ASSAY_ID	ASSAY	PROJECT	PLATE	WELL	WELL_TYPE	RAW_VALUE_A	BSUB_VALUE_A	Z_SCORE_A	RAW_VALUE_B	BSUB_VALUE_B	Z_SCORE_B	COMPOSITE_Z	REPRODUCIBILITY	CHEMBANK_ID	VIRTUAL_ID	SMILES
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A01	compound treatment	1.112	-0.042	-0.57	1.246	-0.00871	-0.12	-0.4842	-0.8372	1667682	CBDivE_000001	CCOC(=O)c1c(C)n(c2ccccc2)c3ccc(NS(=O)(=O)c4ccccc4)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A02	compound treatment	1.134	-0.02	-0.27	1.356	0.101	1.38	0.7863	0.5587	1912315	CBDivE_000002	CC(CC(Nc1ccc(Cl)cn1)n2cncn2)n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A03	compound treatment	1.111	-0.043	-0.58	1.273	0.0183	0.25	-0.2334	-0.37	1293498	CBDivE_000003	CCOC(=O)c1c(C)n(c2ccc(C)cc2)c3ccc(O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A04	compound treatment	1.184	0.03	0.41	1.274	0.0193	0.26	0.4726	0.9781	1912316	CBDivE_000004	CC(CC(Nc1ccccn1)n2cncn2)n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A05	compound treatment	1.182	0.028	0.38	1.28	0.0253	0.34	0.5114	0.9989	1912317	CBDivE_000005	Nc1c(OS(=O)(=O)c2ccccc2)c3ccccc3oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A06	compound treatment	1.158	0.00404	0.05	1.277	0.0223	0.3	0.2535	0.8208	1912318	CBDivE_000006	Clc1cccc(c1)N(Cc2ccc(Br)cc2)C(=O)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A07	compound treatment	1.21	0.056	0.76	1.341	0.0863	1.18	1.3666	0.9771	1912319	CBDivE_000007	OC1=C(/C=C/C=C\2/C(=O)c3ccccc3S2(=O)=O)S(=O)(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A08	compound treatment	1.076	-0.078	-1.05	1.361	0.106	1.45	0.2812	0.157	1912320	CBDivE_000008	Clc1ccc(cc1)C(=O)OCNC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A09	compound treatment	1.149	-0.00496	-0.07	1.253	-0.00171	-0.02	-0.0638	-0.9003	1711851	CBDivE_000009	OC(=O)CCCC(=O)c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A10	compound treatment	1.172	0.018	0.24	1.199	-0.0557	-0.76	-0.3651	-0.4577	1912321	CBDivE_000010	[O-][N+](=O)c1cccc(c1)C(=O)OCNC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A11	compound treatment	1.139	-0.015	-0.2	1.302	0.0473	0.64	0.3133	0.4637	1626425	CBDivE_000011	OC(=O)C1CC=CCC1C(=O)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A12	compound treatment	1.189	0.035	0.47	1.302	0.0473	0.64	0.7903	0.9883	1366986	CBDivE_000012	Clc1cccc(c1)N(Cc2ccc(Br)cc2)C(=O)COc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A13	compound treatment	1.121	-0.033	-0.44	1.269	0.0143	0.19	-0.1766	-0.3638	1580960	CBDivE_000013	Cc1[nH]c2ccccc2c1C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A14	compound treatment	1.19	0.036	0.49	1.231	-0.0237	-0.32	0.1152	0.1973	1912322	CBDivE_000014	Clc1ccc(C(=O)OCNC(=O)c2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A15	compound treatment	1.132	-0.022	-0.3	1.316	0.0613	0.84	0.3815	0.4302	1726195	CBDivE_000015	CCc1ccc(nc1)C(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A16	compound treatment	1.116	-0.038	-0.51	1.297	0.0423	0.58	0.0457	0.0592	1912323	CBDivE_000016	Clc1ccc(OCC(=O)OCNC(=O)c2ccccc2Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A17	compound treatment	1.129	-0.025	-0.34	1.403	0.148	2.02	1.1918	0.5814	1321024	CBDivE_000017	Cc1ccc(NCCc2ccc(C)nc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A18	compound treatment	1.114	-0.04	-0.54	1.244	-0.0107	-0.15	-0.4844	-0.8674	1912324	CBDivE_000018	Clc1cccc(c1)N(Cc2ccc(Cl)cc2Cl)C(=O)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A19	compound treatment	1.177	0.023	0.31	1.267	0.0123	0.17	0.3383	0.958	1407105	CBDivE_000019	CC(NC(=S)c1ccncc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	A20	compound treatment	1.157	0.00304	0.04	1.221	-0.0337	-0.46	-0.296	-0.6415	1774985	CBDivE_000020	[O-][N+](=O)c1cccc(c1)C(=O)N(Cc2ccc(Cl)cc2Cl)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B01	compound treatment	1.098	-0.056	-0.75	1.203	-0.0517	-0.71	-1.0324	-0.9994	1276281	CBDivE_000021	Cc1ccc(C2=C(C#N)C(=C(C#N)C3=CCCCC23)N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B02	compound treatment	1.148	-0.00596	-0.08	1.301	0.0463	0.63	0.3895	0.6121	1912325	CBDivE_000022	CC(=O)Nc1cc(NC(=O)C)c(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B03	compound treatment	1.156	0.00204	0.03	1.234	-0.0207	-0.28	-0.1802	-0.6352	1325219	CBDivE_000023	CCOCc1c(C)cc(C)c(C=C(C#N)C#N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B04	compound treatment	1.173	0.019	0.26	1.286	0.0313	0.43	0.4834	0.9705	1912326	CBDivE_000024	CCOC(=O)C(C#N)C(=O)c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B05	compound treatment	1.188	0.034	0.46	1.321	0.0663	0.9	0.9639	0.9507	1912327	CBDivE_000025	CCOCc1c(C)cc(C)c(/C=C(\C#N)/C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B06	compound treatment	1.182	0.028	0.38	1.229	-0.0257	-0.35	0.0196	0.038	1912328	CBDivE_000026	CC(=O)Nc1ccc(/C=C/c2ccc(NC(=O)C)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B07	compound treatment	1.222	0.068	0.92	1.223	-0.0317	-0.43	0.3433	0.3384	1912329	CBDivE_000027	Cc1cc(C)c(C=C(C#N)C#N)c(C)c1CCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B08	compound treatment	1.138	-0.016	-0.22	1.247	-0.00771	-0.11	-0.2266	-0.9456	1912330	CBDivE_000028	OS(=O)(=O)c1cc(ccc1/C=C(\Br)/c2ccc(cc2S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B09	compound treatment	1.162	0.00804	0.11	1.249	-0.00571	-0.08	0.0217	0.1622	1140984	CBDivE_000029	CCOC(=O)C1=C(N)OC2=C(C1c3ccc(C)cc3C)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B10	compound treatment	1.113	-0.041	-0.55	1.292	0.0373	0.51	-0.0311	-0.0415	1912331	CBDivE_000030	COS(=O)(=O)c1cc(ccc1C#Cc2ccc(cc2S(=O)(=O)OC)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B11	compound treatment	1.169	0.015	0.2	1.201	-0.0537	-0.73	-0.3744	-0.4926	1322577	CBDivE_000031	Cc1cc(C)c(C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B12	compound treatment	1.151	-0.00296	-0.04	1.212	-0.0427	-0.58	-0.44	-0.7538	1624451	CBDivE_000032	CCNc1ccc(N)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B13	compound treatment	1.181	0.027	0.36	1.287	0.0323	0.44	0.5693	0.9956	1912332	CBDivE_000033	Cc1ccc(/C=C(\C#N)/C(=O)N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B14	compound treatment	1.14	-0.014	-0.19	1.228	-0.0267	-0.36	-0.3907	-0.9529	1513257	CBDivE_000034	CC(=O)Nc1ccc(cc1)C(=O)CC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B15	compound treatment	1.164	0.01	0.14	1.267	0.0123	0.17	0.2143	0.9944	1912333	CBDivE_000035	Cc1cc(C)c(/C=C(\C#N)/C(=O)N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B16	compound treatment	1.167	0.013	0.18	1.236	-0.0187	-0.26	-0.056	-0.1807	1912334	CBDivE_000036	CC(=O)Nc1ccc(cc1)c2n[nH]c(N)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B17	compound treatment	1.166	0.012	0.16	1.29	0.0353	0.48	0.4552	0.8961	1912335	CBDivE_000037	CCOC(=O)/C(=C\c1c(C)cc(C)c(CCl)c1C)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B18	compound treatment	1.133	-0.021	-0.28	1.169	-0.0857	-1.17	-1.0264	-0.8536	1912336	CBDivE_000038	CCN(CC)c1ccc(/N=C/c2ccc(cc2S(=O)(=O)O)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B19	compound treatment	1.155	0.00104	0.01	1.268	0.0133	0.18	0.1381	0.7596	1912337	CBDivE_000039	CCc1cc(CC)c(/C=C(\C#N)/C(=O)N)c(CC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	B20	compound treatment	1.087	-0.067	-0.9	1.217	-0.0377	-0.51	-1.0023	-0.9643	1077410	CBDivE_000040	Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C01	compound treatment	1.098	-0.056	-0.75	1.248	-0.00671	-0.09	-0.5985	-0.787	1540707	CBDivE_000041	CC(NC(=O)c1ccccn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C02	compound treatment	1.114	-0.04	-0.54	1.306	0.0513	0.7	0.1134	0.1284	1912338	CBDivE_000042	Clc1cccc(c1)N(Cc2ccc(Cl)cc2Cl)C(=O)COc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C03	compound treatment	1.152	-0.00196	-0.03	1.268	0.0133	0.18	0.1095	0.5977	1163732	CBDivE_000043	O=C(NCc1ccccc1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C04	compound treatment	1.186	0.032	0.43	1.296	0.0413	0.56	0.7038	0.9915	1912339	CBDivE_000044	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N(Cc2ccc(Cl)cc2Cl)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C05	compound treatment	1.162	0.00804	0.11	1.315	0.0603	0.82	0.6581	0.7935	1367021	CBDivE_000045	Cc1ccc(CCNc2ccccc2C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C06	compound treatment	1.175	0.021	0.28	1.28	0.0253	0.34	0.4446	0.9953	1912340	CBDivE_000046	COc1ccc(NCc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C07	compound treatment	1.171	0.017	0.23	1.298	0.0433	0.59	0.58	0.9155	1912341	CBDivE_000047	Cc1ccc(CCN(N=O)c2ccccc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C08	compound treatment	1.115	-0.039	-0.53	1.248	-0.00671	-0.09	-0.4363	-0.8179	1690656	CBDivE_000048	COc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C09	compound treatment	1.194	0.04	0.54	1.273	0.0183	0.25	0.5583	0.9384	1872862	CBDivE_000049	Cc1ccc(CCNc2ccccc2)c[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C10	compound treatment	1.126	-0.028	-0.38	1.288	0.0333	0.45	0.0543	0.092	1176797	CBDivE_000050	COc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C11	compound treatment	1.129	-0.025	-0.34	1.241	-0.0137	-0.19	-0.3703	-0.9614	1912342	CBDivE_000051	CC/C(=N\O)/c1c(C)n(C)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C12	compound treatment	1.169	0.015	0.2	1.245	-0.00971	-0.13	0.0499	0.2058	1668788	CBDivE_000052	COc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C13	compound treatment	1.188	0.034	0.46	1.302	0.0473	0.64	0.7807	0.9862	1912343	CBDivE_000053	CCCC/C(=N/O)/c1c(C)[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C14	compound treatment	1.142	-0.012	-0.16	1.276	0.0213	0.29	0.0912	0.2746	1912344	CBDivE_000054	COc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)COc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C15	compound treatment	1.168	0.014	0.19	1.237	-0.0177	-0.24	-0.0368	-0.12	1912345	CBDivE_000055	O/N=C(\Cc1ccccc1)/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C16	compound treatment	1.114	-0.04	-0.54	1.28	0.0253	0.34	-0.1373	-0.2146	1912346	CBDivE_000056	[O-][N+](=O)c1ccc(/C=N\C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C17	compound treatment	1.161	0.00704	0.09	1.292	0.0373	0.51	0.4267	0.8249	1912347	CBDivE_000057	Cn1cc(/C(=N/O)/Cc2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C18	compound treatment	1.173	0.019	0.26	1.251	-0.00371	-0.05	0.1459	0.5572	1912348	CBDivE_000058	CC1(C)C2C1(C)N=NC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C19	compound treatment	1.19	0.036	0.49	1.257	0.00229	0.03	0.3659	0.751	1402147	CBDivE_000059	Cc1c(C)c2ccccc2n1CCc3ccc(C)nc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	C20	compound treatment	1.174	0.02	0.27	1.252	-0.00271	-0.04	0.1651	0.6049	1912349	CBDivE_000060	OC(=O)/C=C/C(=O)Nc1cccc(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D01	compound treatment	1.174	0.02	0.27	1.207	-0.0477	-0.65	-0.2689	-0.3816	1912350	CBDivE_000061	[O-][N+](=O)c1cccc(/C=N/N=C\c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D02	compound treatment	1.141	-0.013	-0.17	1.249	-0.00571	-0.08	-0.1787	-0.9336	1912351	CBDivE_000062	[O-][N+](=O)c1ccc(cc1)C23OC3(c4ccccc4C2=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D03	compound treatment	1.207	0.053	0.72	1.282	0.0273	0.37	0.7691	0.9536	1399625	CBDivE_000063	Oc1ccccc1C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D04	compound treatment	1.173	0.019	0.26	1.214	-0.0407	-0.56	-0.2109	-0.3448	1912352	CBDivE_000064	CCOC(=O)OCCNC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D05	compound treatment	1.245	0.091	1.23	1.29	0.0353	0.48	1.2088	0.9163	1470239	CBDivE_000065	COc1ccc(cc1)C(=O)COC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D06	compound treatment	1.162	0.00804	0.11	1.225	-0.0297	-0.41	-0.2098	-0.5002	1625895	CBDivE_000066	CCN(C(=O)c1cc2ccccc2oc1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D07	compound treatment	1.196	0.042	0.57	1.277	0.0223	0.3	0.616	0.9573	1912353	CBDivE_000067	CC(=N/N=C/c1cccc(c1)[N+](=O)[O-])C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D08	compound treatment	1.133	-0.021	-0.28	1.301	0.0463	0.63	0.2464	0.3563	1912354	CBDivE_000068	CCCC/N=C(/C)\c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D09	compound treatment	1.19	0.036	0.49	1.192	-0.0627	-0.86	-0.2609	-0.2652	1912355	CBDivE_000069	COC(=O)c1cccc(NP(=S)C(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D10	compound treatment	1.157	0.00304	0.04	1.214	-0.0407	-0.56	-0.3635	-0.6531	1040327	CBDivE_000070	CC(=O)Nc1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D11	compound treatment	1.183	0.029	0.39	1.279	0.0243	0.33	0.5113	0.9965	1175161	CBDivE_000071	O=P(CCN1CCOCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D12	compound treatment	1.153	-9.59E-4	-0.01	1.274	0.0193	0.26	0.1769	0.6715	1492398	CBDivE_000072	O=c1oc2ccccc2cc1c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D13	compound treatment	1.213	0.059	0.8	1.275	0.0203	0.28	0.7589	0.9	1242454	CBDivE_000073	CCP(=O)(CCN1CCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D14	compound treatment	1.157	0.00304	0.04	1.211	-0.0437	-0.6	-0.3924	-0.6569	1401969	CBDivE_000074	Brc1ccccc1NC(=O)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D15	compound treatment	1.199	0.045	0.61	1.264	0.00929	0.13	0.5192	0.8366	1912356	CBDivE_000075	CCP(=O)(CCN1CCCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D16	compound treatment	1.136	-0.018	-0.24	1.251	-0.00371	-0.05	-0.2071	-0.8367	1634555	CBDivE_000076	Cc1cccc(NC(=O)c2cc3ccccc3oc2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D17	compound treatment	1.186	0.032	0.43	1.232	-0.0227	-0.31	0.0867	0.163	1912357	CBDivE_000077	CC(C)COP(=O)(Nc1cccc(c1)C(F)(F)F)OCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D18	compound treatment	1.175	0.021	0.28	1.27	0.0153	0.21	0.3482	0.9885	1912358	CBDivE_000078	[O-][N+](=O)c1ccccc1NC(=O)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D19	compound treatment	1.185	0.031	0.42	1.259	0.00429	0.06	0.3375	0.7982	1912359	CBDivE_000079	CC(C)COP(=O)(Nc1cccc(F)c1)OCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	D20	compound treatment	1.088	-0.066	-0.89	1.257	0.00229	0.03	-0.6071	-0.6819	1189884	CBDivE_000080	O=C(N(c1ccccc1)c2ccccc2)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E01	compound treatment	1.137	-0.017	-0.23	1.295	0.0403	0.55	0.2267	0.3809	1048234	CBDivE_000081	Cc1[nH]c2ccc(cc2c1C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E02	compound treatment	1.176	0.022	0.3	1.245	-0.00971	-0.13	0.1166	0.3584	1365538	CBDivE_000082	Ic1ccccc1N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E03	compound treatment	1.159	0.00504	0.07	1.25	-0.00471	-0.06	0.0027	0.0287	1912360	CBDivE_000083	C(=N/c1ccccc1\N=C\c2c[nH]c3ccccc23)\c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E04	compound treatment	1.169	0.015	0.2	1.263	0.00829	0.11	0.2234	0.9619	1114305	CBDivE_000084	Cc1ccc(NN=Nc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E05	compound treatment	1.095	-0.059	-0.8	1.274	0.0193	0.26	-0.3764	-0.4493	1026134	CBDivE_000085	O=C(c1cc2ccccc2o1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E06	compound treatment	1.157	0.00304	0.04	1.35	0.0953	1.3	0.9478	0.7291	1671488	CBDivE_000086	Cc1ccc(cc1)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E07	compound treatment	1.169	0.015	0.2	1.263	0.00829	0.11	0.2234	0.9619	1912361	CBDivE_000087	O=C(c1coc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E08	compound treatment	1.17	0.016	0.22	1.343	0.0883	1.2	1.0044	0.821	1912362	CBDivE_000088	CC1(OC2C=C1)C3C2C(=O)N(C3=O)c4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E09	compound treatment	1.132	-0.022	-0.3	1.284	0.0293	0.4	0.073	0.1467	1912363	CBDivE_000089	C/C(=N\O)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E10	compound treatment	1.122	-0.032	-0.43	1.368	0.113	1.54	0.7875	0.491	1571364	CBDivE_000090	Clc1ccc(cc1Cl)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E11	compound treatment	1.144	-0.00996	-0.13	1.334	0.0793	1.08	0.6696	0.6145	1041400	CBDivE_000091	CN(C(=O)c1ccco1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E12	compound treatment	1.167	0.013	0.18	1.239	-0.0157	-0.21	-0.0271	-0.0977	1507633	CBDivE_000092	Fc1cccc(NC(CC(=O)c2ccccc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E13	compound treatment	1.147	-0.00696	-0.09	1.29	0.0353	0.48	0.2739	0.5586	1003767	CBDivE_000093	O=C1N(Cc2ccccc2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E14	compound treatment	1.074	-0.08	-1.08	1.263	0.00829	0.11	-0.6828	-0.6295	1912364	CBDivE_000094	O=C1CS/C(=N\c2ccccc2)/N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E15	compound treatment	1.169	0.015	0.2	1.357	0.102	1.39	1.1298	0.8015	1912365	CBDivE_000095	OC(=O)c1ccc2C3c4ccccc4C(c5ccccc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E16	compound treatment	1.185	0.031	0.42	1.284	0.0293	0.4	0.5785	0.9997	1774344	CBDivE_000096	COc1cccc(/C=C/C2=NN(C(C2)c3cccc(OC)c3OC)c4ccccc4F)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E17	compound treatment	1.228	0.074	1.0	1.296	0.0413	0.56	1.1044	0.9632	1912366	CBDivE_000097	NC(=O)c1ccc2C3c4ccccc4C(c5ccccc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E18	compound treatment	1.166	0.012	0.16	1.291	0.0363	0.49	0.4648	0.8924	1663594	CBDivE_000098	CC(O)Cn1c2ccccc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E19	compound treatment	1.111	-0.043	-0.58	1.285	0.0303	0.41	-0.1177	-0.1654	1912367	CBDivE_000099	COC(=O)c1ccc2C3c4ccccc4C(c5ccccc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	E20	compound treatment	1.146	-0.00796	-0.11	1.29	0.0353	0.48	0.2644	0.5362	1435727	CBDivE_000100	O=C1C2C(C3c4ccccc4C2c5ccccc35)C(=O)N1Cc6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F01	compound treatment	1.132	-0.022	-0.3	1.244	-0.0107	-0.15	-0.3127	-0.9469	1912368	CBDivE_000101	CCOP(=O)(Nc1ccc(Br)cc1)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F02	compound treatment	1.177	0.023	0.31	1.23	-0.0247	-0.34	-0.0185	-0.0403	1912369	CBDivE_000102	C/C(=N/CCO)/c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F03	compound treatment	1.159	0.00504	0.07	1.257	0.00229	0.03	0.0702	0.9378	1912370	CBDivE_000103	CC(C)COP(=O)(Nc1ccc(Br)cc1)OCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F04	compound treatment	1.187	0.033	0.45	1.222	-0.0327	-0.45	-2.0E-4	-3.0E-4	1690525	CBDivE_000104	O=C(c1cc2ccccc2oc1=O)n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F05	compound treatment	1.137	-0.017	-0.23	1.206	-0.0487	-0.66	-0.6314	-0.8988	1397588	CBDivE_000105	CC(C)P(Nc1ccc(C)cn1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F06	compound treatment	1.153	-9.59E-4	-0.01	1.26	0.00529	0.07	0.0419	0.5712	1353446	CBDivE_000106	Cc1ccc2c(CC(=O)O)cc(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F07	compound treatment	1.16	0.00604	0.08	1.259	0.00429	0.06	0.099	0.9868	1112072	CBDivE_000107	[O-][N+](=O)c1ccc(NCc2ccccc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F08	compound treatment	1.189	0.035	0.47	1.334	0.0793	1.08	1.0988	0.9312	1116092	CBDivE_000108	Oc1c([N+](=O)[O-])c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F09	compound treatment	1.145	-0.00896	-0.12	1.25	-0.00471	-0.06	-0.1309	-0.9562	1912371	CBDivE_000109	CCOP(=O)(OCC)C(Nc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F10	compound treatment	1.187	0.033	0.45	1.228	-0.0267	-0.36	0.0577	0.1002	1912372	CBDivE_000110	O=C(OCC1CC2CC1C=C2)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F11	compound treatment	1.175	0.021	0.28	1.271	0.0163	0.22	0.3578	0.9926	1912373	CBDivE_000111	C[n+]1ccn2cccc2c1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F12	compound treatment	1.091	-0.063	-0.85	1.249	-0.00571	-0.08	-0.6556	-0.7687	1701036	CBDivE_000112	CC(=N)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F13	compound treatment	1.185	0.031	0.42	1.185	-0.0697	-0.95	-0.3761	-0.362	1912374	CBDivE_000113	CC1=[N+](CC(=O)c2ccccc2)CCn3c(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F14	compound treatment	1.148	-0.00596	-0.08	1.238	-0.0167	-0.23	-0.218	-0.9021	1912375	CBDivE_000114	CC(=O)CC(c1ccccc1)c2c(OC(=O)C)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F15	compound treatment	1.204	0.05	0.68	1.191	-0.0637	-0.87	-0.1369	-0.1245	1912376	CBDivE_000115	Cc1ccc2c(C)[n+](CC(=O)c3ccccc3)ccn12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F16	compound treatment	1.172	0.018	0.24	1.247	-0.00771	-0.11	0.0978	0.3688	1243974	CBDivE_000116	COC(=O)Oc1c(Br)c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F17	compound treatment	1.174	0.02	0.27	1.24	-0.0147	-0.2	0.0493	0.1466	1912377	CBDivE_000117	COC(=O)C[n+]1ccn2c(C)ccc2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F18	compound treatment	1.12	-0.034	-0.46	1.196	-0.0587	-0.8	-0.89	-0.9649	1912378	CBDivE_000118	CCOP(=O)(OCC)C1C(C(=O)C)C(=O)Oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F19	compound treatment	1.186	0.032	0.43	1.243	-0.0117	-0.16	0.1927	0.4183	1912379	CBDivE_000119	Cc1[n+](CC(=O)c2ccccc2)ccn3cccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	F20	compound treatment	1.157	0.00304	0.04	1.187	-0.0677	-0.92	-0.6239	-0.675	1698018	CBDivE_000120	Cc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G01	compound treatment	1.117	-0.037	-0.5	1.208	-0.0467	-0.64	-0.8029	-0.9927	1912380	CBDivE_000121	[O-][N+](=O)c1ccc2C3c4ccccc4C(c5ccc(cc35)[N+](=O)[O-])c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G02	compound treatment	1.156	0.00204	0.03	1.297	0.0423	0.58	0.4273	0.74	1912381	CBDivE_000122	Fc1ccccc1N2N=C(CC2c3ccc(Br)cc3)/C=C/c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G03	compound treatment	1.085	-0.069	-0.93	1.252	-0.00271	-0.04	-0.6839	-0.7346	1018022	CBDivE_000123	OCC1C(CO)C2c3ccccc3C1c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G04	compound treatment	1.175	0.021	0.28	1.288	0.0333	0.45	0.5217	0.9744	1912382	CBDivE_000124	[O-][N+](=O)c1cccc(/C=C\2/S\C(=N/c3ccccc3)\N(C2=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G05	compound treatment	1.177	0.023	0.31	1.294	0.0393	0.54	0.5987	0.9665	1174891	CBDivE_000125	OC(=O)C1CC(=C(CC1C(=O)c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G06	compound treatment	1.115	-0.039	-0.53	1.339	0.0843	1.15	0.4411	0.349	1912383	CBDivE_000126	Cc1ccccc1N2C(=O)C3C(N4C5C(C(N4C3C2=O)c6ccccc6)C(=O)N(C5=O)c7ccccc7C)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G07	compound treatment	1.178	0.024	0.32	1.299	0.0443	0.6	0.6564	0.9575	1912384	CBDivE_000127	CC(NC(=O)/C=C/c1ccco1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G08	compound treatment	1.14	-0.014	-0.19	1.388	0.133	1.82	1.1521	0.6305	1912385	CBDivE_000128	COc1ccccc1N2C(=O)C3C(N4C5C(C(N4C3C2=O)c6ccccc6)C(=O)N(C5=O)c7ccccc7OC)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G09	compound treatment	1.171	0.017	0.23	1.26	0.00529	0.07	0.2136	0.8864	1912386	CBDivE_000129	CC(NC(=O)/C=C/C(=O)O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G10	compound treatment	1.093	-0.061	-0.82	1.272	0.0173	0.24	-0.4148	-0.4848	1774773	CBDivE_000130	COc1ccc(cc1)N2C(=O)C3C(C4c5ccc(cc5C3c6ccc(cc46)C(C)(C)C)C(C)(C)C)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G11	compound treatment	1.17	0.016	0.22	1.295	0.0403	0.55	0.5415	0.917	1912387	CBDivE_000131	CCOC(=O)CNC(=O)NC(C)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G12	compound treatment	1.17	0.016	0.22	1.318	0.0633	0.86	0.7633	0.8578	1912388	CBDivE_000132	[O-][N+](=O)c1ccc(Cl)c(C[n+]2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G13	compound treatment	1.202	0.048	0.65	1.288	0.0333	0.45	0.7793	0.9848	1912389	CBDivE_000133	Cc1cc(C)c(Br)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G14	compound treatment	1.114	-0.04	-0.54	1.233	-0.0217	-0.3	-0.5905	-0.9602	1912390	CBDivE_000134	[O-][N+](=O)c1ccc(Cl)c(CN2C=Cc3ccccc3C2C(Br)(Br)Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G15	compound treatment	1.129	-0.025	-0.34	1.287	0.0323	0.44	0.0733	0.1322	1912391	CBDivE_000135	COC(=O)c1cc(C)c(Br)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G16	compound treatment	1.179	0.025	0.34	1.317	0.0623	0.85	0.8395	0.9184	1709102	CBDivE_000136	CC(=O)NC1(C)CCC2(C)CC1(C)C(=NC2(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G17	compound treatment	1.188	0.034	0.46	1.323	0.0683	0.93	0.9832	0.9469	1912392	CBDivE_000137	CC(Cc1ccccc1)NC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G18	compound treatment	1.129	-0.025	-0.34	1.302	0.0473	0.64	0.2179	0.2995	1912393	CBDivE_000138	CC(C)OP(=O)(Nc1ccc(Br)cc1)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G19	compound treatment	1.127	-0.027	-0.36	1.333	0.0783	1.07	0.4977	0.4413	1912394	CBDivE_000139	CCOC(=O)CNC(=O)NC(C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	G20	compound treatment	1.177	0.023	0.31	1.301	0.0463	0.63	0.6662	0.9467	1912395	CBDivE_000140	CC(C)OP(=O)(Nc1nc2ccccc2[nH]1)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H01	compound treatment	1.11	-0.044	-0.59	1.226	-0.0287	-0.39	-0.6962	-0.9797	1912396	CBDivE_000141	CCc1[n+](CC(=O)c2ccccc2)ccn3c(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H02	compound treatment	1.126	-0.028	-0.38	1.211	-0.0437	-0.6	-0.6882	-0.9756	1912397	CBDivE_000142	CCOC(=O)/C=C(\C)/Sc1cc(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H03	compound treatment	1.185	0.031	0.42	1.297	0.0423	0.58	0.7039	0.9876	1912398	CBDivE_000143	O=C(C[N+]1=C(c2cccn2CC1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H04	compound treatment	1.17	0.016	0.22	1.386	0.131	1.79	1.419	0.7868	1037734	CBDivE_000144	CCOC(=O)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H05	compound treatment	1.153	-9.59E-4	-0.01	1.227	-0.0277	-0.38	-0.2763	-0.7309	1912399	CBDivE_000145	CCCC1=[N+](CC(=O)c2ccccc2)CCn3c(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H06	compound treatment	1.132	-0.022	-0.3	1.243	-0.0117	-0.16	-0.3224	-0.9579	1350777	CBDivE_000146	CCC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H07	compound treatment	1.17	0.016	0.22	1.235	-0.0197	-0.27	-0.037	-0.1073	1912400	CBDivE_000147	COC(=O)C[n+]1ccn2cccc2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H08	compound treatment	1.129	-0.025	-0.34	1.255	2.92E-4	0.0	-0.2353	-0.6987	1741129	CBDivE_000148	CCSC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H09	compound treatment	1.199	0.045	0.61	1.166	-0.0887	-1.21	-0.4257	-0.3145	1912401	CBDivE_000149	Cc1ccc2[n+](CC(=O)c3ccccc3)cccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H10	compound treatment	1.155	0.00104	0.01	1.26	0.00529	0.07	0.061	0.8291	1912402	CBDivE_000150	ClCCNC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H11	compound treatment	1.126	-0.028	-0.38	1.186	-0.0687	-0.94	-0.9292	-0.92	1912403	CBDivE_000151	Cc1ccc(cc1)C(=O)C[n+]2cccc3cc(C)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H12	compound treatment	1.133	-0.021	-0.28	1.23	-0.0247	-0.34	-0.4382	-0.9962	1464160	CBDivE_000152	OCCNC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H13	compound treatment	1.179	0.025	0.34	1.277	0.0223	0.3	0.4538	0.9986	1912404	CBDivE_000153	C[n+]1cccc2cc(O)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H14	compound treatment	1.142	-0.012	-0.16	1.233	-0.0217	-0.3	-0.3234	-0.9593	1436055	CBDivE_000154	Oc1c(Sc2ccccc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H15	compound treatment	1.175	0.021	0.28	1.243	-0.0117	-0.16	0.0878	0.2696	1060581	CBDivE_000155	COc1ccc2[n+](C)cccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H16	compound treatment	1.149	-0.00496	-0.07	1.219	-0.0357	-0.49	-0.3916	-0.7968	1367668	CBDivE_000156	O=C(OCc1ccc2OCOc2c1)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H17	compound treatment	1.175	0.021	0.28	1.259	0.00429	0.06	0.2421	0.8353	1024872	CBDivE_000157	COc1ccc2[n+](CC(=O)c3ccccc3)cccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H18	compound treatment	1.153	-9.59E-4	-0.01	1.213	-0.0417	-0.57	-0.4113	-0.723	1461555	CBDivE_000158	O=C(Nc1ccc(cc1)c2ccccc2)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H19	compound treatment	1.219	0.065	0.88	1.231	-0.0237	-0.32	0.3918	0.419	1912405	CBDivE_000159	COc1ccc2[n+](CC(=O)c3ccc(C)cc3)cccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	H20	compound treatment	1.124	-0.03	-0.4	1.248	-0.00671	-0.09	-0.3505	-0.8458	1912406	CBDivE_000160	Brc1ccc(/C=N/n2cnnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I01	compound treatment	1.149	-0.00496	-0.07	1.285	0.0303	0.41	0.2448	0.585	1912407	CBDivE_000161	Clc1ccc(cc1)N2N=CCC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I02	compound treatment	1.159	0.00504	0.07	1.266	0.0113	0.15	0.157	0.9325	1912408	CBDivE_000162	CCN(CC)P(=O)(OC(C)C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I03	compound treatment	1.158	0.00404	0.05	1.305	0.0503	0.69	0.5235	0.7609	1501968	CBDivE_000163	NC(=S)N1CCC(=N1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I04	compound treatment	1.161	0.00704	0.09	1.339	0.0843	1.15	0.8799	0.7629	1912409	CBDivE_000164	C/C(=N\OCO\N=C(\C)/c1ccccc1Cl)/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I05	compound treatment	1.103	-0.051	-0.69	1.285	0.0303	0.41	-0.194	-0.2419	1293966	CBDivE_000165	Cc1nn(Cc2ccccc2)c(C)c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I06	compound treatment	1.155	0.00104	0.01	1.285	0.0303	0.41	0.302	0.7307	1912410	CBDivE_000166	C/C(=N\OCCCl)/C(=N/OCCCl)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I07	compound treatment	1.162	0.00804	0.11	1.268	0.0133	0.18	0.2049	0.9699	1645016	CBDivE_000167	Cc1cc(C)c(N2CCC(=O)N2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I08	compound treatment	1.175	0.021	0.28	1.301	0.0463	0.63	0.6471	0.9349	1912411	CBDivE_000168	[O-][N+](=O)c1ccc(N/N=C/C(=O)c2ccccc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I09	compound treatment	1.115	-0.039	-0.53	1.286	0.0313	0.43	-0.0699	-0.1033	1912412	CBDivE_000169	CC1=NN(C(=O)CC1)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I10	compound treatment	1.168	0.014	0.19	1.215	-0.0397	-0.54	-0.2489	-0.434	1912413	CBDivE_000170	C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccc(C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I11	compound treatment	1.09	-0.064	-0.86	1.263	0.00829	0.11	-0.5302	-0.6092	1312045	CBDivE_000171	Clc1cccc(c1)N2CCC(=O)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I12	compound treatment	1.158	0.00404	0.05	1.295	0.0403	0.55	0.4271	0.7735	1912414	CBDivE_000172	S=C(Nc1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I13	compound treatment	1.1	-0.054	-0.73	1.34	0.0853	1.16	0.3077	0.2242	1654693	CBDivE_000173	CCOC(=O)c1c(C)n(C)c2ccc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I14	compound treatment	1.166	0.012	0.16	1.246	-0.00871	-0.12	0.0309	0.1535	1912415	CBDivE_000174	Cc1cc(C)c(C=C(C#N)C#N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I15	compound treatment	1.195	0.041	0.55	1.261	0.00629	0.09	0.4522	0.807	1148828	CBDivE_000175	CCOC(=O)c1c(C)[nH]c2cc(Br)c(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I16	compound treatment	1.169	0.015	0.2	1.221	-0.0337	-0.46	-0.1816	-0.3613	1912416	CBDivE_000176	CCOC(=O)/C(=C\c1ccc(C)cc1C)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I17	compound treatment	1.098	-0.056	-0.75	1.273	0.0183	0.25	-0.3574	-0.4496	1632149	CBDivE_000177	CC1C(C)c2ccccc2N1NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I18	compound treatment	1.154	4.06E-5	0.0	1.318	0.0633	0.86	0.6107	0.7076	1569390	CBDivE_000178	CCOc1ccc(OCC)c(C=C(C#N)C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I19	compound treatment	1.193	0.039	0.53	1.3	0.0453	0.62	0.8091	0.9969	1912417	CBDivE_000179	CN(NC(=O)COc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	I20	compound treatment	1.174	0.02	0.27	1.257	0.00229	0.03	0.2133	0.7836	1912418	CBDivE_000180	CCOC(=O)/C(=C\c1c(C)cc(C)cc1C)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J01	compound treatment	1.154	4.06E-5	0.0	1.257	0.00229	0.03	0.0225	0.7194	1912419	CBDivE_000181	COc1ccc(cc1)C(=O)C[n+]2cccc3cc(OC)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J02	compound treatment	1.164	0.01	0.14	1.259	0.00429	0.06	0.1372	0.9296	1912420	CBDivE_000182	CC1COP(=O)(O1)C2(CCCCC2)Nn3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J03	compound treatment	1.158	0.00404	0.05	1.123	-0.132	-1.8	-1.2314	-0.6853	1912421	CBDivE_000183	CC(=O)C[n+]1ccc2ccccc2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J04	compound treatment	1.111	-0.043	-0.58	1.232	-0.0227	-0.31	-0.6288	-0.9569	1912422	CBDivE_000184	CCc1ccc(/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J05	compound treatment	1.204	0.05	0.68	1.203	-0.0517	-0.71	-0.0212	-0.0218	1912423	CBDivE_000185	CCc1cc2c(cccc2c[n+]1CC(=O)c3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J06	compound treatment	1.185	0.031	0.42	1.235	-0.0197	-0.27	0.1061	0.2132	1912424	CBDivE_000186	Clc1cccc(Cl)c1/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J07	compound treatment	1.182	0.028	0.38	1.246	-0.00871	-0.12	0.1835	0.4629	1020755	CBDivE_000187	O=C(C[n+]1ccc2ccccc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J08	compound treatment	1.115	-0.039	-0.53	1.224	-0.0307	-0.42	-0.6677	-0.9937	1912425	CBDivE_000188	FC(F)(F)c1cccc(/N=C/c2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J09	compound treatment	1.151	-0.00296	-0.04	1.227	-0.0277	-0.38	-0.2954	-0.7775	1912426	CBDivE_000189	COC(=O)C[n+]1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J10	compound treatment	1.133	-0.021	-0.28	1.237	-0.0177	-0.24	-0.3707	-0.9969	1912427	CBDivE_000190	C(=N/n1cnnc1)\c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J11	compound treatment	1.227	0.073	0.99	1.27	0.0153	0.21	0.8442	0.8382	1912428	CBDivE_000191	C[n+]1ccccc1CCC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J12	compound treatment	1.179	0.025	0.34	1.202	-0.0527	-0.72	-0.2694	-0.3392	1912429	CBDivE_000192	CC(C)OP(=O)(OC(C)C)C(NS(=O)(=O)c1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J13	compound treatment	1.166	0.012	0.16	1.213	-0.0417	-0.57	-0.2873	-0.4857	1170792	CBDivE_000193	COc1ccc(cc1)c2cc3c4cccn4ccn3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J14	compound treatment	1.155	0.00104	0.01	1.184	-0.0707	-0.96	-0.6719	-0.6967	1912430	CBDivE_000194	Clc1cc(Cl)cc(/N=C/c2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J15	compound treatment	1.141	-0.013	-0.17	1.235	-0.0197	-0.27	-0.3137	-0.9783	1912431	CBDivE_000195	c1cc2c3cc(cn3ccn2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J16	compound treatment	1.142	-0.012	-0.16	1.217	-0.0377	-0.51	-0.4777	-0.8864	1912432	CBDivE_000196	CC1CCOP(=O)(O1)C(NS(=O)(=O)c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J17	compound treatment	1.163	0.00904	0.12	1.229	-0.0257	-0.35	-0.1617	-0.4355	1529931	CBDivE_000197	CC(C)NC(=O)CCc1c(C)[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J18	compound treatment	1.162	0.00804	0.11	1.208	-0.0467	-0.64	-0.3737	-0.5784	1912433	CBDivE_000198	CC1COP(=O)(O1)C(NS(=O)(=O)c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J19	compound treatment	1.135	-0.019	-0.26	1.236	-0.0187	-0.26	-0.3613	-1.0	1559545	CBDivE_000199	Cc1[nH]c2ccccc2c1CCC(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	J20	compound treatment	1.109	-0.045	-0.61	1.218	-0.0367	-0.5	-0.7828	-0.9955	1912434	CBDivE_000200	CC1OP(=O)(OC1C)C(NS(=O)(=O)c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K01	compound treatment	1.099	-0.055	-0.74	1.259	0.00429	0.06	-0.4829	-0.6493	1912435	CBDivE_000201	O=C(Cc1ccccc1)NN(Cc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K02	compound treatment	1.166	0.012	0.16	1.203	-0.0517	-0.71	-0.3837	-0.5303	1912436	CBDivE_000202	Cc1cc(C)c(/C=N/NC(=O)N)c(C)c1/C=N/NC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K03	compound treatment	1.129	-0.025	-0.34	0.705	-0.55	-7.5	-5.5386	-0.7381	1912437	CBDivE_000203	Clc1cccc(NNC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K04	compound treatment	1.145	-0.00896	-0.12	1.221	-0.0337	-0.46	-0.4105	-0.8637	1912438	CBDivE_000204	CCOC(=O)/C(=C\c1cc(OCC)ccc1OCC)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K05	compound treatment	1.156	0.00204	0.03	1.342	0.0873	1.19	0.8612	0.7233	1009868	CBDivE_000205	O=C(Cc1ccccc1)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K06	compound treatment	1.18	0.026	0.35	1.276	0.0213	0.29	0.4537	0.9955	1912439	CBDivE_000206	Cc1ccc(/C=C/C(=N\NC(=O)N)/c2cccs2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K07	compound treatment	1.198	0.044	0.59	1.278	0.0233	0.32	0.6447	0.957	1912440	CBDivE_000207	CC(C)(C)C(=O)NNCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K08	compound treatment	1.127	-0.027	-0.36	1.258	0.00329	0.04	-0.2254	-0.6152	1912441	CBDivE_000208	CCOc1ccc(OCC)c(c1)C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K09	compound treatment	1.161	0.00704	0.09	1.264	0.00929	0.13	0.1568	0.9899	1912442	CBDivE_000209	CCC(=O)NN(Cc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K10	compound treatment	1.182	0.028	0.38	1.315	0.0603	0.82	0.8488	0.9379	1182413	CBDivE_000210	CCOc1ccc(OCC)c(c1)C2C3CCC=C3C(=C(N)C2(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K11	compound treatment	1.195	0.041	0.55	1.272	0.0173	0.24	0.5582	0.9276	1912443	CBDivE_000211	CC1Cc2ccccc2N1C(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K12	compound treatment	1.154	4.06E-5	0.0	1.248	-0.00671	-0.09	-0.0643	-0.7029	1643536	CBDivE_000212	CCOc1ccc(OCC)c(c1)C2C3CCCC=C3C(=C(N)C2(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K13	compound treatment	1.203	0.049	0.66	1.244	-0.0107	-0.15	0.3646	0.5381	1593695	CBDivE_000213	C[C@@H](Cc1ccccc1)NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K14	compound treatment	1.162	0.00804	0.11	1.277	0.0223	0.3	0.2916	0.9036	1912444	CBDivE_000214	CCOc1ccc(OCC)c(/C=C/C(=O)c2cccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K15	compound treatment	1.188	0.034	0.46	1.223	-0.0317	-0.43	0.019	0.0301	1912445	CBDivE_000215	C[C@@H](Cc1ccccc1)NC(=O)CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K16	compound treatment	1.146	-0.00796	-0.11	1.214	-0.0407	-0.56	-0.4685	-0.8285	1315506	CBDivE_000216	CCOC(=O)C1=C(N)OC2=C(C1c3cc(OCC)ccc3OCC)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K17	compound treatment	1.116	-0.038	-0.51	1.298	0.0433	0.59	0.0553	0.0708	1912446	CBDivE_000217	C[C@H](NC(=O)Cc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K18	compound treatment	1.139	-0.015	-0.2	1.249	-0.00571	-0.08	-0.1977	-0.9142	1912447	CBDivE_000218	Cc1c(C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N)c(C)c([N+](=O)[O-])c(C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K19	compound treatment	1.086	-0.068	-0.92	1.285	0.0303	0.41	-0.3562	-0.3542	1236173	CBDivE_000219	C[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	K20	compound treatment	1.152	-0.00196	-0.03	1.29	0.0353	0.48	0.3216	0.6673	1912448	CBDivE_000220	Cc1c(C2C(=C(N)SC(=C2C#N)N)C#N)c(C)c([N+](=O)[O-])c(C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L01	compound treatment	1.143	-0.011	-0.15	1.298	0.0433	0.59	0.3129	0.5141	1345446	CBDivE_000221	Cc1[nH]c2ccc(C)cc2c1CCC(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L02	compound treatment	1.147	-0.00696	-0.09	1.259	0.00429	0.06	-0.025	-0.226	1912449	CBDivE_000222	C/C(=N\Nc1ccccc1)/CC(=O)n2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L03	compound treatment	1.164	0.01	0.14	1.245	-0.00971	-0.13	0.0022	0.0114	1912450	CBDivE_000223	Cc1[nH]c2ccccc2c1CCCNC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L04	compound treatment	1.153	-9.59E-4	-0.01	1.238	-0.0167	-0.23	-0.1703	-0.7461	1912451	CBDivE_000224	C/C(=N\Nc1ccccc1)/CC(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L05	compound treatment	1.245	0.091	1.23	1.213	-0.0417	-0.57	0.4663	0.3445	1912452	CBDivE_000225	CCOC(=O)c1c(C)n(C)c2cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L06	compound treatment	1.181	0.027	0.36	1.228	-0.0267	-0.36	4.0E-4	8.0E-4	1912453	CBDivE_000226	CCC1CCCCN1C(=O)C/C(=N/Nc2ccccc2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L07	compound treatment	1.224	0.07	0.94	1.288	0.0333	0.45	0.9892	0.9436	1642690	CBDivE_000227	CCOC(=O)c1c(C)n(C)c2ccc(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L08	compound treatment	1.205	0.051	0.69	1.203	-0.0517	-0.71	-0.0117	-0.0119	1013152	CBDivE_000228	O=C(C1C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L09	compound treatment	1.126	-0.028	-0.38	1.267	0.0123	0.17	-0.1482	-0.359	1912454	CBDivE_000229	N#CCCC12CCCCC2=Nc3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L10	compound treatment	1.128	-0.026	-0.35	1.255	2.92E-4	0.0	-0.2448	-0.699	1146554	CBDivE_000230	OCC1(C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L11	compound treatment	1.094	-0.06	-0.81	1.28	0.0253	0.34	-0.3281	-0.3731	1912455	CBDivE_000231	COc1ccc(/C=C/[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L12	compound treatment	1.1	-0.054	-0.73	1.255	2.92E-4	0.0	-0.5119	-0.7032	1912456	CBDivE_000232	COc1ccc(C=C2C(=O)c3ccccc3C2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L13	compound treatment	1.179	0.025	0.34	1.275	0.0203	0.28	0.4345	0.9951	1912457	CBDivE_000233	[O-][N+](=O)c1ccccc1CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L14	compound treatment	1.076	-0.078	-1.05	1.244	-0.0107	-0.15	-0.8469	-0.7976	1028672	CBDivE_000234	O=C1C(C(=O)c2ccccc12)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L15	compound treatment	1.171	0.017	0.23	1.227	-0.0277	-0.38	-0.1046	-0.2365	1265927	CBDivE_000235	COc1ccc(CNN)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L16	compound treatment	1.086	-0.068	-0.92	1.21	-0.0447	-0.61	-1.0794	-0.9804	1115603	CBDivE_000236	Oc1ccc(cc1)C2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L17	compound treatment	1.152	-0.00196	-0.03	1.248	-0.00671	-0.09	-0.0834	-0.8756	1009232	CBDivE_000237	CCCC(=O)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L18	compound treatment	1.13	-0.024	-0.32	1.249	-0.00571	-0.08	-0.2836	-0.853	1483037	CBDivE_000238	OC(=O)CC1(C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L19	compound treatment	1.185	0.031	0.42	1.197	-0.0577	-0.79	-0.2603	-0.2921	1182161	CBDivE_000239	CCC(=O)NCCc1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	L20	compound treatment	1.159	0.00504	0.07	1.192	-0.0627	-0.86	-0.5566	-0.6488	1912458	CBDivE_000240	C/C(=N\Nc1ccccc1)/Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M01	compound treatment	1.114	-0.04	-0.54	1.263	0.00829	0.11	-0.3012	-0.5469	1912459	CBDivE_000241	COc1ccc(/C=N/C(C)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M02	compound treatment	1.173	0.019	0.26	1.239	-0.0157	-0.21	0.0302	0.0902	1778631	CBDivE_000242	CCOC(=O)C1=C(C)OC(=C(C#N)C1c2c(C)c([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M03	compound treatment	1.162	0.00804	0.11	1.229	-0.0257	-0.35	-0.1712	-0.4665	1912460	CBDivE_000243	COc1ccc(/C=N/[C@@H](C)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M04	compound treatment	1.139	-0.015	-0.2	1.226	-0.0287	-0.39	-0.4195	-0.9525	1912461	CBDivE_000244	Cc1c(C2C(=C(N)Oc3[nH]c(=O)[nH]c(=O)c23)C#N)c(C)c([N+](=O)[O-])c(C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M05	compound treatment	1.147	-0.00696	-0.09	1.293	0.0383	0.52	0.3028	0.5708	1101325	CBDivE_000245	OC1CN(C1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M06	compound treatment	1.173	0.019	0.26	1.243	-0.0117	-0.16	0.0687	0.2273	1912462	CBDivE_000246	CCOC(=O)C1=C(N)OC2=C(C1c3c(C)cc(C)cc3C)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M07	compound treatment	1.162	0.00804	0.11	1.278	0.0233	0.32	0.3013	0.8977	1149162	CBDivE_000247	CC(C)C(Nc1ccccn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M08	compound treatment	1.205	0.051	0.69	1.285	0.0303	0.41	0.779	0.9701	1912463	CBDivE_000248	Cc1cc(C)c(C)c(C=C(C#N)C#N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M09	compound treatment	1.164	0.01	0.14	1.227	-0.0277	-0.38	-0.1714	-0.427	1337399	CBDivE_000249	CC(C)C(Nc1ccc(Br)cn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M10	compound treatment	1.179	0.025	0.34	1.203	-0.0517	-0.71	-0.2597	-0.3322	1912464	CBDivE_000250	Cc1cc(C)c(C)c(C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M11	compound treatment	1.18	0.026	0.35	1.283	0.0283	0.39	0.5212	0.9989	1488297	CBDivE_000251	CCCC(Nc1ccc(Br)cn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M12	compound treatment	1.185	0.031	0.42	1.197	-0.0577	-0.79	-0.2603	-0.2921	1912465	CBDivE_000252	Cc1cc(C)c(C)c(/C=C(/C#N)\C(=S)N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M13	compound treatment	1.16	0.00604	0.08	1.259	0.00429	0.06	0.099	0.9868	1912466	CBDivE_000253	CCCC(Nc1ccccn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M14	compound treatment	1.155	0.00104	0.01	1.278	0.0233	0.32	0.2345	0.7376	1912467	CBDivE_000254	CCOC(=O)/C(=C\c1c(C)c(C)cc(C)c1C)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M15	compound treatment	1.18	0.026	0.35	1.322	0.0673	0.92	0.8973	0.9132	1912468	CBDivE_000255	Brc1ccc(NCn2cncn2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M16	compound treatment	1.149	-0.00496	-0.07	1.311	0.0563	0.77	0.4955	0.643	1912469	CBDivE_000256	Cc1cc(C)c(C)c(/C=C(/C#N)\C(=O)N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M17	compound treatment	1.18	0.026	0.35	1.248	-0.00671	-0.09	0.1837	0.5061	1912470	CBDivE_000257	CC(Nc1ccc(Cl)cn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M18	compound treatment	1.172	0.018	0.24	1.244	-0.0107	-0.15	0.0688	0.2425	1912471	CBDivE_000258	Cc1ccc(/C=C(\C#N)/C(=S)N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M19	compound treatment	1.124	-0.03	-0.4	1.324	0.0693	0.94	0.3823	0.372	1912472	CBDivE_000259	CCCC(Nc1ccc(Cl)cn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	M20	compound treatment	1.133	-0.021	-0.28	1.248	-0.00671	-0.09	-0.2646	-0.8904	1912473	CBDivE_000260	Cc1n[nH]c2OC(=C(C#N)C(c12)c3c(C)cc(C)cc3C)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N01	compound treatment	1.137	-0.017	-0.23	1.203	-0.0517	-0.71	-0.6604	-0.8908	1052338	CBDivE_000261	COc1cc2C(C)NCCc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N02	compound treatment	1.134	-0.02	-0.27	1.218	-0.0367	-0.5	-0.5444	-0.9577	1912474	CBDivE_000262	C/C(=N\Nc1ccccc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N03	compound treatment	1.108	-0.046	-0.62	1.203	-0.0517	-0.71	-0.937	-0.9979	1706463	CBDivE_000263	CC(=O)NC(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N04	compound treatment	1.145	-0.00896	-0.12	1.168	-0.0867	-1.18	-0.9215	-0.7753	1912475	CBDivE_000264	CCOc1ccc(cc1OC)C/2/C(=N\Nc3ccccc3)/c4ccccc4\C2=N\Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N05	compound treatment	1.12	-0.034	-0.46	1.223	-0.0317	-0.43	-0.6297	-0.9996	1912476	CBDivE_000265	CC1C/C(=N\NC(=S)N)/C(C)CN1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N06	compound treatment	1.14	-0.014	-0.19	1.258	0.00329	0.04	-0.1014	-0.5239	1010718	CBDivE_000266	O=C(C(c1ccccc1)c2ccccc2)C3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N07	compound treatment	1.158	0.00404	0.05	1.185	-0.0697	-0.95	-0.6336	-0.6655	1574696	CBDivE_000267	CC1CC(O)(C(C)CN1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N08	compound treatment	1.143	-0.011	-0.15	1.143	-0.112	-1.52	-1.1817	-0.7721	1029705	CBDivE_000268	OC1=C(C(=O)c2ccccc12)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N09	compound treatment	1.171	0.017	0.23	1.181	-0.0737	-1.01	-0.5482	-0.5317	1724003	CBDivE_000269	CC1C(N(C)CCC1(O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N10	compound treatment	1.141	-0.013	-0.17	1.216	-0.0387	-0.53	-0.4969	-0.8936	1912477	CBDivE_000270	OC1=C(C(=O)c2ccccc12)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N11	compound treatment	1.177	0.023	0.31	1.236	-0.0187	-0.26	0.0394	0.098	1415486	CBDivE_000271	CCC1(CC(C)N(C)CC1C)OC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N12	compound treatment	1.081	-0.073	-0.98	1.24	-0.0147	-0.2	-0.8378	-0.8341	1912478	CBDivE_000272	[O-][N+](=O)C1(Cl)C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N13	compound treatment	1.244	0.09	1.21	1.181	-0.0737	-1.01	0.1482	0.094	1430972	CBDivE_000273	COC(=O)C1(O)CC(C)N(C)CC1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N14	compound treatment	1.163	0.00904	0.12	1.204	-0.0507	-0.69	-0.4027	-0.5735	1206659	CBDivE_000274	CCOc1ccc(NC(=O)CC2(C(=O)c3ccccc3C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N15	compound treatment	1.149	-0.00496	-0.07	1.243	-0.0117	-0.16	-0.1602	-0.9254	1695917	CBDivE_000275	CC1CN(C)CCC1(O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N16	compound treatment	1.136	-0.018	-0.24	1.212	-0.0427	-0.58	-0.5831	-0.9245	1912479	CBDivE_000276	Cc1ccc(cc1)C/2/C(=N\Nc3ccccc3)/c4ccccc4\C2=N\Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N17	compound treatment	1.155	0.00104	0.01	1.232	-0.0227	-0.31	-0.209	-0.6744	1732968	CBDivE_000277	OC1(CCN(Cc2ccccc2)CC1C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N18	compound treatment	1.1	-0.054	-0.73	1.258	0.00329	0.04	-0.483	-0.6622	1912480	CBDivE_000278	N(/N=C/1\C(/C(=N\Nc2ccccc2)/c3ccccc13)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N19	compound treatment	1.163	0.00904	0.12	1.221	-0.0337	-0.46	-0.2388	-0.5021	1012441	CBDivE_000279	CN(CCC(=O)c1ccccc1)CCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	N20	compound treatment	1.14	-0.014	-0.19	1.167	-0.0877	-1.2	-0.9789	-0.8085	1912481	CBDivE_000280	COC(=O)N(c1ccccc1)P(=O)(Oc2ccccc2)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O01	compound treatment	1.094	-0.06	-0.81	1.364	0.109	1.49	0.4819	0.2842	1774343	CBDivE_000281	Cc1ccc(NCn2cncn2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O02	compound treatment	1.106	-0.048	-0.65	1.286	0.0313	0.43	-0.1558	-0.201	1912482	CBDivE_000282	Cc1n[nH]c2OC(=C(C#N)C(c12)c3ccc(C)cc3C)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O03	compound treatment	1.12	-0.034	-0.46	1.277	0.0223	0.3	-0.109	-0.1983	1912483	CBDivE_000283	CC(Nc1ccc(Br)cn1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O04	compound treatment	1.157	0.00304	0.04	1.263	0.00829	0.11	0.109	0.9059	1343382	CBDivE_000284	CCOC1=C(C)OC(=C(C#N)C1c2ccc(OC)cc2)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O05	compound treatment	1.153	-9.59E-4	-0.01	1.264	0.00929	0.13	0.0804	0.6316	1912484	CBDivE_000285	COc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O06	compound treatment	1.173	0.019	0.26	1.285	0.0303	0.41	0.4737	0.9739	1912485	CBDivE_000286	COc1ccc(/C=C(\C#N)/C(=S)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O07	compound treatment	1.125	-0.029	-0.39	1.245	-0.00971	-0.13	-0.3699	-0.8966	1912486	CBDivE_000287	[O-][N+](=O)c1ccc(NCn2cncn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O08	compound treatment	1.144	-0.00996	-0.13	1.305	0.0503	0.69	0.3899	0.558	1912487	CBDivE_000288	COc1ccc(cc1)C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O09	compound treatment	1.172	0.018	0.24	1.327	0.0723	0.99	0.8692	0.856	1912488	CBDivE_000289	N#Cc1ccccc1NCn2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O10	compound treatment	1.201	0.047	0.63	1.226	-0.0287	-0.39	0.1719	0.2306	1912489	CBDivE_000290	COc1ccc(/C=C(/C#N)\C(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O11	compound treatment	1.089	-0.065	-0.88	1.262	0.00729	0.1	-0.5494	-0.6229	1393406	CBDivE_000291	Brc1ccc(CNc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O12	compound treatment	1.166	0.012	0.16	1.242	-0.0127	-0.17	-0.0077	-0.0323	1912490	CBDivE_000292	COc1ccc(cc1)C2C(=C(N)Oc3[nH]nc(C)c23)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O13	compound treatment	1.096	-0.058	-0.78	1.256	0.00129	0.02	-0.5404	-0.691	1912491	CBDivE_000293	[O-][N+](=O)c1cccc(c1)C(=O)N(Cc2ccc(Br)cc2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O14	compound treatment	1.169	0.015	0.2	1.285	0.0303	0.41	0.4356	0.9464	1912492	CBDivE_000294	Cc1ccc(C2C(=C(N)SC(=C2C#N)N)C#N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O15	compound treatment	1.177	0.023	0.31	1.212	-0.0427	-0.58	-0.192	-0.2909	1912493	CBDivE_000295	[O-][N+](=O)c1cccc(c1)C(=O)N(Cc2ccc(Br)cc2)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O16	compound treatment	1.177	0.023	0.31	1.228	-0.0267	-0.36	-0.0377	-0.0788	1912494	CBDivE_000296	COc1ccc(cc1)C2C3CCCC=C3C(=C(N)C2(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O17	compound treatment	1.244	0.09	1.21	1.28	0.0253	0.34	1.1028	0.8734	1912495	CBDivE_000297	Clc1ccc(cc1)C(=O)N(Cc2ccc(Br)cc2)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O18	compound treatment	1.104	-0.05	-0.67	1.254	-7.08E-4	-0.01	-0.4834	-0.7172	1676379	CBDivE_000298	CCOC(=O)C1=C(C)OC(=C(C#N)C1c2ccc(C)cc2C)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O19	compound treatment	1.184	0.03	0.41	1.287	0.0323	0.44	0.5979	0.9991	1912496	CBDivE_000299	Clc1ccc(cc1)C(=O)N(Cn2cncn2)c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	O20	compound treatment	1.166	0.012	0.16	1.278	0.0233	0.32	0.3394	0.9515	1912497	CBDivE_000300	Cc1cc(C)c(C=C(C#N)C#N)c(C)c1C=C(C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P01	compound treatment	1.153	-9.59E-4	-0.01	1.142	-0.113	-1.54	-1.0959	-0.713	1343459	CBDivE_000301	CC(=O)NC(C)(CC(=O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P02	compound treatment	1.135	-0.019	-0.26	1.237	-0.0177	-0.24	-0.3516	-0.9996	1003875	CBDivE_000302	CC(C)(C)c1ccc(OP(=O)(Oc2ccc(cc2)C(C)(C)C)Oc3ccc(cc3)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P03	compound treatment	1.186	0.032	0.43	1.204	-0.0507	-0.69	-0.1833	-0.2248	1719922	CBDivE_000303	CC1CC2(NC(=O)NC2=O)C(C)CN1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P04	compound treatment	1.111	-0.043	-0.58	1.127	-0.128	-1.74	-1.6412	-0.8942	1040786	CBDivE_000304	Cc1cc(C)cc(OP(=O)(Oc2cc(C)cc(C)c2)Oc3cc(C)cc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P05	compound treatment	1.118	-0.036	-0.49	1.197	-0.0577	-0.79	-0.8995	-0.973	1912498	CBDivE_000305	Cc1cc(C)n(n1)C(=O)CCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P06	compound treatment	1.111	-0.043	-0.58	1.206	-0.0487	-0.66	-0.8795	-0.9977	1912499	CBDivE_000306	Brc1ccc(OP(=O)(Oc2ccc(Br)cc2)Oc3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P07	compound treatment	1.236	0.082	1.11	1.145	-0.11	-1.5	-0.2752	-0.1479	1912500	CBDivE_000307	Cc1cc(Cl)n(n1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P08	compound treatment	1.156	0.00204	0.03	1.196	-0.0587	-0.8	-0.5466	-0.6824	1427838	CBDivE_000308	CCOC(=O)N(c1ccccc1)P2(=S)OCCC(C)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P09	compound treatment	1.152	-0.00196	-0.03	1.28	0.0253	0.34	0.2252	0.651	3001692	CBDivE_000309	Cc1[nH]c2ccc(C)cc2c1CCN.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P10	compound treatment	1.046	-0.108	-1.46	1.162	-0.0927	-1.26	-1.9238	-0.9975	1264330	CBDivE_000310	COC(=O)N(c1ccccc1)P2(=S)OCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P11	compound treatment	1.178	0.024	0.32	1.161	-0.0937	-1.28	-0.6742	-0.5114	1005188	CBDivE_000311	NN=C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P12	compound treatment	1.132	-0.022	-0.3	1.188	-0.0667	-0.91	-0.8527	-0.8913	1912501	CBDivE_000312	CC(=NOC(=O)Nc1ccc(cc1)[N+](=O)[O-])C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P13	compound treatment	1.221	0.067	0.9	1.216	-0.0387	-0.53	0.2663	0.2543	1912502	CBDivE_000313	Cc1nn(c(Cl)c1Br)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P14	compound treatment	1.154	4.06E-5	0.0	1.195	-0.0597	-0.81	-0.5753	-0.7066	1413653	CBDivE_000314	O=C(Nc1ccccc1)Nn2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P15	compound treatment	1.159	0.00504	0.07	1.206	-0.0487	-0.66	-0.4216	-0.6314	1912503	CBDivE_000315	CC(=O)Nc1ccc(NCCC#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P16	compound treatment	1.117	-0.037	-0.5	1.207	-0.0477	-0.65	-0.8126	-0.9914	1912504	CBDivE_000316	CCOc1ccc(NP(=O)(Oc2ccccc2)Oc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P17	compound treatment	1.189	0.035	0.47	1.283	0.0283	0.39	0.6071	0.9949	1912505	CBDivE_000317	CC(=O)Nc1ccc(cc1)N(CCC#N)N=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P18	compound treatment	1.061	-0.093	-1.25	1.195	-0.0597	-0.81	-1.4625	-0.9781	1912506	CBDivE_000318	COc1ccc(NC(=O)ON=C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P19	compound treatment	1.166	0.012	0.16	1.205	-0.0497	-0.68	-0.3645	-0.5229	1912507	CBDivE_000319	OC(=O)C/1=NN(C(=O)\C1=C/C=C/C=C/c2c(O)n(nc2C(=O)O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1	P20	compound treatment	1.102	-0.052	-0.7	1.243	-0.0117	-0.16	-0.6086	-0.8465	1912508	CBDivE_000320	CCOC(=O)/C(=N\Nc1ccccc1O)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A01	compound treatment	0.581	-0.538	-7.25	1.253	0.0499	0.68	-4.6475	-0.638	1914260	CBDivE_002881	CCOc1ccc(cc1)C(Nc2ccc(Br)cc2)P3(=O)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A02	compound treatment	1.133	0.0144	0.19	1.261	0.0579	0.79	0.6954	0.8554	1475262	CBDivE_002882	Oc1ccc(C=c2sc3=NCCCn3c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A03	compound treatment	0.461	-0.658	-8.87	1.247	0.0439	0.6	-5.8501	-0.6579	1914261	CBDivE_002883	CC/C(=N\N=C(/CC)\c1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A04	compound treatment	1.146	0.0274	0.37	1.243	0.0399	0.54	0.6458	0.9822	1914262	CBDivE_002884	COP(=O)(OC)C(Nc1ccc(Br)cc1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A05	compound treatment	0.115	-1.0	-13.54	1.206	0.00289	0.04	-9.546	-0.705	1914263	CBDivE_002885	Cc1cc(C)c([N+](=O)[O-])c(C)c1/C=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A06	compound treatment	1.234	0.115	1.56	1.198	-0.00511	-0.07	1.0514	0.6748	1350777	CBDivE_002886	CCC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A07	compound treatment	1.124	0.00538	0.07	1.216	0.0129	0.18	0.1756	0.9235	1914264	CBDivE_002887	CCc1ccc(NC(c2ccccc2)P3(=O)OCCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A08	compound treatment	1.164	0.0454	0.61	1.199	-0.00411	-0.06	0.3932	0.6397	1914265	CBDivE_002888	COP(=O)(OC)C(Nc1ccc(C)cc1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A09	compound treatment	1.213	0.0944	1.27	1.265	0.0619	0.84	1.4971	0.9801	1914266	CBDivE_002889	CCOP(=O)(OCC)C(Nc1ccc(Br)cc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A10	compound treatment	1.159	0.0404	0.54	1.247	0.0439	0.6	0.8084	0.9989	1914267	CBDivE_002890	CC(=O)Oc1ccc(/C=N/c2cc(ccc2O)S(=O)(=O)c3ccc(O)c(\N=C\c4ccc(OC(=O)C)cc4)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A11	compound treatment	1.215	0.0964	1.3	1.214	0.0109	0.15	1.0244	0.7828	1914268	CBDivE_002891	Oc1c(C(=O)NNc2ccccc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A12	compound treatment	1.508	0.389	5.25	1.223	0.0199	0.27	3.9062	0.7426	1914269	CBDivE_002892	COc1ccc(/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A13	compound treatment	1.203	0.0844	1.14	1.227	0.0239	0.33	1.0353	0.8744	1914270	CBDivE_002893	Oc1ccc(cc1/N=C/c2ccc(cc2)[N+](=O)[O-])S(=O)(=O)c3ccc(O)c(/N=C/c4ccc(cc4)[N+](=O)[O-])c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A14	compound treatment	1.273	0.154	2.08	1.155	-0.0481	-0.66	1.0088	0.462	1914271	CBDivE_002894	CC(C)C1=C/C(=C(\c2ccccc2S(=O)(=O)O)/c3cc(C(C)C)c(O)cc3C)/C(=CC1=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A15	compound treatment	1.34	0.221	2.99	1.266	0.0629	0.86	2.7182	0.8748	1088422	CBDivE_002895	O=S(=O)(c1ccccc1)n2ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A16	compound treatment	1.39	0.271	3.66	1.213	0.00989	0.13	2.6841	0.7327	1326458	CBDivE_002896	OC(=O)CCC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A17	compound treatment	1.474	0.355	4.79	1.245	0.0419	0.57	3.794	0.7858	1077864	CBDivE_002897	COc1ccc(Cc2[n+](C)ccc3cc(OC)c(OC)cc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A18	compound treatment	1.529	0.41	5.54	1.219	0.0159	0.22	4.068	0.7342	1914272	CBDivE_002898	COc1ccc(cc1)S(=O)(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A19	compound treatment	1.422	0.303	4.09	1.258	0.0549	0.75	3.4233	0.8228	1914273	CBDivE_002899	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccc3CCc4cccc2c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	A20	compound treatment	1.589	0.47	6.35	1.264	0.0609	0.83	5.0742	0.7929	1914274	CBDivE_002900	OC(=O)CCCCCCCCCCC1CCOC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B01	compound treatment	1.077	-0.0416	-0.56	1.262	0.0589	0.8	0.1708	0.1743	2693	CBDivE_002901	OC(=O)c1ccccc1c2c3ccc(O)cc3oc4cc(=O)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B02	compound treatment	1.123	0.00438	0.06	1.165	-0.0381	-0.52	-0.3257	-0.6227	1914275	CBDivE_002902	NNc1ccc(Oc2ccccc2)c(c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B03	compound treatment	1.172	0.0534	0.72	1.158	-0.0451	-0.62	0.0742	0.0784	1914276	CBDivE_002903	Cc1[nH]c2ccccc2c1C3C=Cc4ccccc4N3C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B04	compound treatment	1.14	0.0214	0.29	1.286	0.0829	1.13	1.0032	0.86	1229376	CBDivE_002904	NCCc1c([nH]c2ccc(OCc3ccccc3)cc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B05	compound treatment	1.114	-0.00462	-0.06	1.182	-0.0211	-0.29	-0.2476	-0.8407	1914277	CBDivE_002905	CCCCCC(=O)N(C)CCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B06	compound treatment	1.159	0.0404	0.54	1.21	0.00689	0.09	0.4516	0.817	1914278	CBDivE_002906	COc1ccc(/C=N/c2ccc(OC(=O)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B07	compound treatment	1.318	0.199	2.69	1.27	0.0669	0.91	2.5469	0.8967	1914279	CBDivE_002907	CCCCCC(=O)NCCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B08	compound treatment	1.154	0.0354	0.48	1.133	-0.0701	-0.96	-0.3385	-0.3168	1612128	CBDivE_002908	CC1Cc2c([nH]c3ccccc23)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B09	compound treatment	1.204	0.0854	1.15	1.179	-0.0241	-0.33	0.582	0.4858	1087071	CBDivE_002909	CC(=O)NC1C(OC(=O)C)OC(COC(=O)C)C(OC(=O)C)C1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B10	compound treatment	1.226	0.107	1.45	1.223	0.0199	0.27	1.2161	0.8251	1774576	CBDivE_002910	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CSc2nnc(Nc3ccccc3)n2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B11	compound treatment	1.207	0.0884	1.19	1.2	-0.00311	-0.04	0.8131	0.6815	1103401	CBDivE_002911	OC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B12	compound treatment	1.197	0.0784	1.06	1.218	0.0149	0.2	0.8913	0.8277	1914280	CBDivE_002912	[O-][N+](=O)c1ccc(NC(=S)NC(NC(=O)c2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B13	compound treatment	1.206	0.0874	1.18	1.227	0.0239	0.33	1.0639	0.8699	1914281	CBDivE_002913	CCCCCC(=O)NCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B14	compound treatment	1.109	-0.00962	-0.13	1.211	0.00789	0.11	-0.0157	-0.0932	1914282	CBDivE_002914	CC(C)(C)C(=O)NC(NC(=S)Nc1cccc2ccccc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B15	compound treatment	1.351	0.232	3.13	1.268	0.0649	0.88	2.8424	0.8726	1914283	CBDivE_002915	CCCCCCCCCC(=O)N(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B16	compound treatment	1.481	0.362	4.89	1.137	-0.0661	-0.9	2.8194	0.5671	1442022	CBDivE_002916	COc1ccc(OCC(O)CNC(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B17	compound treatment	1.486	0.367	4.96	1.15	-0.0531	-0.72	2.9924	0.5974	1914284	CBDivE_002917	N/C(=N\Nc1ccccc1)/N=Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B18	compound treatment	1.585	0.466	6.29	1.191	-0.0121	-0.17	4.3322	0.6883	1457244	CBDivE_002918	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccccc3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B19	compound treatment	1.391	0.272	3.67	1.24	0.0369	0.5	2.954	0.7965	1914285	CBDivE_002919	Clc1ccc(cc1)C(=O)Nc2ccc(/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	B20	compound treatment	1.453	0.334	4.51	1.175	-0.0281	-0.38	2.9187	0.6447	1005048	CBDivE_002920	NC(Cc1cc(I)c(O)c(I)c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C01	compound treatment	1.094	-0.0246	-0.33	1.2	-0.00311	-0.04	-0.2649	-0.791	1914286	CBDivE_002921	CN(C)c1ccc(N=Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C02	compound treatment	1.095	-0.0236	-0.32	1.24	0.0369	0.5	0.1304	0.219	1914287	CBDivE_002922	CC(=O)Oc1c(ccc2ccccc12)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C03	compound treatment	0.885	-0.234	-3.15	1.194	-0.00911	-0.12	-2.3164	-0.7344	1914288	CBDivE_002923	Cc1cc(O)c(C(=O)/C=C/c2cc(Br)ccc2O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C04	compound treatment	1.164	0.0454	0.61	1.19	-0.0131	-0.18	0.3065	0.4805	1914289	CBDivE_002924	CC(=O)N(CCN(Cc1ccccc1)C(=O)C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C05	compound treatment	1.113	-0.00562	-0.08	1.217	0.0139	0.19	0.0803	0.3937	1914290	CBDivE_002925	Cc1ccc(cc1)S(=O)(=O)NNC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C06	compound treatment	1.125	0.00638	0.09	1.238	0.0349	0.48	0.3973	0.8217	1171734	CBDivE_002926	CC(C1C(=O)CC(C)(C)CC1=O)C2=C(O)CC(C)(C)CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C07	compound treatment	1.144	0.0254	0.34	1.179	-0.0241	-0.33	0.0096	0.0203	1039363	CBDivE_002927	CCOC(=O)C(Br)C(Br)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C08	compound treatment	1.097	-0.0216	-0.29	1.224	0.0209	0.28	-0.0048	-0.0118	1914291	CBDivE_002928	COc1ccc(/C=C(\NC(=O)c2ccccc2)/C(=O)NNC(=O)c3ccc(cc3)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C09	compound treatment	1.217	0.0984	1.33	1.16	-0.0431	-0.59	0.5228	0.3601	1914292	CBDivE_002929	Brc1ccc(N/N=C(/N=Nc2ccc(Br)cc2)\c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C10	compound treatment	1.227	0.108	1.46	1.199	-0.00411	-0.06	0.9942	0.6795	1914293	CBDivE_002930	Cc1cc(ccc1NC(=O)/C=C/C(=O)O)c2ccc(NC(=O)/C=C/C(=O)O)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C11	compound treatment	1.071	-0.0476	-0.64	1.195	-0.00811	-0.11	-0.5325	-0.8169	1914294	CBDivE_002931	[O-][N+](=O)c1cccc(/C=N\Nc2nc(OCC(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C12	compound treatment	1.139	0.0204	0.27	1.228	0.0249	0.34	0.4344	0.9945	1914295	CBDivE_002932	COc1ccc(/C=N/c2cccc3c(/N=C\c4ccc(OC)c(OC)c4)cccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C13	compound treatment	1.154	0.0354	0.48	1.16	-0.0431	-0.59	-0.0782	-0.1033	1005565	CBDivE_002933	CC(=O)Oc1c2ccccc2c(OC(=O)C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C14	compound treatment	1.138	0.0194	0.26	1.223	0.0199	0.27	0.3766	0.9998	1914296	CBDivE_002934	Cc1cc(ccc1/N=C/c2ccccc2O)c3ccc(/N=C/c4ccccc4O)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C15	compound treatment	1.437	0.318	4.3	1.195	-0.00811	-0.11	2.9589	0.6887	1914297	CBDivE_002935	COc1ccc(/C=N/n2cnnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C16	compound treatment	1.467	0.348	4.7	1.197	-0.00611	-0.08	3.2644	0.6945	1914298	CBDivE_002936	CN(C)c1ccc(N=Nc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C17	compound treatment	1.002	-0.117	-1.57	1.173	-0.0301	-0.41	-1.4028	-0.8628	1914299	CBDivE_002937	CCOc1ccc(/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C18	compound treatment	1.175	0.0564	0.76	1.218	0.0149	0.2	0.6814	0.8655	1914300	CBDivE_002938	COC(=O)C(C(C(=O)OC)C(=O)OC)C(C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C19	compound treatment	1.017	-0.102	-1.37	1.206	0.00289	0.04	-0.9415	-0.6865	1003525	CBDivE_002939	O=C(C[n+]1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	C20	compound treatment	1.152	0.0334	0.45	1.208	0.00489	0.07	0.3656	0.803	1914301	CBDivE_002940	FC(F)(F)C(=O)NCCCCNC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D01	compound treatment	1.135	0.0164	0.22	1.212	0.00889	0.12	0.242	0.96	1914302	CBDivE_002941	O=C(NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D02	compound treatment	1.123	0.00438	0.06	1.132	-0.0711	-0.97	-0.6439	-0.6628	1914303	CBDivE_002942	CC(=O)c1ccc2[nH]c(C(=O)O)c(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D03	compound treatment	1.118	-6.19E-4	-0.01	1.201	-0.00211	-0.03	-0.0263	-0.8759	1019667	CBDivE_002943	Cc1ccc(cc1)S(=O)(=O)NCCNS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D04	compound treatment	1.121	0.00238	0.03	1.154	-0.0491	-0.67	-0.4509	-0.6724	1914304	CBDivE_002944	[O-][N+](=O)c1ccccc1CSc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D05	compound treatment	1.142	0.0234	0.32	1.241	0.0379	0.52	0.5884	0.972	1914305	CBDivE_002945	CCC(NC(=O)/C=C/c1cccc(Br)c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D06	compound treatment	1.15	0.0314	0.42	1.16	-0.0431	-0.59	-0.1164	-0.1606	1914306	CBDivE_002946	CC(=O)C1=C(C)NC2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D07	compound treatment	1.12	0.00138	0.02	1.201	-0.00211	-0.03	-0.0072	-0.2097	1914307	CBDivE_002947	C(=N/c1ccc(cc1)c2ccc(\N=C\c3ccco3)cc2)\c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D08	compound treatment	1.121	0.00238	0.03	1.196	-0.00711	-0.1	-0.0459	-0.4489	1914308	CBDivE_002948	CCN(CC)c1ccc(N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D09	compound treatment	1.188	0.0694	0.94	1.232	0.0289	0.39	0.9404	0.926	1499288	CBDivE_002949	CCN(CC)Cc1n[nH]c(CN(CC)CC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D10	compound treatment	1.236	0.117	1.58	1.181	-0.0221	-0.3	0.9065	0.5624	1778026	CBDivE_002950	OCc1c(CO)[n+]([O-])c2ccccc2[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D11	compound treatment	1.13	0.0114	0.15	1.192	-0.0111	-0.15	0.0014	0.0066	1914309	CBDivE_002951	[O-][N+](=O)c1ccc(N/N=C\2/CCCc3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D12	compound treatment	1.141	0.0224	0.3	1.156	-0.0471	-0.64	-0.2408	-0.3392	1914310	CBDivE_002952	ClC(Cl)(Cl)C(NC(=O)/C=C/c1ccccc1)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D13	compound treatment	1.14	0.0214	0.29	1.19	-0.0131	-0.18	0.0775	0.2284	1606914	CBDivE_002953	OC(=O)CCC(=O)Nc1ccc(Br)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D14	compound treatment	1.107	-0.0116	-0.16	1.237	0.0339	0.46	0.2159	0.4425	1914311	CBDivE_002954	CC(C)(C)C(=O)NC(NC(=S)Nc1cccc(O)c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D15	compound treatment	1.502	0.383	5.17	1.177	-0.0261	-0.36	3.4054	0.6569	1914312	CBDivE_002955	[O-][N+](=O)c1cccc(NN=Nc2ccc(Cl)c(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D16	compound treatment	1.485	0.366	4.94	1.149	-0.0541	-0.74	2.9733	0.5949	1411138	CBDivE_002956	COc1ccc(OCC(O)CN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D17	compound treatment	1.082	-0.0366	-0.49	1.197	-0.00611	-0.08	-0.4083	-0.8149	1914313	CBDivE_002957	COC(=O)c1ccc(N=NNc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D18	compound treatment	1.158	0.0394	0.53	1.187	-0.0161	-0.22	0.2203	0.3832	1914314	CBDivE_002958	CCCCCC(=O)NC(NC(=S)Nc1ccccc1O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D19	compound treatment	1.15	0.0314	0.42	1.251	0.0479	0.65	0.7611	0.978	1777539	CBDivE_002959	CCOC(=O)C1=C(CC)NC2=C(C1c3cccc(c3)[N+](=O)[O-])C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	D20	compound treatment	1.076	-0.0426	-0.57	1.172	-0.0311	-0.42	-0.7066	-0.9888	1914315	CBDivE_002960	CC(=O)N/C(=C\c1ccccc1)/C(=O)Nc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E01	compound treatment	1.086	-0.0326	-0.44	1.19	-0.0131	-0.18	-0.4376	-0.9213	1914316	CBDivE_002961	CCOP(=O)(OCC)C(Nc1ccc(Cl)c(Cl)c1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E02	compound treatment	1.16	0.0414	0.56	1.209	0.00589	0.08	0.4515	0.8006	1600996	CBDivE_002962	CCCCc1c(cccc1C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E03	compound treatment	1.096	-0.0226	-0.31	1.179	-0.0241	-0.33	-0.4483	-0.9993	1914317	CBDivE_002963	O=P1(OCCCO1)C(Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E04	compound treatment	1.152	0.0334	0.45	1.229	0.0259	0.35	0.568	0.9927	1914318	CBDivE_002964	FC(F)(F)C(F)(F)C(F)(F)OC(F)(C(=O)Nc1ccc2ncccc2c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E05	compound treatment	1.038	-0.0806	-1.09	1.17	-0.0331	-0.45	-1.0883	-0.9242	1914319	CBDivE_002965	COc1ccc(NC(c2ccc(O)cc2)P(=O)(OC)OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E06	compound treatment	1.119	3.81E-4	0.01	1.177	-0.0261	-0.36	-0.2482	-0.6968	1914320	CBDivE_002966	FC(F)(F)C(F)(F)C(F)(F)OC(F)(C(=O)Nc1cccc2ccccc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E07	compound treatment	1.112	-0.00662	-0.09	1.236	0.0329	0.45	0.254	0.5554	1914321	CBDivE_002967	COP(=O)(OC)C(Nc1ccc(Cl)c(Cl)c1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E08	compound treatment	1.19	0.0714	0.96	1.204	8.87E-4	0.01	0.6895	0.7159	1342842	CBDivE_002968	CC(=O)Oc1c(Br)cc(Br)c2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E09	compound treatment	0.918	-0.201	-2.71	1.205	0.00189	0.03	-1.8956	-0.7004	1009618	CBDivE_002969	CCOC(=O)C(NC(=O)C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E10	compound treatment	1.103	-0.0156	-0.21	1.215	0.0119	0.16	-0.0344	-0.1293	1022384	CBDivE_002970	CC(=O)Oc1ccccc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E11	compound treatment	1.103	-0.0156	-0.21	1.122	-0.0811	-1.11	-0.9311	-0.8269	1914322	CBDivE_002971	Clc1ccc(/N=C/c2c[nH]c3ccccc23)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E12	compound treatment	1.145	0.0264	0.36	1.269	0.0659	0.9	0.887	0.9178	1537665	CBDivE_002972	Clc1ccc(OCC(=O)Nc2ccc(I)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E13	compound treatment	1.104	-0.0146	-0.2	1.219	0.0159	0.22	0.0137	0.0469	1044687	CBDivE_002973	CCOC(=O)C[n+]1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E14	compound treatment	1.074	-0.0446	-0.6	1.311	0.108	1.47	0.6147	0.3867	1914323	CBDivE_002974	[O-][N+](=O)c1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E15	compound treatment	1.5	0.381	5.15	1.222	0.0189	0.26	3.8202	0.7416	1914324	CBDivE_002975	CCOP(=O)(OCC)C(Nc1ccc(Br)cc1)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E16	compound treatment	1.442	0.323	4.36	1.201	-0.00211	-0.03	3.0645	0.7024	3105715	CBDivE_002976	Cc1ccc(cc1)S(=O)(=O)O.NC(=N)SCCS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E17	compound treatment	1.115	-0.00362	-0.05	1.194	-0.00911	-0.12	-0.1224	-0.9167	1914326	CBDivE_002977	CCOc1ccc(cc1)C(Nc2ccc(C)cc2)P3(=O)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E18	compound treatment	1.155	0.0364	0.49	1.235	0.0319	0.43	0.6545	0.9982	1914327	CBDivE_002978	CCCCCOC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E19	compound treatment	1.06	-0.0586	-0.79	1.177	-0.0261	-0.36	-0.811	-0.9351	1601550	CBDivE_002979	COc1ccc(C2C(=O)c3ccccc3C2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	E20	compound treatment	1.146	0.0274	0.37	1.2	-0.00311	-0.04	0.2312	0.6218	1471945	CBDivE_002980	O=C(N1CCNCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F01	compound treatment	1.074	-0.0446	-0.6	1.19	-0.0131	-0.18	-0.5521	-0.8792	1004614	CBDivE_002981	OC(=O)CNS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F02	compound treatment	1.128	0.00938	0.13	1.17	-0.0331	-0.45	-0.2298	-0.49	1261842	CBDivE_002982	COc1ccc(cc1)C(=O)O[C@H](C2CC3CCN2CC3C=C)c4ccnc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F03	compound treatment	1.121	0.00238	0.03	1.206	0.00289	0.04	0.0506	0.9949	1914328	CBDivE_002983	CCCCCC(=O)NCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F04	compound treatment	1.151	0.0324	0.44	1.204	8.87E-4	0.01	0.3174	0.7264	1914329	CBDivE_002984	CC(=O)c1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F05	compound treatment	1.101	-0.0176	-0.24	1.197	-0.00611	-0.08	-0.227	-0.9013	1914330	CBDivE_002985	COC(=O)c1ccc(N=NNc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F06	compound treatment	1.117	-0.00162	-0.02	1.161	-0.0421	-0.57	-0.4215	-0.7335	1037610	CBDivE_002986	OC(=O)c1ccc(cc1)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F07	compound treatment	1.075	-0.0436	-0.59	1.155	-0.0481	-0.66	-0.88	-0.9985	1914331	CBDivE_002987	COC(=O)c1ccc(NN=Nc2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F08	compound treatment	1.142	0.0234	0.32	1.201	-0.00211	-0.03	0.2027	0.6399	1914332	CBDivE_002988	CN(C)CCNC(=O)COc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F09	compound treatment	1.162	0.0434	0.59	1.225	0.0219	0.3	0.6249	0.9512	1112119	CBDivE_002989	CC(=O)Oc1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F10	compound treatment	1.124	0.00538	0.07	1.157	-0.0461	-0.63	-0.3933	-0.6213	1914333	CBDivE_002990	[O-][n+]1c(CBr)c(CBr)[n+]([O-])c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F11	compound treatment	1.145	0.0264	0.36	1.205	0.00189	0.03	0.2699	0.7563	1914334	CBDivE_002991	Fc1cccc(N=NNc2ccc(Cl)c(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F12	compound treatment	1.059	-0.0596	-0.8	1.134	-0.0691	-0.94	-1.2351	-0.9969	1914335	CBDivE_002992	CC(C)C(=O)NC(NC(=S)Nc1cccc(c1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F13	compound treatment	1.142	0.0234	0.32	1.228	0.0249	0.34	0.463	0.9993	1053980	CBDivE_002993	Cc1ccc(cc1)S(=O)(=O)NCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F14	compound treatment	1.116	-0.00262	-0.04	1.254	0.0509	0.69	0.4657	0.6702	1914336	CBDivE_002994	CC(C)(C)C(=O)NC(NC(=S)Nc1ccccc1O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F15	compound treatment	1.583	0.464	6.26	1.174	-0.0291	-0.4	4.1492	0.661	1003076	CBDivE_002995	OC(=O)c1ccccc1c2c3cc(Br)c(O)c(Br)c3oc4c(Br)c(=O)c(Br)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F16	compound treatment	1.45	0.331	4.47	1.155	-0.0481	-0.66	2.6972	0.5969	1153907	CBDivE_002996	COc1ccc(OCC(O)CNC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F17	compound treatment	1.099	-0.0196	-0.26	1.195	-0.00811	-0.11	-0.2654	-0.9251	1914337	CBDivE_002997	Cc1ccc(N=NNc2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F18	compound treatment	1.085	-0.0336	-0.45	1.233	0.0299	0.41	-0.0325	-0.0533	1914338	CBDivE_002998	CC(C)COC(C(=O)OC(C)CN(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F19	compound treatment	1.117	-0.00162	-0.02	1.196	-0.00711	-0.1	-0.084	-0.8452	1023142	CBDivE_002999	CC(C)C(NC(=O)c1ccccc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	F20	compound treatment	1.136	0.0174	0.23	1.209	0.00589	0.08	0.2226	0.898	1446316	CBDivE_003000	OC(=O)c1ccc(cc1C(=O)O)S(=O)(=O)c2ccc(C(=O)O)c(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G01	compound treatment	1.081	-0.0376	-0.51	1.171	-0.0321	-0.44	-0.6685	-0.9973	1914339	CBDivE_003001	FCCOc1ccc(OCCF)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G02	compound treatment	1.139	0.0204	0.27	1.17	-0.0331	-0.45	-0.1249	-0.2362	1914340	CBDivE_003002	CC(C)OC(=O)C(N)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G03	compound treatment	1.061	-0.0576	-0.78	1.197	-0.00611	-0.08	-0.6086	-0.7785	1914341	CBDivE_003003	C/C(=N\Nc1ccccc1)/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G04	compound treatment	1.158	0.0394	0.53	1.174	-0.0291	-0.4	0.095	0.1432	1327295	CBDivE_003004	Cc1cc(C)nc(NC(=O)NS(=O)(=O)N(Cc2ccccc2)c3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G05	compound treatment	1.11	-0.00862	-0.12	1.154	-0.0491	-0.67	-0.5558	-0.8176	1481	CBDivE_003005	Oc1c(Cc2c(O)c3ccccc3oc2=O)c(=O)oc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G06	compound treatment	1.099	-0.0196	-0.26	1.228	0.0249	0.34	0.0528	0.1227	1147504	CBDivE_003006	COc1ccc2[nH]c(C(=O)O)c(CCNC(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G07	compound treatment	1.106	-0.0126	-0.17	1.203	-1.13E-4	0.0	-0.1215	-0.7135	1914342	CBDivE_003007	CC1=C/C(=C(\c2cc(C)c(O)c(Br)c2)/c3ccccc3S(=O)(=O)O)/C=C(Br)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G08	compound treatment	1.124	0.00538	0.07	1.208	0.00489	0.07	0.0985	0.9991	1914343	CBDivE_003008	O=C(CCS(=O)NCc1ccccc1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G09	compound treatment	1.121	0.00238	0.03	1.223	0.0199	0.27	0.2145	0.7854	1052409	CBDivE_003009	CC(NC(=O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G10	compound treatment	1.078	-0.0406	-0.55	1.231	0.0279	0.38	-0.1186	-0.1778	1459990	CBDivE_003010	Fc1ccc(cc1)C(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G11	compound treatment	1.131	0.0124	0.17	1.195	-0.00811	-0.11	0.0399	0.1991	1914344	CBDivE_003011	COP(=O)(OC)C1(CCCCC1)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G12	compound treatment	1.18	0.0614	0.83	1.215	0.0119	0.16	0.7002	0.8298	1551804	CBDivE_003012	Cc1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G13	compound treatment	1.131	0.0124	0.17	1.152	-0.0511	-0.7	-0.3747	-0.5228	1914345	CBDivE_003013	COP(=O)(OC)C(Nc1ccc(Cl)cc1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G14	compound treatment	1.107	-0.0116	-0.16	1.24	0.0369	0.5	0.2448	0.4647	1914346	CBDivE_003014	Cc1cc(ccc1/N=C/c2cccc(c2)[N+](=O)[O-])c3ccc(/N=C/c4cccc(c4)[N+](=O)[O-])c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G15	compound treatment	0.9	-0.219	-2.95	1.248	0.0449	0.61	-1.6527	-0.5487	1914347	CBDivE_003015	COP(=O)(OC)C1(CCCCC1)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G16	compound treatment	1.135	0.0164	0.22	1.196	-0.00711	-0.1	0.0877	0.3633	1914348	CBDivE_003016	C(CSCCc1ccncc1)SCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G17	compound treatment	1.146	0.0274	0.37	1.176	-0.0271	-0.37	-2.0E-4	-4.0E-4	1914349	CBDivE_003017	Oc1ccc2ccccc2c1/C=N\c3ccc(/N=C\c4c(O)ccc5ccccc45)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G18	compound treatment	1.128	0.00938	0.13	1.219	0.0159	0.22	0.2427	0.9672	1110839	CBDivE_003018	OC(=O)c1ccccc1C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G19	compound treatment	1.112	-0.00662	-0.09	1.249	0.0459	0.63	0.3793	0.6001	1914350	CBDivE_003019	Oc1ccc(cc1)C(Nc2ccc(Br)cc2)P3(=O)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	G20	compound treatment	1.162	0.0434	0.59	1.226	0.0229	0.31	0.6345	0.9567	1043646	CBDivE_003020	COc1ccc(CC(=O)N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H01	compound treatment	1.072	-0.0466	-0.63	1.244	0.0409	0.56	-0.0505	-0.06	1114807	CBDivE_003021	OC(=O)c1ccccc1C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H02	compound treatment	1.101	-0.0176	-0.24	1.159	-0.0441	-0.6	-0.5934	-0.9175	1914133	CBDivE_003022	CCOc1ccc2[nH]c(C(=O)O)c(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H03	compound treatment	1.092	-0.0266	-0.36	1.157	-0.0461	-0.63	-0.6986	-0.9647	1914351	CBDivE_003023	CC(=O)Oc1c(N=Nc2ccccc2)ccc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H04	compound treatment	1.141	0.0224	0.3	1.191	-0.0121	-0.17	0.0967	0.281	1412855	CBDivE_003024	CN1CCN(CC1)C(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H05	compound treatment	1.124	0.00538	0.07	1.203	-1.13E-4	0.0	0.0502	0.692	1914352	CBDivE_003025	COc1ccc(/C(=N/NC(=O)c2cccc(c2)[N+](=O)[O-])/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H06	compound treatment	1.082	-0.0366	-0.49	1.189	-0.0141	-0.19	-0.4854	-0.9156	1914353	CBDivE_003026	FC(F)(C(OP(=O)(c1ccccc1)c2ccccc2)c3ccccc3)C4(F)OC(F)(F)C(F)(F)C4(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H07	compound treatment	1.104	-0.0146	-0.2	1.23	0.0269	0.37	0.1198	0.2878	1914354	CBDivE_003027	COC(=O)c1ccc(N=NNc2ccc(cc2OC)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H08	compound treatment	1.12	0.00138	0.02	1.181	-0.0221	-0.3	-0.2	-0.6621	1914355	CBDivE_003028	CC1CC(=O)NN=C1c2ccc(N)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H09	compound treatment	1.139	0.0204	0.27	1.109	-0.0941	-1.28	-0.7131	-0.5433	1914356	CBDivE_003029	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccco3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H10	compound treatment	1.147	0.0284	0.38	1.237	0.0339	0.46	0.5975	0.9956	1183706	CBDivE_003030	CC(C)c1ccc(OCc2nc3ccccc3[nH]2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H11	compound treatment	1.071	-0.0476	-0.64	1.217	0.0139	0.19	-0.3203	-0.4783	1113698	CBDivE_003031	COC(=O)COc1ccccc1OCC(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H12	compound treatment	1.116	-0.00262	-0.04	1.109	-0.0941	-1.28	-0.9325	-0.7263	1914357	CBDivE_003032	CC(C)C(=O)NC(NC(=S)Nc1cccc2ccccc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H13	compound treatment	1.131	0.0124	0.17	1.155	-0.0481	-0.66	-0.3458	-0.5108	1030990	CBDivE_003033	CC(C)CC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H14	compound treatment	1.123	0.00438	0.06	1.233	0.0299	0.41	0.33	0.8013	1914358	CBDivE_003034	Clc1ccc(Cl)c(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H15	compound treatment	1.141	0.0224	0.3	1.261	0.0579	0.79	0.7717	0.9131	1057916	CBDivE_003035	Cc1ccc(cc1)S(=O)(=O)NC(CCC(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H16	compound treatment	1.094	-0.0246	-0.33	1.215	0.0119	0.16	-0.1202	-0.3253	1428920	CBDivE_003036	Cc1cc(C)c(OCC(O)CNC(C)(C)C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H17	compound treatment	1.109	-0.00962	-0.13	1.215	0.0119	0.16	0.0229	0.1101	1478034	CBDivE_003037	NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H18	compound treatment	1.098	-0.0206	-0.28	1.162	-0.0411	-0.56	-0.5931	-0.9477	1914359	CBDivE_003038	CCCOC(C(=O)OCCCN1CCCCCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H19	compound treatment	1.114	-0.00462	-0.06	1.208	0.00489	0.07	0.0031	0.0336	1340252	CBDivE_003039	O=C1N(CCc2n[nH]c(CCN3C(=O)c4ccccc4C3=O)n2)C(=O)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	H20	compound treatment	1.118	-6.19E-4	-0.01	1.2	-0.00311	-0.04	-0.0359	-0.8303	1669641	CBDivE_003040	OC(=O)c1ccc(C(=O)O)c(c1)S(=O)(=O)c2cc(ccc2C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I01	compound treatment	1.111	-0.00762	-0.1	1.262	0.0589	0.8	0.4951	0.6116	1914360	CBDivE_003041	COP(=O)(OC)C(Nc1ccc(Br)cc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I02	compound treatment	1.168	0.0494	0.67	1.276	0.0729	0.99	1.1739	0.9811	1016552	CBDivE_003042	OC(=O)C(Cc1ccccc1)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I03	compound treatment	1.102	-0.0166	-0.22	1.227	0.0239	0.33	0.0718	0.1816	1914361	CBDivE_003043	CC1OP(=O)(OC1C)C(Nc2ccc(C)cc2)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I04	compound treatment	1.128	0.00938	0.13	1.193	-0.0101	-0.14	-0.008	-0.0429	1914362	CBDivE_003044	CC(C)CC(N)C(=O)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I05	compound treatment	1.128	0.00938	0.13	1.16	-0.0431	-0.59	-0.3262	-0.5425	1914363	CBDivE_003045	CC(C)OP(=O)(OC(C)C)C(Nc1ccc(Br)cc1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I06	compound treatment	1.116	-0.00262	-0.04	1.221	0.0179	0.24	0.1475	0.5984	3006937	CBDivE_003046	C[n+]1cccc(c1)C(=O)N.OS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I07	compound treatment	1.119	3.81E-4	0.01	1.207	0.00389	0.05	0.0411	0.7721	1914364	CBDivE_003047	CCOP(=O)(OCC)C(Nc1ccc(Br)cc1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I08	compound treatment	1.145	0.0264	0.36	1.173	-0.0301	-0.41	-0.0387	-0.0712	1914365	CBDivE_003048	O=C(NNC(=O)c1ccccc1c2ccccc2C(=O)NNC(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I09	compound treatment	1.039	-0.0796	-1.07	1.157	-0.0461	-0.63	-1.2041	-0.9675	1914366	CBDivE_003049	Oc1c(/C=N\Nc2nc(OCC(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I10	compound treatment	1.136	0.0174	0.23	1.261	0.0579	0.79	0.724	0.8792	1055240	CBDivE_003050	COc1ccc(cc1OC)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I11	compound treatment	1.07	-0.0486	-0.66	1.209	0.00589	0.08	-0.407	-0.616	1914367	CBDivE_003051	CC(C)C/C(=N\O)/c1c(C)n(C)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I12	compound treatment	1.155	0.0364	0.49	1.239	0.0359	0.49	0.6931	1.0	1628887	CBDivE_003052	OC(=O)c1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I13	compound treatment	1.058	-0.0606	-0.82	1.281	0.0779	1.06	0.1728	0.1289	1914368	CBDivE_003053	Cc1ccc(/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I14	compound treatment	1.113	-0.00562	-0.08	1.209	0.00589	0.08	0.0032	0.0287	1914369	CBDivE_003054	Oc1ccc2ccccc2c1/C=N/Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I15	compound treatment	1.115	-0.00362	-0.05	1.224	0.0209	0.28	0.1669	0.5775	1914370	CBDivE_003055	COP(=O)(OC)C(Nc1ccc(cc1)[N+](=O)[O-])c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I16	compound treatment	1.145	0.0264	0.36	1.247	0.0439	0.6	0.6748	0.9692	1914371	CBDivE_003056	Cc1cc(CSC(=N)N)c(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I17	compound treatment	1.03	-0.0886	-1.2	1.243	0.0399	0.54	-0.4608	-0.3508	1914372	CBDivE_003057	CC(=O)CC(=O)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I18	compound treatment	1.121	0.00238	0.03	1.261	0.0579	0.79	0.5809	0.7353	1914373	CBDivE_003058	OCCCCOC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I19	compound treatment	1.121	0.00238	0.03	1.218	0.0149	0.2	0.1663	0.8089	1914374	CBDivE_003059	CC1CCOP(=O)(O1)C2(CCCCC2)Nc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	I20	compound treatment	1.156	0.0374	0.5	1.28	0.0769	1.05	1.098	0.9437	1050616	CBDivE_003060	COc1ccc(I)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J01	compound treatment	1.117	-0.00162	-0.02	1.241	0.0379	0.52	0.3499	0.6766	1023877	CBDivE_003061	CC(C)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J02	compound treatment	1.107	-0.0116	-0.16	1.271	0.0679	0.93	0.5438	0.5791	1914131	CBDivE_003062	CC(N)Cc1cn(Cc2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J03	compound treatment	1.097	-0.0216	-0.29	1.22	0.0169	0.23	-0.0434	-0.1168	1914375	CBDivE_003063	CCCCOCCC(=O)NNC(=O)CCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J04	compound treatment	1.069	-0.0496	-0.67	1.178	-0.0251	-0.34	-0.7155	-0.9516	1914376	CBDivE_003064	COc1ccccc1C(Nn2cnnc2)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J05	compound treatment	1.085	-0.0336	-0.45	1.148	-0.0551	-0.75	-0.8521	-0.9708	1914377	CBDivE_003065	Cc1ccc(O)c(N=Nc2ccc(cc2)S(=O)(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J06	compound treatment	1.132	0.0134	0.18	1.207	0.00389	0.05	0.1651	0.8777	1914378	CBDivE_003066	FC(F)(F)C(OP(=O)(c1ccccc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J07	compound treatment	1.115	-0.00362	-0.05	1.227	0.0239	0.33	0.1958	0.5945	1047868	CBDivE_003067	NC(=N)NCCCC(NC(=O)c1ccccc1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J08	compound treatment	1.088	-0.0306	-0.41	1.158	-0.0451	-0.62	-0.7271	-0.9812	1914379	CBDivE_003068	CCSc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J09	compound treatment	1.14	0.0214	0.29	1.228	0.0249	0.34	0.4439	0.9967	1914380	CBDivE_003069	Cc1cccc(NC(=O)CC(=O)c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J10	compound treatment	1.09	-0.0286	-0.39	1.187	-0.0161	-0.22	-0.4284	-0.9643	1246346	CBDivE_003070	COc1ccc(OCc2nc3ccccc3[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J11	compound treatment	1.056	-0.0626	-0.84	1.225	0.0219	0.3	-0.3863	-0.4312	1331844	CBDivE_003071	O=S1CCOCCOCCS(=O)CCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J12	compound treatment	1.124	0.00538	0.07	1.206	0.00289	0.04	0.0792	0.9587	1914381	CBDivE_003072	CC(C)(C)C(=O)NC(NC(=S)Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J13	compound treatment	1.072	-0.0466	-0.63	1.223	0.0199	0.27	-0.253	-0.3693	3006997	CBDivE_003073	NCCO.OC(=O)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J14	compound treatment	1.124	0.00538	0.07	1.178	-0.0251	-0.34	-0.1908	-0.5451	1914382	CBDivE_003074	COc1ccc(/C=C/2\CCC/C(=C\c3ccc(OC)cc3)/C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J15	compound treatment	1.073	-0.0456	-0.62	1.18	-0.0231	-0.32	-0.658	-0.9517	1708486	CBDivE_003075	CCOC(=O)C1=C(CC)NC2=C(C1c3ccc4OCOc4c3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J16	compound treatment	1.14	0.0214	0.29	1.179	-0.0241	-0.33	-0.0285	-0.0653	1041191	CBDivE_003076	NCCc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J17	compound treatment	1.118	-6.19E-4	-0.01	1.134	-0.0691	-0.94	-0.6723	-0.7133	1914383	CBDivE_003077	OC(=O)CCN(CC(=O)O)C(=O)c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J18	compound treatment	1.115	-0.00362	-0.05	1.193	-0.0101	-0.14	-0.132	-0.9025	1914384	CBDivE_003078	Cc1ccc(CCSCC(=O)O)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J19	compound treatment	1.099	-0.0196	-0.26	1.212	0.00889	0.12	-0.1015	-0.3485	1004724	CBDivE_003079	Oc1ccc(N=Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	J20	compound treatment	1.107	-0.0116	-0.16	1.223	0.0199	0.27	0.0809	0.2584	1192735	CBDivE_003080	OC(=O)c1ccc(cc1C(=O)O)C(=O)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K01	compound treatment	1.051	-0.0676	-0.91	1.221	0.0179	0.24	-0.4726	-0.5005	1914385	CBDivE_003081	CC1CCOP(=O)(O1)C(Nc2ccc(Cl)cc2)c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K02	compound treatment	1.142	0.0234	0.32	1.172	-0.0311	-0.42	-0.077	-0.1456	1914386	CBDivE_003082	N1N(N(N=C1c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K03	compound treatment	1.068	-0.0506	-0.68	1.204	8.87E-4	0.01	-0.4743	-0.6945	1032539	CBDivE_003083	S=C(NNc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K04	compound treatment	1.125	0.00638	0.09	1.188	-0.0151	-0.21	-0.0849	-0.3799	1011263	CBDivE_003084	CC(C)OC(=O)C(N)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K05	compound treatment	1.059	-0.0596	-0.8	1.232	0.0289	0.39	-0.2902	-0.324	1012001	CBDivE_003085	NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K06	compound treatment	1.13	0.0114	0.15	1.178	-0.0251	-0.34	-0.1336	-0.3559	1104687	CBDivE_003086	NC(=N)NCCCC(NC(=O)c1ccccc1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K07	compound treatment	1.094	-0.0246	-0.33	1.219	0.0159	0.22	-0.0817	-0.2059	1417869	CBDivE_003087	O=c1n(c2ccccn2)c(=O)c3cc4c(=O)n(c5ccccn5)c(=O)c4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K08	compound treatment	1.113	-0.00562	-0.08	1.191	-0.0121	-0.17	-0.1704	-0.9376	1914387	CBDivE_003088	COC(=O)C(N)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K09	compound treatment	1.119	3.81E-4	0.01	1.216	0.0129	0.18	0.1279	0.7275	1914388	CBDivE_003089	CC(C)Cc1ccc(cc1)C(C)C(=O)N/N=C/c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K10	compound treatment	1.171	0.0524	0.71	1.279	0.0759	1.03	1.2314	0.9827	1914389	CBDivE_003090	Clc1ccc(OCC(=O)Nc2cccc(OC(=O)COc3ccc(Cl)cc3Cl)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K11	compound treatment	1.144	0.0254	0.34	1.228	0.0249	0.34	0.4821	1.0	1914390	CBDivE_003091	CC(NC(=O)C(F)(F)F)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K12	compound treatment	1.114	-0.00462	-0.06	1.181	-0.0221	-0.3	-0.2573	-0.8356	1139498	CBDivE_003092	CCN(CCO)c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K13	compound treatment	1.13	0.0114	0.15	1.209	0.00589	0.08	0.1653	0.9543	1914391	CBDivE_003093	C/C(=N\N=C(\C)/c1cccc2ccccc12)/c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K14	compound treatment	1.155	0.0364	0.49	1.255	0.0519	0.71	0.8474	0.984	1914392	CBDivE_003094	O=C(c1ccccc1)n2ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K15	compound treatment	1.147	0.0284	0.38	1.197	-0.00611	-0.08	0.2118	0.5405	1914393	CBDivE_003095	C/C(=N\Nc1ccccc1)/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K16	compound treatment	1.113	-0.00562	-0.08	1.194	-0.00911	-0.12	-0.1415	-0.9719	1914394	CBDivE_003096	C(C/N=C/c1ccccc1)/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K17	compound treatment	1.06	-0.0586	-0.79	1.203	-1.13E-4	0.0	-0.5603	-0.7085	1914395	CBDivE_003097	C/C(=N\Nc1ccccc1)/c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K18	compound treatment	1.115	-0.00362	-0.05	1.206	0.00289	0.04	-0.0067	-0.1065	1914396	CBDivE_003098	CCCCCCCCS(=O)(=O)CCSC(=N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K19	compound treatment	1.022	-0.0966	-1.3	1.202	-0.00111	-0.02	-0.9324	-0.7153	1914397	CBDivE_003099	CCC(=O)CC(O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	K20	compound treatment	1.13	0.0114	0.15	1.256	0.0529	0.72	0.6185	0.8388	1009925	CBDivE_003100	CC(NC(=O)c1ccccc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L01	compound treatment	1.105	-0.0136	-0.18	1.232	0.0289	0.39	0.1486	0.3419	1103446	CBDivE_003101	OC(=O)C(Cc1ccccc1)NC=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L02	compound treatment	1.134	0.0154	0.21	1.205	0.00189	0.03	0.1649	0.7888	1914398	CBDivE_003102	OC(=O)C(Cc1cc(I)c(O)c(I)c1)NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L03	compound treatment	1.128	0.00938	0.13	1.223	0.0199	0.27	0.2813	0.9398	1450404	CBDivE_003103	COC(=O)c1nnn(c2nonc2N)c1C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L04	compound treatment	1.118	-6.19E-4	-0.01	1.21	0.00689	0.09	0.0605	0.6417	1914399	CBDivE_003104	Oc1ccc(/C=C/2\CCC/C(=C\c3ccc(O)cc3O)/C2=O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L05	compound treatment	1.148	0.0294	0.4	1.224	0.0209	0.28	0.4817	0.9869	1003119	CBDivE_003105	O=C(CC(=O)Nc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L06	compound treatment	1.139	0.0204	0.27	1.204	8.87E-4	0.01	0.203	0.7375	1914400	CBDivE_003106	OP(=O)(OC(c1ccccc1)C(F)(F)C(F)(F)C(F)(F)F)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L07	compound treatment	0.739	-0.38	-5.12	0.741	-0.462	-6.3	-8.0772	-0.9947	1005814	CBDivE_003107	Oc1c(O)c2C(=O)c3c(O)c(c(O)c(O)c3C(=O)c2c(O)c1S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L08	compound treatment	1.117	-0.00162	-0.02	1.128	-0.0751	-1.02	-0.7397	-0.722	1914401	CBDivE_003108	C(Cc1nc2ccccc2[nH]1)SCCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L09	compound treatment	1.075	-0.0436	-0.59	1.219	0.0159	0.22	-0.2629	-0.4193	1914402	CBDivE_003109	COc1ccc(O)c(c1)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L10	compound treatment	1.096	-0.0226	-0.31	1.152	-0.0511	-0.7	-0.7086	-0.9313	1914403	CBDivE_003110	CC(=O)Cc1ccccc1OCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L11	compound treatment	1.127	0.00838	0.11	1.207	0.00389	0.05	0.1174	0.9404	1681749	CBDivE_003111	CC(=O)Nc1c(Oc2ccccc2)c(NC(=O)C)c(Oc3ccccc3)c(NC(=O)C)c1Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L12	compound treatment	1.086	-0.0326	-0.44	1.186	-0.0171	-0.23	-0.4762	-0.956	1914404	CBDivE_003112	CC(C)(C)C(=O)NC(NC(=S)Nc1ccc(N=Nc2ccccc2)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L13	compound treatment	1.127	0.00838	0.11	1.177	-0.0261	-0.36	-0.1718	-0.4599	1914405	CBDivE_003113	CCN(CC)CCOC(=O)COc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L14	compound treatment	1.064	-0.0546	-0.74	1.165	-0.0381	-0.52	-0.8885	-0.9854	1914406	CBDivE_003114	Oc1ccc(/C=N/Cc2ccccc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L15	compound treatment	1.149	0.0304	0.41	1.175	-0.0281	-0.38	0.0187	0.0334	1914407	CBDivE_003115	[O-][N+](=O)c1ccc(cc1)C(=O)CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L16	compound treatment	1.042	-0.0766	-1.03	1.159	-0.0441	-0.6	-1.1562	-0.9668	1914408	CBDivE_003116	O=C(CC1(CC2CC3CC(C2)C1)C3)OCCNC(=O)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L17	compound treatment	1.149	0.0304	0.41	1.213	0.00989	0.13	0.3852	0.8927	1777132	CBDivE_003117	CCOC(=O)C1=C(CC)NC2=C(C1c3cc4OCOc4cc3[N+](=O)[O-])C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L18	compound treatment	1.092	-0.0266	-0.36	1.208	0.00489	0.07	-0.2068	-0.5662	1914409	CBDivE_003118	Cc1ccc(SCCc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L19	compound treatment	1.111	-0.00762	-0.1	1.22	0.0169	0.23	0.0902	0.3575	1484925	CBDivE_003119	CC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	L20	compound treatment	1.117	-0.00162	-0.02	1.199	-0.00411	-0.06	-0.0551	-0.9155	1914410	CBDivE_003120	OC(=O)c1cc(C(=O)O)c(cc1C(=O)O)C(=O)c2cc(C(=O)O)c(cc2C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M01	compound treatment	1.066	-0.0526	-0.71	1.227	0.0239	0.33	-0.2716	-0.3478	1914411	CBDivE_003121	CCCCCOC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M02	compound treatment	1.128	0.00938	0.13	1.216	0.0129	0.18	0.2138	0.987	3006536	CBDivE_003122	Cc1ccc(cc1)S(=O)(=O)O.NC(=N)SCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M03	compound treatment	1.112	-0.00662	-0.09	1.235	0.0319	0.43	0.2443	0.5504	1914412	CBDivE_003123	Clc1ccc(/N=C/c2c[nH]c3ccccc23)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M04	compound treatment	1.127	0.00838	0.11	1.225	0.0219	0.3	0.291	0.9118	1312287	CBDivE_003124	CC1=CCC2(CO)COC(C1C2)c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M05	compound treatment	1.114	-0.00462	-0.06	1.177	-0.0261	-0.36	-0.2959	-0.8184	1914413	CBDivE_003125	CCOc1ccc(cc1)C(Nc2ccc(C)cc2)P3(=O)Oc4ccccc4O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M06	compound treatment	1.143	0.0244	0.33	1.191	-0.0121	-0.17	0.1158	0.3146	1914414	CBDivE_003126	NNC(=O)CC1CC(=NN1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M07	compound treatment	1.11	-0.00862	-0.12	1.205	0.00189	0.03	-0.064	-0.5376	1914415	CBDivE_003127	Cc1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1/N=C/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M08	compound treatment	1.119	3.81E-4	0.01	1.203	-1.13E-4	0.0	0.0025	0.4748	1914416	CBDivE_003128	NC(=O)N/N=C/c1c2ccccc2cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M09	compound treatment	1.093	-0.0256	-0.35	1.138	-0.0651	-0.89	-0.8722	-0.9154	1914417	CBDivE_003129	CCOC(=O)C(=CNC(=O)C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M10	compound treatment	1.136	0.0174	0.23	1.204	8.87E-4	0.01	0.1744	0.7426	1775125	CBDivE_003130	[O-][N+](=O)c1cc(Cl)cc(Cl)c1OC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M11	compound treatment	1.093	-0.0256	-0.35	1.22	0.0169	0.23	-0.0816	-0.1964	1914418	CBDivE_003131	C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M12	compound treatment	1.156	0.0374	0.5	1.206	0.00289	0.04	0.3844	0.76	1367124	CBDivE_003132	Cc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M13	compound treatment	1.093	-0.0256	-0.35	1.218	0.0149	0.2	-0.1008	-0.2516	1914419	CBDivE_003133	C(=N/N=C/c1ccccc1)\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M14	compound treatment	1.144	0.0254	0.34	1.209	0.00589	0.08	0.2989	0.8498	1017061	CBDivE_003134	CC1(C)OCC(O1)C2OC(C)(C)OC2C3COC(C)(C)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M15	compound treatment	1.111	-0.00762	-0.1	1.202	-0.00111	-0.02	-0.0834	-0.8028	1914420	CBDivE_003135	C/C=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M16	compound treatment	1.136	0.0174	0.23	1.202	-0.00111	-0.02	0.1551	0.66	1014417	CBDivE_003136	[O-][N+](=O)c1ccc(N=Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M17	compound treatment	1.112	-0.00662	-0.09	1.224	0.0209	0.28	0.1383	0.4632	1914421	CBDivE_003137	C/C(=N\Nc1ccccc1)/c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M18	compound treatment	1.153	0.0344	0.46	1.254	0.0509	0.69	0.8186	0.9808	1914422	CBDivE_003138	ClC(=C(Cl)COC(=O)/C=C/C(=O)Nc1ccc(Cl)cc1Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M19	compound treatment	1.059	-0.0596	-0.8	1.189	-0.0141	-0.19	-0.7048	-0.8522	1914423	CBDivE_003139	C/C(=N\Nc1ccccc1)/c2ccc(cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	M20	compound treatment	1.149	0.0304	0.41	1.22	0.0169	0.23	0.4526	0.9628	1914424	CBDivE_003140	C(=N/C(\N=C\c1ccccc1)c2ccccc2)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N01	compound treatment	1.131	0.0124	0.17	1.176	-0.0271	-0.37	-0.1433	-0.3533	1120986	CBDivE_003141	CCOC(=O)C1=C(CC)NC2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N02	compound treatment	1.098	-0.0206	-0.28	1.169	-0.0341	-0.47	-0.5256	-0.9698	1036003	CBDivE_003142	NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N03	compound treatment	1.087	-0.0316	-0.43	1.157	-0.0461	-0.63	-0.7463	-0.9821	1068226	CBDivE_003143	Cc1ccc(cc1)S(=O)(=O)NC(CO)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N04	compound treatment	1.093	-0.0256	-0.35	1.194	-0.00911	-0.12	-0.3323	-0.9047	1914425	CBDivE_003144	CC(C)(C)C1=CC(=NO)C=C(C1=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N05	compound treatment	1.086	-0.0326	-0.44	1.215	0.0119	0.16	-0.1965	-0.4191	1914426	CBDivE_003145	Cc1cc(ccc1/N=C/c2ccco2)c3ccc(/N=C/c4ccco4)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N06	compound treatment	1.07	-0.0486	-0.66	1.19	-0.0131	-0.18	-0.5902	-0.8682	1914427	CBDivE_003146	Oc1ccc(cc1/N=C/c2cccnc2)S(=O)(=O)c3ccc(O)c(/N=C/c4cccnc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N07	compound treatment	1.052	-0.0666	-0.9	1.18	-0.0231	-0.32	-0.8584	-0.9013	1914428	CBDivE_003147	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccccc2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N08	compound treatment	1.068	-0.0506	-0.68	1.191	-0.0121	-0.17	-0.5997	-0.8535	1030945	CBDivE_003148	N=c1[nH][nH]c(=S)n1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N09	compound treatment	1.113	-0.00562	-0.08	1.242	0.0389	0.53	0.3214	0.5999	1914429	CBDivE_003149	CC(COC(=O)COc1ccc(Cl)cc1)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N10	compound treatment	1.106	-0.0126	-0.17	1.186	-0.0171	-0.23	-0.2854	-0.988	1445306	CBDivE_003150	OC1(COc2ccccc2OC1C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N11	compound treatment	1.05	-0.0686	-0.93	1.214	0.0109	0.15	-0.5496	-0.5862	1002838	CBDivE_003151	CC(=O)OCC(COC(=O)C)(COC(=O)C)COC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N12	compound treatment	1.043	-0.0756	-1.02	1.186	-0.0171	-0.23	-0.8864	-0.847	1914430	CBDivE_003152	Clc1ccc(OCC(=O)NNC(=O)Nc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N13	compound treatment	1.083	-0.0356	-0.48	1.144	-0.0591	-0.81	-0.9098	-0.9694	1914431	CBDivE_003153	CN1CCN(CC1)C(=O)CCCCCCCCC(=O)N2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N14	compound treatment	1.122	0.00338	0.05	1.203	-1.13E-4	0.0	0.0312	0.6829	1914432	CBDivE_003154	[O-][N+](=O)NC(=N)N/N=C/c1ccccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N15	compound treatment	1.058	-0.0606	-0.82	1.174	-0.0291	-0.4	-0.859	-0.9449	1007436	CBDivE_003155	OC(=O)COc1ccccc1OCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N16	compound treatment	1.116	-0.00262	-0.04	1.193	-0.0101	-0.14	-0.1225	-0.8605	1914433	CBDivE_003156	COC(=O)c1ccc(NC(=O)c2cc[n+]([O-])cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N17	compound treatment	1.09	-0.0286	-0.39	1.203	-1.13E-4	0.0	-0.2741	-0.7099	1777155	CBDivE_003157	CCOC(=O)C1=C(CC)NC2=C(C1c3ccc(cc3)[N+](=O)[O-])C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N18	compound treatment	1.067	-0.0516	-0.7	1.213	0.00989	0.13	-0.3971	-0.5598	1914434	CBDivE_003158	C(Cc1ccncc1)SCc2ccc3CCc4cccc2c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N19	compound treatment	1.138	0.0194	0.26	1.167	-0.0361	-0.49	-0.1633	-0.2929	1034133	CBDivE_003159	O=C(OCc1ccccc1)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	N20	compound treatment	1.134	0.0154	0.21	1.215	0.0119	0.16	0.2613	0.9925	1914435	CBDivE_003160	C(c1ccc2nn[nH]c2c1)c3ccc4nn[nH]c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O01	compound treatment	1.063	-0.0556	-0.75	1.228	0.0249	0.34	-0.2906	-0.3529	1914436	CBDivE_003161	COc1ccc(/N=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O02	compound treatment	1.096	-0.0226	-0.31	1.287	0.0839	1.14	0.5931	0.501	1914437	CBDivE_003162	Oc1ccccc1/C=N/c2ccc(cc2)S(=O)(=O)c3ccc(\N=C\c4ccccc4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O03	compound treatment	1.09	-0.0286	-0.39	1.24	0.0369	0.5	0.0827	0.1304	1914438	CBDivE_003163	Cc1cccc(/N=C/c2ccc(O)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O04	compound treatment	1.126	0.00738	0.1	1.18	-0.0231	-0.32	-0.1525	-0.4612	1003061	CBDivE_003164	OC(=O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O05	compound treatment	1.108	-0.0106	-0.14	1.244	0.0409	0.56	0.293	0.5089	1914439	CBDivE_003165	CC(C)OP(=O)(OC(C)C)C(C)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O06	compound treatment	1.152	0.0334	0.45	1.196	-0.00711	-0.1	0.2498	0.5424	1914440	CBDivE_003166	COc1ccc(cc1)C2OCC3(CO)CC=C(C)C2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O07	compound treatment	1.063	-0.0556	-0.75	1.22	0.0169	0.23	-0.3677	-0.4685	1113442	CBDivE_003167	CCCCCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O08	compound treatment	1.121	0.00238	0.03	1.219	0.0159	0.22	0.1759	0.8032	1020131	CBDivE_003168	Cc1ccc(cc1)S(=O)(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O09	compound treatment	1.137	0.0184	0.25	1.188	-0.0151	-0.21	0.0296	0.0919	1914441	CBDivE_003169	CC(=O)NNc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O10	compound treatment	1.169	0.0504	0.68	1.203	-1.13E-4	0.0	0.4795	0.7055	1914442	CBDivE_003170	O=C(Oc1ccc(cc1)C2(OC(=O)c3ccccc32)c4ccc(OC(=O)c5ccc(cc5)c6ccccc6)cc4)c7ccc(cc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O11	compound treatment	1.038	-0.0806	-1.09	1.165	-0.0381	-0.52	-1.1365	-0.9429	1914443	CBDivE_003171	CCOc1ccc(cc1)C(Nc2ccc(C)cc2)P3(=O)OCCC(C)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O12	compound treatment	1.123	0.00438	0.06	1.237	0.0339	0.46	0.3685	0.7911	1914444	CBDivE_003172	CC(=O)NCCSC(=O)c1ccccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O13	compound treatment	1.065	-0.0536	-0.72	1.214	0.0109	0.15	-0.4065	-0.5505	1357529	CBDivE_003173	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccco3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O14	compound treatment	1.149	0.0304	0.41	1.206	0.00289	0.04	0.3177	0.7715	1548531	CBDivE_003174	O=C(CCCN1C(=O)c2ccccc2C1=O)N3CCc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O15	compound treatment	1.136	0.0174	0.23	1.22	0.0169	0.23	0.3286	1.0	1914445	CBDivE_003175	CCCN1C/C(=C\c2ccc(cc2)N(C)C)/C3=C(C1)C(NC(=S)N3)c4ccc(cc4)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O16	compound treatment	1.126	0.00738	0.1	1.218	0.0149	0.2	0.214	0.9462	1022593	CBDivE_003176	Cc1ccc(N=Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O17	compound treatment	1.171	0.0524	0.71	1.262	0.0589	0.8	1.0675	0.998	1914446	CBDivE_003177	CCC(=O)CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3sc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O18	compound treatment	1.064	-0.0546	-0.74	1.181	-0.0221	-0.3	-0.7342	-0.9222	3105858	CBDivE_003178	Cc1ccc(cc1)S(=O)(=O)O.NC(=N)SCCS(=O)(=O)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O19	compound treatment	1.118	-6.19E-4	-0.01	1.222	0.0189	0.26	0.1762	0.6838	1914448	CBDivE_003179	NC(=N)Sc1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	O20	compound treatment	1.156	0.0374	0.5	1.232	0.0289	0.39	0.6351	0.9925	1376851	CBDivE_003180	OC(=O)CS(=O)(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P01	compound treatment	1.107	-0.0116	-0.16	1.184	-0.0191	-0.26	-0.2951	-0.9704	1013305	CBDivE_003181	CCN(CC)CCOC(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P02	compound treatment	1.098	-0.0206	-0.28	1.176	-0.0271	-0.37	-0.4581	-0.9902	1246284	CBDivE_003182	COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3C(=O)O)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P03	compound treatment	1.034	-0.0846	-1.14	1.231	0.0279	0.38	-0.5383	-0.4474	1914449	CBDivE_003183	NCCc1n[nH]c(n1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P04	compound treatment	1.081	-0.0376	-0.51	1.128	-0.0751	-1.02	-1.0831	-0.9475	1914450	CBDivE_003184	OC(=O)c1ccc(Nc2nc(Cl)nc(Cl)n2)cc1c3c4ccc(O)cc4oc5cc(=O)ccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P05	compound treatment	1.06	-0.0586	-0.79	1.129	-0.0741	-1.01	-1.2738	-0.9926	1914332	CBDivE_003185	CN(C)CCNC(=O)COc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P06	compound treatment	1.069	-0.0496	-0.67	1.143	-0.0601	-0.82	-1.053	-0.9949	1914451	CBDivE_003186	C/C(=N/NC(=S)N)/C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P07	compound treatment	1.061	-0.0576	-0.78	1.138	-0.0651	-0.89	-1.1775	-0.9978	1914452	CBDivE_003187	COc1nccnc1NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccco3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P08	compound treatment	1.184	0.0654	0.88	1.142	-0.0611	-0.83	0.0344	0.0284	1914453	CBDivE_003188	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CSc2nncn2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P09	compound treatment	1.095	-0.0236	-0.32	1.216	0.0129	0.18	-0.101	-0.2777	1113570	CBDivE_003189	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P10	compound treatment	1.02	-0.0986	-1.33	1.183	-0.0201	-0.27	-1.1347	-0.8353	1914454	CBDivE_003190	CC(=O)COc1ccccc1OCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P11	compound treatment	1.012	-0.107	-1.44	1.137	-0.0661	-0.9	-1.6546	-0.9747	1914455	CBDivE_003191	OCCNC(=O)c1nc[nH]c1C(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P12	compound treatment	1.154	0.0354	0.48	1.144	-0.0591	-0.81	-0.2325	-0.2482	1914456	CBDivE_003192	CC(C)(C)C(=O)NC(NC(=S)Nc1cccc(c1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P13	compound treatment	1.011	-0.108	-1.45	1.21	0.00689	0.09	-0.9602	-0.66	1530959	CBDivE_003193	Cc1ccc(cc1)S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P14	compound treatment	1.121	0.00238	0.03	1.15	-0.0531	-0.72	-0.4894	-0.6751	1914457	CBDivE_003194	CC(C)N/C(=N/C(=N/S(=O)(=O)c1ccccc1)/c2ccccc2)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P15	compound treatment	1.131	0.0124	0.17	1.193	-0.0101	-0.14	0.0206	0.0951	1103374	CBDivE_003195	CC(C)(C)OC(=O)NC(CCCCNC=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P16	compound treatment	1.102	-0.0166	-0.22	1.142	-0.0611	-0.83	-0.7478	-0.8665	1259648	CBDivE_003196	COc1ccc(NC(=O)C(C(=O)Nc2ccc(OC)cc2)C3(CC4CC5CC(C4)C3)C5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P17	compound treatment	1.174	0.0554	0.75	1.221	0.0179	0.24	0.7008	0.8916	1914458	CBDivE_003197	COc1cc(ccc1NN=Nc2ccccc2I)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P18	compound treatment	1.057	-0.0616	-0.83	1.172	-0.0311	-0.42	-0.8878	-0.9513	1914459	CBDivE_003198	CC(C)c1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P19	compound treatment	1.095	-0.0236	-0.32	1.17	-0.0331	-0.45	-0.5446	-0.9854	1914460	CBDivE_003199	CCCCCC(=O)NCCCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.10	P20	compound treatment	1.096	-0.0226	-0.31	1.213	0.00989	0.13	-0.1204	-0.361	1018996	CBDivE_003200	NNC(=O)CCCCCCCCC(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A01	compound treatment	1.146	0.0313	0.42	1.24	0.057	0.78	0.8482	0.9589	1914461	CBDivE_003201	CCN(CC)CCCOC(=O)C(OC(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A02	compound treatment	1.091	-0.0237	-0.32	1.274	0.091	1.24	0.6514	0.5084	1914462	CBDivE_003202	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCNCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A03	compound treatment	1.128	0.0133	0.18	1.253	0.07	0.95	0.8018	0.8256	1736700	CBDivE_003203	Cc1ccc(CCS(=O)(=O)c2ccc(cc2)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A04	compound treatment	1.167	0.0523	0.71	1.261	0.078	1.06	1.251	0.9802	1914463	CBDivE_003204	O=C(COC(=O)c1ccc(C(=O)OCC(=O)c2ccccc2)c(c1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A05	compound treatment	1.072	-0.0427	-0.58	1.186	0.00299	0.04	-0.3784	-0.6554	1914464	CBDivE_003205	OC(=O)/C=C/C(=O)Nc1ccc2nn(nc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A06	compound treatment	1.153	0.0383	0.52	1.198	0.015	0.2	0.51	0.9176	1914465	CBDivE_003206	Cc1ccc(cc1)S(=O)(=O)NC(CC2CNc3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A07	compound treatment	1.124	0.00931	0.13	1.198	0.015	0.2	0.2334	0.9726	1914466	CBDivE_003207	COc1cccc(c1)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A08	compound treatment	1.159	0.0443	0.6	1.18	-0.00301	-0.04	0.3937	0.657	1284137	CBDivE_003208	Clc1ccc(OCC(=O)Nc2cccc3c(NC(=O)COc4ccc(Cl)cc4Cl)cccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A09	compound treatment	1.093	-0.0217	-0.29	1.267	0.084	1.15	0.603	0.5101	1914467	CBDivE_003209	COc1ccccc1NC(=O)C(C)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A10	compound treatment	1.14	0.0253	0.34	1.241	0.058	0.79	0.8006	0.9295	1914468	CBDivE_003210	C/C(=N/NC(=O)c1cccc(I)c1)/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A11	compound treatment	1.119	0.00431	0.06	1.173	-0.01	-0.14	-0.0554	-0.3735	1914469	CBDivE_003211	CC(C)(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A12	compound treatment	1.161	0.0463	0.62	1.202	0.019	0.26	0.6249	0.924	1914470	CBDivE_003212	CC(C)(C)c1cc(Br)cc(/C=N/[C@@H]2CCCC[C@H]2\N=C\c3cc(Br)cc(c3O)C(C)(C)C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A13	compound treatment	1.191	0.0763	1.03	1.228	0.045	0.61	1.1618	0.9694	1914471	CBDivE_003213	CC(C)C(Nc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A14	compound treatment	1.157	0.0423	0.57	1.138	-0.045	-0.61	-0.0304	-0.0363	1402071	CBDivE_003214	Cc1cc(O)c(C2=NCCSC(C2)c3ccccc3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A15	compound treatment	1.081	-0.0337	-0.45	1.14	-0.043	-0.59	-0.7361	-0.9921	1914472	CBDivE_003215	Cc1cccc(NC(=S)NNC(=S)NNC(=S)Nc2cccc(C)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A16	compound treatment	1.191	0.0763	1.03	1.201	0.018	0.25	0.9014	0.8518	1131738	CBDivE_003216	CC1(NC(=O)NC1=O)c2cccc(OCc3cccc(Cl)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A17	compound treatment	1.084	-0.0307	-0.41	1.02	-0.163	-2.22	-1.8646	-0.8246	1914473	CBDivE_003217	COc1ccc(NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A18	compound treatment	1.145	0.0303	0.41	1.215	0.032	0.44	0.5976	0.9995	1914474	CBDivE_003218	CCCCCNC(=O)/C(=C(/Sc1ccc(Cl)cc1)\c2ccccc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A19	compound treatment	1.114	-6.91E-4	-0.01	0.854	-0.329	-4.49	-3.179	-0.7086	1914475	CBDivE_003219	[O-][N+](=O)c1ccccc1NC(=S)NC(NC(=O)c2ccccc2Br)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	A20	compound treatment	1.086	-0.0287	-0.39	1.262	0.079	1.08	0.488	0.4263	1298399	CBDivE_003220	Brc1ccc(cc1)C(=O)COC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B01	compound treatment	1.16	0.0453	0.61	1.237	0.054	0.74	0.9528	0.9957	1914476	CBDivE_003221	O=P(OC1CS(=O)(=O)C=C1)(Oc2ccccc2)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B02	compound treatment	1.124	0.00931	0.13	1.165	-0.018	-0.25	-0.0848	-0.3076	1587985	CBDivE_003222	CCN(CC)CCC1S(=O)(=O)C(C(C(C(=O)OC)S1(=O)=O)c2ccc(OC)cc2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B03	compound treatment	1.074	-0.0407	-0.55	1.158	-0.025	-0.34	-0.6293	-0.9738	1914477	CBDivE_003223	CC1=CCN(/S(=N/S(=O)(=O)c2ccccc2)/C1)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B04	compound treatment	1.151	0.0363	0.49	1.264	0.081	1.1	1.1273	0.9331	1914478	CBDivE_003224	Oc1ccc(cc1/C=N/CCCCCC\N=C\c2cc(ccc2O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B05	compound treatment	1.126	0.0113	0.15	1.178	-0.00501	-0.07	0.0596	0.3564	1914479	CBDivE_003225	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B06	compound treatment	1.104	-0.0107	-0.14	1.187	0.00399	0.05	-0.0635	-0.412	1122523	CBDivE_003226	CC1(C)C(CCC1(C)C(=O)O)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B07	compound treatment	1.155	0.0403	0.54	1.241	0.058	0.79	0.9437	0.9833	1914480	CBDivE_003227	C/C(=N/NC(=O)COc1ccccc1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B08	compound treatment	1.098	-0.0167	-0.23	1.127	-0.056	-0.76	-0.6993	-0.8782	1914481	CBDivE_003228	OC(=O)c1ccccc1N2C(=O)c3cccc([N+](=O)[O-])c3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B09	compound treatment	1.126	0.0113	0.15	1.169	-0.014	-0.19	-0.0272	-0.1113	1914482	CBDivE_003229	Cc1cccc(C)c1NC(=O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B10	compound treatment	1.105	-0.00969	-0.13	1.216	0.033	0.45	0.2257	0.4817	1417895	CBDivE_003230	Clc1cc(N(C(=O)c2ccccc2)S(=O)(=O)c3ccccc3)c(Cl)c(Cl)c1OC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B11	compound treatment	1.167	0.0523	0.71	1.18	-0.00301	-0.04	0.47	0.6649	1107484	CBDivE_003231	O=C1C(=C2Nc3ccccc3N2)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B12	compound treatment	1.127	0.0123	0.17	1.172	-0.011	-0.15	0.0113	0.0503	535	CBDivE_003232	ONC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B13	compound treatment	1.138	0.0233	0.31	1.204	0.021	0.29	0.4248	0.9989	1914483	CBDivE_003233	Brc1ccc(cc1)C(=O)COC(=O)C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B14	compound treatment	1.017	-0.0977	-1.32	1.205	0.022	0.3	-0.7199	-0.5326	1083251	CBDivE_003234	OC(=O)c1ccc(cc1[N+](=O)[O-])N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B15	compound treatment	1.192	0.0773	1.04	1.243	0.06	0.82	1.3159	0.9928	1914484	CBDivE_003235	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B16	compound treatment	1.133	0.0183	0.25	1.15	-0.033	-0.45	-0.1436	-0.2797	1532004	CBDivE_003236	OC(=O)c1cccc(NCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B17	compound treatment	1.178	0.0633	0.85	1.157	-0.026	-0.35	0.3531	0.3819	1913266	CBDivE_003237	OC(=O)CN1C(=O)/C(=C\2/Sc3ccccc3N2CCCS(=O)(=O)O)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B18	compound treatment	1.123	0.00831	0.11	1.177	-0.00601	-0.08	0.0213	0.1535	1914485	CBDivE_003238	CC(CCC(=O)C(C)C1C(=O)CC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C)CNC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B19	compound treatment	1.159	0.0443	0.6	1.248	0.065	0.89	1.0493	0.9816	1914486	CBDivE_003239	[O-][N+](=O)c1ccc(C(=O)OCC(=O)c2ccc(Br)cc2)c(c1)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	B20	compound treatment	1.13	0.0153	0.21	1.19	0.00699	0.1	0.2134	0.9383	1914487	CBDivE_003240	OC(CNC(=S)Nc1ccccc1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C01	compound treatment	1.09	-0.0247	-0.33	1.214	0.031	0.42	0.0633	0.1176	1914488	CBDivE_003241	CC/1(C)C2CCC(C)(C2)\C1=N\NC(=O)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C02	compound treatment	1.151	0.0363	0.49	1.241	0.058	0.79	0.9055	0.9735	1483761	CBDivE_003242	CC1(C)OC(C(O1)C(=O)NC2CCCCC2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C03	compound treatment	1.116	0.00131	0.02	1.159	-0.024	-0.33	-0.219	-0.668	1124232	CBDivE_003243	Cc1ccc(CCC(=O)Nc2ccc(NC(=O)CCc3ccc(C)o3)cc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C04	compound treatment	1.15	0.0353	0.48	1.174	-0.00901	-0.12	0.25	0.5081	1914489	CBDivE_003244	Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2c3ccccc3C(=O)OCC(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C05	compound treatment	1.09	-0.0247	-0.33	1.187	0.00399	0.05	-0.1971	-0.5838	1914490	CBDivE_003245	Clc1ccccc1C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C06	compound treatment	1.129	0.0143	0.19	1.217	0.034	0.46	0.4643	0.9246	1914491	CBDivE_003246	CC(C)CC(=O)NC(NC(=S)Nc1cccc(c1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C07	compound treatment	1.085	-0.0297	-0.4	1.162	-0.021	-0.29	-0.4858	-0.9865	1592383	CBDivE_003247	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CSc2nnnn2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C08	compound treatment	1.1	-0.0147	-0.2	1.224	0.041	0.56	0.2551	0.4302	1914492	CBDivE_003248	Clc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C09	compound treatment	1.052	-0.0627	-0.85	1.118	-0.065	-0.89	-1.2249	-0.9997	1914493	CBDivE_003249	COC(=O)c1ccccc1NC(=O)C(C)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C10	compound treatment	1.101	-0.0137	-0.18	1.177	-0.00601	-0.08	-0.1885	-0.9331	1914494	CBDivE_003250	OC(=O)c1ccccc1C(=O)NNC(=O)c2cccc(I)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C11	compound treatment	1.132	0.0173	0.23	1.181	-0.00201	-0.03	0.1457	0.6199	1914495	CBDivE_003251	ClC(Cl)(Cl)C(NC(=O)/C=C/c1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C12	compound treatment	1.14	0.0253	0.34	1.239	0.056	0.76	0.7813	0.9342	1005473	CBDivE_003252	OC(=O)c1nc([nH]c1C(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C13	compound treatment	1.076	-0.0387	-0.52	1.147	-0.036	-0.49	-0.7163	-0.9995	1774660	CBDivE_003253	OC(=O)CNS(=O)(=O)/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C14	compound treatment	1.12	0.00531	0.07	1.239	0.056	0.76	0.5905	0.7701	1914496	CBDivE_003254	Oc1cccc(C=c2sc3=NCCCn3c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C15	compound treatment	1.145	0.0303	0.41	1.176	-0.00701	-0.1	0.2215	0.5276	1914497	CBDivE_003255	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C16	compound treatment	1.148	0.0333	0.45	1.207	0.024	0.33	0.5491	0.9878	1042637	CBDivE_003256	C(N1CCOCC1)c2ccc(CN3CCOCC3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C17	compound treatment	1.089	-0.0257	-0.35	1.168	-0.015	-0.2	-0.3898	-0.9684	1914498	CBDivE_003257	COc1ccccc1NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C18	compound treatment	1.053	-0.0617	-0.83	1.223	0.04	0.55	-0.2029	-0.2039	1914499	CBDivE_003258	Clc1ccc(S/C(=C(\NC(=O)c2ccccc2)/C(=O)NCC=C)/c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C19	compound treatment	1.073	-0.0417	-0.56	1.177	-0.00601	-0.08	-0.4556	-0.8017	1914500	CBDivE_003259	COc1ccc(cc1NC(=S)NC(NC(=O)c2ccccc2Br)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	C20	compound treatment	1.113	-0.00169	-0.02	1.218	0.035	0.48	0.3213	0.6725	1129784	CBDivE_003260	Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D01	compound treatment	1.121	0.00631	0.09	1.212	0.029	0.4	0.3397	0.8401	1206216	CBDivE_003261	OC(=O)c1cccc(Oc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D02	compound treatment	1.107	-0.00769	-0.1	1.155	-0.028	-0.38	-0.3434	-0.8677	1914501	CBDivE_003262	COc1ccc(cc1)C(SCC(=O)O)SCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D03	compound treatment	1.081	-0.0337	-0.45	1.18	-0.00301	-0.04	-0.3504	-0.7678	1914502	CBDivE_003263	CC(C)(C)N/S(=N/S(=O)(=O)c1ccccc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D04	compound treatment	1.023	-0.0917	-1.24	1.128	-0.055	-0.75	-1.4051	-0.9713	1914503	CBDivE_003264	Cc1cc(I)ccc1NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D05	compound treatment	1.122	0.00731	0.1	1.204	0.021	0.29	0.2721	0.8989	1914504	CBDivE_003265	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D06	compound treatment	1.024	-0.0907	-1.22	1.128	-0.055	-0.75	-1.3956	-0.9724	1687551	CBDivE_003266	CCOC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D07	compound treatment	1.122	0.00731	0.1	1.17	-0.013	-0.18	-0.0557	-0.2745	1914505	CBDivE_003267	Oc1ccc2ccccc2c1/C=N/NC(=O)COc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D08	compound treatment	1.117	0.00231	0.03	1.175	-0.00801	-0.11	-0.0552	-0.486	1914506	CBDivE_003268	Oc1ccc(cc1/C=N/CC\N=C\c2cc(ccc2O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D09	compound treatment	1.117	0.00231	0.03	1.203	0.02	0.27	0.2148	0.7828	1010311	CBDivE_003269	C(N1CCN(Cc2ccccc2)CC1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D10	compound treatment	1.136	0.0213	0.29	1.196	0.013	0.18	0.3285	0.9729	1312098	CBDivE_003270	Clc1cc(ccc1OC(=O)c2ccccc2)N(C(=O)c3ccccc3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D11	compound treatment	1.141	0.0263	0.35	1.157	-0.026	-0.35	2.0E-4	4.0E-4	1914507	CBDivE_003271	O=C(Oc1ccccc1)/C(=C/c2nc3ccccc3n2C(=O)c4ccccc4)/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D12	compound treatment	1.1	-0.0147	-0.2	1.138	-0.045	-0.61	-0.5741	-0.8902	1913604	CBDivE_003272	OC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D13	compound treatment	1.099	-0.0157	-0.21	1.159	-0.024	-0.33	-0.3812	-0.9777	1775341	CBDivE_003273	CC1(C)C(CCC1(C)C(=O)OCC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)OCC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D14	compound treatment	1.094	-0.0207	-0.28	1.174	-0.00901	-0.12	-0.2842	-0.932	1210291	CBDivE_003274	CN(C)CCOC(=O)c1ccc2[nH]c3CCSCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D15	compound treatment	1.165	0.0503	0.68	1.138	-0.045	-0.61	0.0459	0.0502	1387642	CBDivE_003275	Cc1ccccc1OCC(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D16	compound treatment	1.084	-0.0307	-0.41	1.099	-0.084	-1.15	-1.1028	-0.9054	1914508	CBDivE_003276	CN(C)CCO/N=C(\c1ccccc1)/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D17	compound treatment	1.156	0.0413	0.56	1.163	-0.02	-0.27	0.2011	0.3241	1914509	CBDivE_003277	CCN1/C(=C\2/SC(=S)N(CC(=O)O)C2=O)/Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D18	compound treatment	1.11	-0.00469	-0.06	1.17	-0.013	-0.18	-0.1702	-0.9036	1739297	CBDivE_003278	OC(=O)c1ccc(NC(=O)c2ccccc2C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D19	compound treatment	1.144	0.0293	0.4	1.242	0.059	0.8	0.8484	0.9465	1775345	CBDivE_003279	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)c2cccc(c2)C(=O)OCC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	D20	compound treatment	1.132	0.0173	0.23	1.188	0.00499	0.07	0.2132	0.8767	1914510	CBDivE_003280	CN(S(=O)(=O)c1ccc(F)cc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E01	compound treatment	1.13	0.0153	0.21	1.183	-9.4E-6	0.0	0.146	0.7067	1914511	CBDivE_003281	OCCN(CCO)C1=NC2C(N=C(N=C2N3CCCCC3)N(CCO)CCO)C(=N1)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E02	compound treatment	1.154	0.0393	0.53	1.203	0.02	0.27	0.5677	0.9522	1914512	CBDivE_003282	OCCNC(=O)/C(=C\c1ccc(Cl)cc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E03	compound treatment	1.109	-0.00569	-0.08	1.158	-0.025	-0.34	-0.2954	-0.8451	1914513	CBDivE_003283	CC(=O)c1ccccc1NC(=O)CCc2ccc(C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E04	compound treatment	1.143	0.0283	0.38	1.235	0.052	0.71	0.7714	0.9579	1701328	CBDivE_003284	Cc1ccccc1OCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E05	compound treatment	1.102	-0.0127	-0.17	1.143	-0.04	-0.55	-0.5068	-0.8864	1914514	CBDivE_003285	Clc1ccccc1C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E06	compound treatment	1.159	0.0443	0.6	1.188	0.00499	0.07	0.4708	0.7826	1914515	CBDivE_003286	CCN(CC)CCCOC(=O)C(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E07	compound treatment	1.068	-0.0467	-0.63	1.206	0.023	0.31	-0.2237	-0.318	1873876	CBDivE_003287	[O-][N+](=O)c1ccc(cc1)c2csc(=Nc3ccccc3)n2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E08	compound treatment	1.109	-0.00569	-0.08	1.185	0.00199	0.03	-0.0351	-0.4309	1914516	CBDivE_003288	C/C(=N\NC(=O)COc1ccccc1)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E09	compound treatment	1.143	0.0283	0.38	1.155	-0.028	-0.38	0.0	0.0	1334672	CBDivE_003289	CC(=O)Nc1ccc2nc(C)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E10	compound treatment	1.111	-0.00369	-0.05	1.199	0.016	0.22	0.119	0.532	1914517	CBDivE_003290	OC(=O)/C=C\C(=O)NNC(=O)C1CC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E11	compound treatment	1.046	-0.0687	-0.93	1.133	-0.05	-0.68	-1.1375	-0.9886	1914518	CBDivE_003291	[O-][N+](=O)c1ccc(cc1)C(=O)NC(NC(=S)Nc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E12	compound treatment	1.082	-0.0327	-0.44	1.222	0.039	0.53	0.0641	0.0928	1774525	CBDivE_003292	OC(CNCc1ccccc1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E13	compound treatment	1.037	-0.0777	-1.05	1.204	0.021	0.29	-0.5387	-0.4958	1914519	CBDivE_003293	Cc1cc(C)n(c1/C=N\Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E14	compound treatment	1.11	-0.00469	-0.06	1.289	0.106	1.45	0.9773	0.6755	1914520	CBDivE_003294	Fc1c(F)c(Oc2ccc(NC(=O)NC3CCS(=O)(=O)C3)cc2)c(F)c(F)c1Oc4ccc(NC(=O)NC5CCS(=O)(=O)C5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E15	compound treatment	1.084	-0.0307	-0.41	1.171	-0.012	-0.16	-0.4086	-0.9176	1914521	CBDivE_003295	Cc1ccc(NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E16	compound treatment	1.064	-0.0507	-0.68	1.203	0.02	0.27	-0.2908	-0.395	1914522	CBDivE_003296	SCC(=O)Nc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E17	compound treatment	1.072	-0.0427	-0.58	1.169	-0.014	-0.19	-0.5423	-0.8938	1914523	CBDivE_003297	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E18	compound treatment	1.114	-6.91E-4	-0.01	1.179	-0.00401	-0.05	-0.0452	-0.8158	1914524	CBDivE_003298	Clc1ccccc1C(=O)NC(Nc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E19	compound treatment	1.086	-0.0287	-0.39	1.175	-0.00801	-0.11	-0.3509	-0.8726	1914525	CBDivE_003299	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)c2ccccc2Br)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	E20	compound treatment	1.11	-0.00469	-0.06	1.227	0.044	0.6	0.3794	0.629	1914526	CBDivE_003300	[O-][N+](=O)c1cccc(C(=O)OCC(=O)c2ccc(Br)cc2)c1C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F01	compound treatment	1.067	-0.0477	-0.64	1.228	0.045	0.61	-0.0211	-0.0238	1914527	CBDivE_003301	OC1CS(=O)(=O)CC1N(CC(=O)O)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F02	compound treatment	1.087	-0.0277	-0.37	1.182	-0.00101	-0.01	-0.2739	-0.7327	1914528	CBDivE_003302	O=S(=O)(Cc1nc2ccccc2[nH]1)CS(=O)(=O)Cc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F03	compound treatment	1.094	-0.0207	-0.28	1.197	0.014	0.19	-0.0625	-0.1848	1914529	CBDivE_003303	O=S(=O)(/N=S\1/NC(=Nc2ccccc12)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F04	compound treatment	1.07	-0.0447	-0.6	1.184	9.91E-4	0.01	-0.4168	-0.6911	3005606	CBDivE_003304	CCOP(=O)(O)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F05	compound treatment	1.136	0.0213	0.29	1.182	-0.00101	-0.01	0.1935	0.6725	1740952	CBDivE_003305	Oc1ccccc1OCC(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F06	compound treatment	1.08	-0.0347	-0.47	1.14	-0.043	-0.59	-0.7456	-0.9937	1914530	CBDivE_003306	COc1ccc(N2C(=O)c3ccc(cc3C2=O)C(=O)O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F07	compound treatment	1.11	-0.00469	-0.06	1.119	-0.064	-0.87	-0.662	-0.7564	1914531	CBDivE_003307	O=C(COc1ccccc1)NNC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F08	compound treatment	1.111	-0.00369	-0.05	1.178	-0.00501	-0.07	-0.0835	-0.9879	1914532	CBDivE_003308	Oc1ccc(Br)cc1/C=N/CCCCCC\N=C\c2cc(Br)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F09	compound treatment	1.138	0.0233	0.31	1.19	0.00699	0.1	0.2898	0.8818	1052060	CBDivE_003309	O=C(NC(NC(=O)c1ccccc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F10	compound treatment	1.075	-0.0397	-0.54	1.129	-0.054	-0.74	-0.8994	-0.9877	1914533	CBDivE_003310	ClC1=C(Cl)/C(=N/S(=O)(=O)c2ccccc2)/c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F11	compound treatment	1.113	-0.00169	-0.02	1.162	-0.021	-0.29	-0.2187	-0.761	1914534	CBDivE_003311	O=S(=O)(Oc1ccc2ccccc2c1Cc3c(OS(=O)(=O)c4ccccc4)ccc5ccccc35)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F12	compound treatment	1.086	-0.0287	-0.39	1.108	-0.075	-1.02	-0.997	-0.9116	1914535	CBDivE_003312	OCCNS(=O)(=O)c1ccc(/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F13	compound treatment	1.14	0.0253	0.34	1.183	-9.4E-6	0.0	0.2413	0.7068	1914536	CBDivE_003313	Brc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F14	compound treatment	1.114	-6.91E-4	-0.01	1.229	0.046	0.63	0.4369	0.6965	1706486	CBDivE_003314	Nc1cccc(c1)C(=O)Oc2ccc(OC(=O)c3cccc(N)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F15	compound treatment	1.12	0.00531	0.07	1.13	-0.053	-0.72	-0.4605	-0.6339	1425867	CBDivE_003315	Oc1ccccc1C(CC(=O)N2CCCCC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F16	compound treatment	1.052	-0.0627	-0.85	1.118	-0.065	-0.89	-1.2249	-0.9997	1914537	CBDivE_003316	CC/C(=C\c1sc2ccc(OC)cc2[n+]1CCO)/C=C/3\Sc4ccc(OC)cc4N3CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F17	compound treatment	1.129	0.0143	0.19	1.162	-0.021	-0.29	-0.0661	-0.1913	1914538	CBDivE_003317	[O-][N+](=O)c1ccccc1C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccccc5[N+](=O)[O-])ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F18	compound treatment	1.108	-0.00669	-0.09	1.217	0.034	0.46	0.2639	0.5589	1668895	CBDivE_003318	OC(=O)c1cccc(NC(=O)c2ccccc2C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F19	compound treatment	1.143	0.0283	0.38	1.168	-0.015	-0.2	0.1253	0.2892	1387978	CBDivE_003319	CN(C)C1CS(=O)(=O)CC1N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	F20	compound treatment	1.117	0.00231	0.03	1.191	0.00799	0.11	0.0991	0.8743	1914539	CBDivE_003320	OC(=O)CCN1C(=O)C2C(C3C=CC2C4C3C(=O)N(CCC(=O)O)C4=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G01	compound treatment	1.094	-0.0207	-0.28	1.143	-0.04	-0.55	-0.5832	-0.9516	1070273	CBDivE_003321	OC(C(O)C(=O)NCC=C)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G02	compound treatment	1.13	0.0153	0.21	1.177	-0.00601	-0.08	0.0881	0.3965	1914540	CBDivE_003322	OC(=O)c1ccccc1C(=O)NNC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G03	compound treatment	1.184	0.0693	0.94	1.194	0.011	0.15	0.7671	0.8101	3105980	CBDivE_003323	CCCCO.CCC(=O)CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G04	compound treatment	1.097	-0.0177	-0.24	1.16	-0.023	-0.31	-0.3906	-0.9909	1154303	CBDivE_003324	CC1(C)C(CCC1(C)C(=O)OCC(=O)c2ccc(Cl)cc2)C(=O)OCC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G05	compound treatment	1.09	-0.0247	-0.33	1.117	-0.066	-0.9	-0.872	-0.9086	1914542	CBDivE_003325	CC(C)(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G06	compound treatment	1.078	-0.0367	-0.49	1.219	0.036	0.49	-0.003	-0.0043	1914543	CBDivE_003326	O=C(CCC(=O)OCCc1ccccc1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G07	compound treatment	1.073	-0.0417	-0.56	1.172	-0.011	-0.15	-0.5039	-0.8655	1914544	CBDivE_003327	COc1ccccc1Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G08	compound treatment	1.104	-0.0107	-0.14	1.203	0.02	0.27	0.0908	0.2943	1914545	CBDivE_003328	OC(C(=O)OCCCN1CCCCC1)(c2ccc(Br)cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G09	compound treatment	1.101	-0.0137	-0.18	1.167	-0.016	-0.22	-0.285	-0.9965	1914546	CBDivE_003329	Clc1ccc(cc1)C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G10	compound treatment	1.063	-0.0517	-0.7	1.223	0.04	0.55	-0.1075	-0.1214	1914547	CBDivE_003330	C/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G11	compound treatment	1.118	0.00331	0.04	1.165	-0.018	-0.25	-0.1421	-0.5692	1914548	CBDivE_003331	CO/C(=N\C(NC(=S)N)C(Cl)(Cl)Cl)/c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G12	compound treatment	1.081	-0.0337	-0.45	1.216	0.033	0.45	-0.0033	-0.0051	1914549	CBDivE_003332	CCOP(=O)(O)CCNCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G13	compound treatment	1.089	-0.0257	-0.35	1.107	-0.076	-1.04	-0.978	-0.8948	1488707	CBDivE_003333	CCC(C)NCc1c(C)sc(C)c1CNC(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G14	compound treatment	1.115	3.09E-4	0.0	1.221	0.038	0.52	0.3693	0.7128	1914550	CBDivE_003334	C(Nn1cn[n+](Cc2ccccc2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G15	compound treatment	1.149	0.0343	0.46	1.199	0.016	0.22	0.4815	0.941	1914551	CBDivE_003335	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G16	compound treatment	1.183	0.0683	0.92	1.175	-0.00801	-0.11	0.5744	0.619	1914552	CBDivE_003336	O=C(O[C@@H]1CS(=O)(=O)C[C@H]1OC(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G17	compound treatment	1.163	0.0483	0.65	1.137	-0.046	-0.63	0.0172	0.019	1914553	CBDivE_003337	[O-][N+](=O)c1ccc(NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G18	compound treatment	1.13	0.0153	0.21	1.213	0.03	0.41	0.4352	0.9499	1914554	CBDivE_003338	[O-][N+](=O)c1cccc(C(=O)OCC(=O)c2ccc(Cl)cc2)c1C(=O)OCC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G19	compound treatment	1.115	3.09E-4	0.0	1.185	0.00199	0.03	0.0221	0.8064	1022617	CBDivE_003339	OC(NC(=O)c1ccccc1O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	G20	compound treatment	1.231	0.116	1.57	1.224	0.041	0.56	1.5048	0.9034	1775343	CBDivE_003340	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)c2ccccc2C(=O)OCC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H01	compound treatment	1.09	-0.0247	-0.33	1.207	0.024	0.33	-0.0042	-0.009	1277345	CBDivE_003341	OC(=O)C(C(=O)O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H02	compound treatment	1.046	-0.0687	-0.93	1.156	-0.027	-0.37	-0.9157	-0.9183	1914555	CBDivE_003342	OC(=O)CSc1nncn1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H03	compound treatment	1.13	0.0153	0.21	1.127	-0.056	-0.76	-0.394	-0.498	1914556	CBDivE_003343	CC(C)C(NS(=O)(=O)c1ccc(/C=C/C(=O)O)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H04	compound treatment	1.11	-0.00469	-0.06	1.175	-0.00801	-0.11	-0.122	-0.9663	3106005	CBDivE_003344	CCCOP(=O)(O)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].Cc1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H05	compound treatment	1.109	-0.00569	-0.08	1.183	-9.4E-6	0.0	-0.0544	-0.7083	1914558	CBDivE_003345	CCOc1ccc(NC(=S)NC(NC(=O)c2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H06	compound treatment	1.091	-0.0237	-0.32	1.175	-0.00801	-0.11	-0.3032	-0.8978	1355924	CBDivE_003346	CC(=O)Nc1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H07	compound treatment	1.121	0.00631	0.09	1.188	0.00499	0.07	0.1083	0.9939	1914559	CBDivE_003347	CC1(C)C(CCC1(C)C(=O)O)C(=O)NNC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H08	compound treatment	1.116	0.00131	0.02	1.174	-0.00901	-0.12	-0.0744	-0.5993	1914560	CBDivE_003348	Oc1ccc(Br)cc1/C=N/CC\N=C\c2cc(Br)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H09	compound treatment	1.125	0.0103	0.14	1.082	-0.101	-1.38	-0.8756	-0.6325	1324672	CBDivE_003349	Oc1ccccc1OCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H10	compound treatment	1.1	-0.0147	-0.2	1.176	-0.00701	-0.1	-0.2077	-0.9441	1404795	CBDivE_003350	COC(=O)Nc1ccc(cc1)S(=O)(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H11	compound treatment	1.131	0.0163	0.22	1.183	-9.4E-6	0.0	0.1555	0.7067	1914561	CBDivE_003351	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(OS(=O)(=O)c3ccccc3[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H12	compound treatment	1.072	-0.0427	-0.58	1.097	-0.086	-1.17	-1.2366	-0.9464	1914562	CBDivE_003352	Clc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccc(Cl)cc5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H13	compound treatment	1.139	0.0243	0.33	1.109	-0.074	-1.01	-0.4817	-0.454	1914563	CBDivE_003353	Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H14	compound treatment	1.093	-0.0217	-0.29	1.145	-0.038	-0.52	-0.5734	-0.9634	1914564	CBDivE_003354	CN(C)c1ccc(/C=C/c2cccc[n+]2CCCS(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H15	compound treatment	1.131	0.0163	0.22	1.207	0.024	0.33	0.3869	0.9814	1451391	CBDivE_003355	Oc1ccccc1C(CC(=O)NCc2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H16	compound treatment	1.112	-0.00269	-0.04	1.16	-0.023	-0.31	-0.2475	-0.7837	1490895	CBDivE_003356	CNCCc1c[nH]c2ccc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H17	compound treatment	1.147	0.0323	0.44	1.178	-0.00501	-0.07	0.2599	0.5891	1914565	CBDivE_003357	Cc1cccc(c1)C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5cccc(C)c5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H18	compound treatment	1.104	-0.0107	-0.14	1.17	-0.013	-0.18	-0.2274	-0.9947	1914566	CBDivE_003358	COc1ccccc1NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H19	compound treatment	1.194	0.0793	1.07	1.143	-0.04	-0.55	0.3708	0.3087	1612219	CBDivE_003359	CC1CS(=O)(=O)CC1OC(=O)CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	H20	compound treatment	1.177	0.0623	0.84	1.109	-0.074	-1.01	-0.1192	-0.0908	1914567	CBDivE_003360	OC(=O)c1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I01	compound treatment	1.075	-0.0397	-0.54	1.233	0.05	0.68	0.1034	0.1193	1914568	CBDivE_003361	Clc1cc(Cl)c(NC(=O)CCCCCCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I02	compound treatment	1.127	0.0123	0.17	1.257	0.074	1.01	0.8309	0.8126	1914569	CBDivE_003362	C/C(=N\NC(=O)COc1ccccc1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I03	compound treatment	1.122	0.00731	0.1	1.202	0.019	0.26	0.2528	0.9124	1914570	CBDivE_003363	CC(=O)CC(c1ccc(Br)cc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I04	compound treatment	1.097	-0.0177	-0.24	1.149	-0.034	-0.46	-0.4967	-0.9523	1914571	CBDivE_003364	Clc1ccc(cc1)C(=O)COC(=O)c2ccc(C(=O)OCC(=O)c3ccc(Cl)cc3)c(c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I05	compound treatment	1.065	-0.0497	-0.67	1.128	-0.055	-0.75	-1.0044	-0.9984	1719916	CBDivE_003365	COc1ccc(OCC(O)CN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I06	compound treatment	1.096	-0.0187	-0.25	1.208	0.025	0.34	0.0627	0.1478	1914572	CBDivE_003366	[O-][N+](=O)c1cccc(NC(=O)CCC(=O)OCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I07	compound treatment	1.122	0.00731	0.1	1.17	-0.013	-0.18	-0.0557	-0.2745	3006664	CBDivE_003367	Cc1cccc(C)[n+]1[O-].OC(=O)C1C(C2CC1C=C2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I08	compound treatment	1.043	-0.0717	-0.97	1.167	-0.016	-0.22	-0.8382	-0.8454	1914573	CBDivE_003368	OC(C(=O)OCCCN1CCOCC1)(c2ccc(Br)cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I09	compound treatment	1.13	0.0153	0.21	1.139	-0.044	-0.6	-0.2783	-0.4385	1576771	CBDivE_003369	COC(=O)c1ccccc1NC(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I10	compound treatment	1.06	-0.0547	-0.74	1.228	0.045	0.61	-0.0879	-0.0916	1914574	CBDivE_003370	C/C(=N\NC(=O)c1ccccc1)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I11	compound treatment	1.078	-0.0367	-0.49	1.155	-0.028	-0.38	-0.6201	-0.9918	1914575	CBDivE_003371	Cc1ccc(cc1)/C(=N/Cc2ccccc2)/NC(=S)NN(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I12	compound treatment	1.062	-0.0527	-0.71	1.195	0.012	0.16	-0.387	-0.5306	1914576	CBDivE_003372	CCCCNCCP(=O)(O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I13	compound treatment	1.123	0.00831	0.11	1.243	0.06	0.82	0.6577	0.7966	1033091	CBDivE_003373	OC(=O)C1=NN(C(=O)C1)c2ccc(cc2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I14	compound treatment	1.129	0.0143	0.19	1.171	-0.012	-0.16	0.0207	0.0818	1914577	CBDivE_003374	O=C(NC1CCS(=O)(=O)C1)/C(=C\c2cccc(Oc3ccccc3)c2)/NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I15	compound treatment	1.073	-0.0417	-0.56	1.177	-0.00601	-0.08	-0.4556	-0.8017	1914578	CBDivE_003375	CCCCCCc1ccc(NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I16	compound treatment	1.121	0.00631	0.09	1.219	0.036	0.49	0.4072	0.8175	1914579	CBDivE_003376	CN(C)CCCNC(=O)/C(=C/c1ccc(F)cc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I17	compound treatment	1.091	-0.0237	-0.32	1.198	0.015	0.2	-0.0814	-0.2147	1914580	CBDivE_003377	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I18	compound treatment	1.07	-0.0447	-0.6	1.24	0.057	0.78	0.1232	0.1253	1664455	CBDivE_003378	COc1ccccc1C(=O)OCC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I19	compound treatment	1.174	0.0593	0.8	1.19	0.00699	0.1	0.6332	0.7858	1914581	CBDivE_003379	COc1ccc(cc1NC(=S)NC(NC(=O)OCc2ccccc2)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	I20	compound treatment	1.12	0.00531	0.07	1.263	0.08	1.09	0.822	0.7519	1914582	CBDivE_003380	Oc1cc(ccc1[N+](=O)[O-])C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J01	compound treatment	1.168	0.0533	0.72	1.234	0.051	0.7	1.0002	0.9999	1914583	CBDivE_003381	COc1ccccc1NC(=O)c2ccc[n+]([O-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J02	compound treatment	1.138	0.0233	0.31	1.291	0.108	1.47	1.2636	0.8392	1914584	CBDivE_003382	OC(=O)CSc1nnc(Nc2ccccc2)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J03	compound treatment	1.105	-0.00969	-0.13	1.205	0.022	0.3	0.1196	0.3656	1914585	CBDivE_003383	OC(=O)CNS(=O)(=O)c1ccc(/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J04	compound treatment	1.069	-0.0457	-0.62	1.159	-0.024	-0.33	-0.6674	-0.9562	1914586	CBDivE_003384	CN(C)CCCOC(=O)c1cccnc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J05	compound treatment	1.123	0.00831	0.11	1.123	-0.06	-0.82	-0.4994	-0.6046	1914587	CBDivE_003385	[O-][N+](=O)c1ccccc1C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J06	compound treatment	1.102	-0.0127	-0.17	1.185	0.00199	0.03	-0.1019	-0.5877	1623307	CBDivE_003386	CC(=O)Oc1cccc(c1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J07	compound treatment	1.13	0.0153	0.21	1.177	-0.00601	-0.08	0.0881	0.3965	1914588	CBDivE_003387	C/C(=N/NC(=O)COc1ccccc1)/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J08	compound treatment	1.071	-0.0437	-0.59	1.143	-0.04	-0.55	-0.8026	-0.9993	1914589	CBDivE_003388	Oc1ccc(cc1/C=N/c2ccc(Cc3ccc(\N=C\c4cc(ccc4O)[N+](=O)[O-])cc3)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J09	compound treatment	1.162	0.0473	0.64	1.134	-0.049	-0.67	-0.0213	-0.023	1653816	CBDivE_003389	CC1(Cc2nc3ccccc3[nH]2)OCCO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J10	compound treatment	1.117	0.00231	0.03	1.172	-0.011	-0.15	-0.0841	-0.5487	1214610	CBDivE_003390	COC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J11	compound treatment	1.113	-0.00169	-0.02	1.193	0.00999	0.14	0.0802	0.5806	1914590	CBDivE_003391	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J12	compound treatment	1.119	0.00431	0.06	1.177	-0.00601	-0.08	-0.0168	-0.1676	1914591	CBDivE_003392	Clc1ccc(C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccc(Cl)cc5Cl)ccc6ccccc46)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J13	compound treatment	1.19	0.0753	1.02	1.18	-0.00301	-0.04	0.6894	0.678	1471668	CBDivE_003393	CC1(C)C(CCC1(C)C(=O)OCC(=O)c2ccc(Br)cc2)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J14	compound treatment	1.071	-0.0437	-0.59	1.181	-0.00201	-0.03	-0.4362	-0.7392	1681451	CBDivE_003394	OC(=O)c1ccc2C(=O)N(Cc3ccccc3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J15	compound treatment	1.118	0.00331	0.04	1.124	-0.059	-0.8	-0.5374	-0.6668	1914592	CBDivE_003395	CCCCNC(CC(=O)NCCCC)c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J16	compound treatment	1.041	-0.0737	-0.99	1.159	-0.024	-0.33	-0.9345	-0.8928	1914593	CBDivE_003396	CCN(CC)CC(=O)N1CCN(CC1)C(=O)CN(CC)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J17	compound treatment	1.167	0.0523	0.71	1.078	-0.105	-1.43	-0.5135	-0.3217	1914594	CBDivE_003397	CCN(CC)CCOC(=O)c1ccc2n(Cc3ccccc3)c(C)c(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J18	compound treatment	1.081	-0.0337	-0.45	1.153	-0.03	-0.41	-0.6107	-0.9986	1914595	CBDivE_003398	ClC(Cl)(Cl)C(NC(=O)c1cccc2ccccc12)NC(=S)Nc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J19	compound treatment	1.177	0.0623	0.84	1.15	-0.033	-0.45	0.2761	0.2896	1914596	CBDivE_003399	O=C(NC1CCS(=O)(=O)C1)OCCOCCOC(=O)NC2CCS(=O)(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	J20	compound treatment	1.089	-0.0257	-0.35	1.179	-0.00401	-0.05	-0.2837	-0.8087	1449841	CBDivE_003400	OC(=O)CCN1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K01	compound treatment	1.147	0.0323	0.44	1.22	0.037	0.5	0.6649	0.9974	1914597	CBDivE_003401	COc1ccc(NC(=O)CCC(=O)OCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K02	compound treatment	1.173	0.0583	0.79	1.2	0.017	0.23	0.7201	0.8781	1713335	CBDivE_003402	Cc1ccccc1OCC(=O)OCC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K03	compound treatment	1.114	-6.91E-4	-0.01	1.198	0.015	0.2	0.138	0.6742	1350777	CBDivE_003403	CCC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K04	compound treatment	1.116	0.00131	0.02	1.186	0.00299	0.04	0.0413	0.9299	1295710	CBDivE_003404	O=C(COC(=O)c1ccccc1NC(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K05	compound treatment	1.109	-0.00569	-0.08	1.221	0.038	0.52	0.312	0.5958	1663537	CBDivE_003405	CCN(CC)CC(O)COc1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K06	compound treatment	1.085	-0.0297	-0.4	1.162	-0.021	-0.29	-0.4858	-0.9865	1131828	CBDivE_003406	O=C(COc1ccccc1)NN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K07	compound treatment	1.06	-0.0547	-0.74	1.17	-0.013	-0.18	-0.6472	-0.8528	1914598	CBDivE_003407	COc1ccc(NC(=O)c2cc[n+]([O-])cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K08	compound treatment	1.122	0.00731	0.1	1.137	-0.046	-0.63	-0.3739	-0.5887	1914599	CBDivE_003408	CCCCSC(CC(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K09	compound treatment	1.078	-0.0367	-0.49	1.181	-0.00201	-0.03	-0.3694	-0.7451	1914600	CBDivE_003409	CN(C)c1ccc(/C=C/2\C(=O)N(N=C2c3ccccc3)c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K10	compound treatment	1.092	-0.0227	-0.31	1.232	0.049	0.67	0.2559	0.3483	1914601	CBDivE_003410	C/C(=N\NC(=O)Nc1ccccc1)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K11	compound treatment	1.108	-0.00669	-0.09	1.163	-0.02	-0.27	-0.2568	-0.8934	1216033	CBDivE_003411	COC(=O)C1=C(C)NC(=O)NC1c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K12	compound treatment	1.106	-0.00869	-0.12	1.141	-0.042	-0.57	-0.488	-0.8345	1914602	CBDivE_003412	Cc1cc(O)c(C2=NCCSC(C2)c3cccc(c3)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K13	compound treatment	1.072	-0.0427	-0.58	1.178	-0.00501	-0.07	-0.4555	-0.7855	1676301	CBDivE_003413	COC(=O)C1C(NC(C(C(=O)OC)S1(=O)=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K14	compound treatment	1.118	0.00331	0.04	1.21	0.027	0.37	0.2918	0.7871	1914603	CBDivE_003414	CNC(=O)/C(=C/c1ccco1)/NC(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K15	compound treatment	1.13	0.0153	0.21	1.153	-0.03	-0.41	-0.1433	-0.3127	1914604	CBDivE_003415	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K16	compound treatment	1.153	0.0383	0.52	1.174	-0.00901	-0.12	0.2786	0.5244	1914605	CBDivE_003416	FCC(=O)NC(N1CCOCC1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K17	compound treatment	1.114	-6.91E-4	-0.01	1.164	-0.019	-0.26	-0.1899	-0.732	1914606	CBDivE_003417	COc1ccc(cc1NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K18	compound treatment	1.163	0.0483	0.65	1.207	0.024	0.33	0.6922	0.9492	1914607	CBDivE_003418	Clc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)C(=O)OCC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K19	compound treatment	1.12	0.00531	0.07	1.184	9.91E-4	0.01	0.0602	0.8259	1914608	CBDivE_003419	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)OCc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	K20	compound treatment	1.17	0.0553	0.75	1.242	0.059	0.8	1.0964	0.9993	1914609	CBDivE_003420	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)c2ccc(NC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L01	compound treatment	1.086	-0.0287	-0.39	1.228	0.045	0.61	0.1601	0.2207	1914610	CBDivE_003421	CN1/C(=C\C=N\N=C2c3ccccc3-c4ccccc24)/C(C)(C)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L02	compound treatment	1.077	-0.0377	-0.51	1.219	0.036	0.49	-0.0125	-0.0177	1212616	CBDivE_003422	O=S1(=O)CC(CS(=O)(=O)C1CCN2CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L03	compound treatment	1.13	0.0153	0.21	1.206	0.023	0.31	0.3677	0.9795	1914611	CBDivE_003423	OCC(/N=C/c1ccc(cc1)[N+](=O)[O-])C(O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L04	compound treatment	1.091	-0.0237	-0.32	1.188	0.00499	0.07	-0.1779	-0.5443	1778384	CBDivE_003424	[O-][N+](=O)C1(CN(CN2CN(C1)C(=O)c3ccccc3)C(=O)c4ccccc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L05	compound treatment	1.139	0.0243	0.33	1.206	0.023	0.31	0.4536	0.9997	1914612	CBDivE_003425	OC(=O)CCC(=O)NNC(=O)C1CC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L06	compound treatment	1.078	-0.0367	-0.49	1.178	-0.00501	-0.07	-0.3983	-0.7971	1305235	CBDivE_003426	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L07	compound treatment	1.117	0.00231	0.03	1.142	-0.041	-0.56	-0.3734	-0.6667	1914613	CBDivE_003427	O=C(COc1ccccc1)NN=C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L08	compound treatment	1.108	-0.00669	-0.09	1.135	-0.048	-0.65	-0.5268	-0.7971	1914614	CBDivE_003428	Oc1ccc(cc1/C=N/c2ccc(Oc3ccc(\N=C\c4cc(ccc4O)[N+](=O)[O-])cc3)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L09	compound treatment	1.109	-0.00569	-0.08	1.192	0.00899	0.12	0.0324	0.224	1249725	CBDivE_003429	CCOC(=O)c1cnc2cc(OCC(C)C)c(OCC(C)C)cc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L10	compound treatment	1.11	-0.00469	-0.06	1.124	-0.059	-0.8	-0.6137	-0.7604	1207379	CBDivE_003430	COC(=O)Nc1ccc(cc1)S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L11	compound treatment	1.101	-0.0137	-0.18	1.182	-0.00101	-0.01	-0.1403	-0.7577	1336201	CBDivE_003431	Oc1c(CN2CCCC2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L12	compound treatment	1.048	-0.0667	-0.9	1.154	-0.029	-0.4	-0.9159	-0.9319	1914615	CBDivE_003432	O=C(Oc1ccc2ccccc2c1Cc3c(OC(=O)/C=C/c4ccccc4)ccc5ccccc35)/C=C/c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L13	compound treatment	1.114	-6.91E-4	-0.01	1.141	-0.042	-0.57	-0.4117	-0.7185	1914616	CBDivE_003433	Brc1ccc(cc1)C(=O)COC(=O)CCC(=O)C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L14	compound treatment	1.099	-0.0157	-0.21	1.141	-0.042	-0.57	-0.5547	-0.9084	1774763	CBDivE_003434	[O-][N+](=O)c1ccc2C(=O)N(CN3CCOCC3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L15	compound treatment	1.098	-0.0167	-0.23	1.143	-0.04	-0.55	-0.545	-0.9234	1914617	CBDivE_003435	OC(=O)c1ccccc1Nc2c([N+](=O)[O-])c(=O)oc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L16	compound treatment	1.097	-0.0177	-0.24	1.146	-0.037	-0.5	-0.5256	-0.9415	1538213	CBDivE_003436	C1CN(CCN1)c2ccnc(n2)N3CCNCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L17	compound treatment	1.161	0.0463	0.62	1.182	-0.00101	-0.01	0.432	0.6914	1914618	CBDivE_003437	COc1ccc(cc1)C(=O)N2CCN(CC(=O)N3CCOCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L18	compound treatment	1.048	-0.0667	-0.9	1.169	-0.014	-0.19	-0.7713	-0.8386	1914619	CBDivE_003438	ClC(Cl)(Cl)C(NC(=O)c1cccc2ccccc12)NC(=S)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L19	compound treatment	1.154	0.0393	0.53	1.197	0.014	0.19	0.5099	0.9047	1668645	CBDivE_003439	O=C(Nc1cccc2ccccc12)OC3CCS(=O)(=O)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	L20	compound treatment	1.033	-0.0817	-1.1	1.169	-0.014	-0.19	-0.9144	-0.8175	1021118	CBDivE_003440	OC(=O)CN1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M01	compound treatment	1.114	-6.91E-4	-0.01	1.198	0.015	0.2	0.138	0.6742	1914620	CBDivE_003441	C(Cc1ccncc1)SC2Cc3cccc4cccc2c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M02	compound treatment	1.14	0.0253	0.34	1.211	0.028	0.38	0.5113	0.9985	1914621	CBDivE_003442	Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2C(=O)OCC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M03	compound treatment	1.066	-0.0487	-0.66	1.229	0.046	0.63	-0.021	-0.0231	1350777	CBDivE_003443	CCC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M04	compound treatment	1.139	0.0243	0.33	1.214	0.031	0.42	0.5307	0.9921	1914622	CBDivE_003444	[O-][N+](=O)c1ccc(C(=O)OCC(=O)c2ccc(Cl)cc2)c(c1)C(=O)OCC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M05	compound treatment	1.076	-0.0387	-0.52	1.167	-0.016	-0.22	-0.5235	-0.9252	1914623	CBDivE_003445	CC(C)(C)CC(C)(C)NCC(O)COCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M06	compound treatment	1.116	0.00131	0.02	1.19	0.00699	0.1	0.0799	0.8241	1914624	CBDivE_003446	OC(=O)CCC(=O)NNC(=O)CCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M07	compound treatment	1.135	0.0203	0.27	1.199	0.016	0.22	0.3479	0.9936	1774522	CBDivE_003447	CCOC(=O)c1ccc(NC(=O)c2cc[n+]([O-])cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M08	compound treatment	1.124	0.00931	0.13	1.168	-0.015	-0.2	-0.0559	-0.2329	1914625	CBDivE_003448	CC(C)CSC(CC(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M09	compound treatment	1.145	0.0303	0.41	1.099	-0.084	-1.15	-0.5209	-0.4283	1914626	CBDivE_003449	CC(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M10	compound treatment	1.104	-0.0107	-0.14	1.19	0.00699	0.1	-0.0346	-0.2	1914627	CBDivE_003450	C/C(=N/NC(=S)N)/CC(=O)Nc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M11	compound treatment	1.095	-0.0197	-0.27	1.177	-0.00601	-0.08	-0.2458	-0.8841	1620010	CBDivE_003451	CCOC(=O)C1=C(C)NC(=O)NC1c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M12	compound treatment	1.073	-0.0417	-0.56	1.185	0.00199	0.03	-0.3785	-0.6722	1914628	CBDivE_003452	Cc1cc(O)c(C2=NCCSC(C2)c3ccccc3[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M13	compound treatment	1.07	-0.0447	-0.6	1.172	-0.011	-0.15	-0.5325	-0.857	1742759	CBDivE_003453	OCCNC(=O)c1ccc2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M14	compound treatment	1.076	-0.0387	-0.52	1.185	0.00199	0.03	-0.3499	-0.6694	1914629	CBDivE_003454	COc1ccc(NC(=O)NNC(=S)NNC(=O)Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M15	compound treatment	1.128	0.0133	0.18	1.171	-0.012	-0.16	0.0112	0.0459	1914630	CBDivE_003455	COc1ccc(NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M16	compound treatment	1.147	0.0323	0.44	1.166	-0.017	-0.23	0.1442	0.292	1914631	CBDivE_003456	CNC(=O)/C(=C\c1cccc(Oc2ccccc2)c1)/NC(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M17	compound treatment	1.134	0.0193	0.26	1.209	0.026	0.35	0.4348	0.9885	1914632	CBDivE_003457	ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)NC(=S)Nc2ccccc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M18	compound treatment	1.137	0.0223	0.3	1.258	0.075	1.02	0.9359	0.878	1914633	CBDivE_003458	Clc1ccc(cc1)C(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M19	compound treatment	1.048	-0.0667	-0.9	1.153	-0.03	-0.41	-0.9255	-0.9364	1585162	CBDivE_003459	Oc1ccc2c(CN3CCCCC3)c(O)ccc2c1CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	M20	compound treatment	1.099	-0.0157	-0.21	1.193	0.00999	0.14	-0.0533	-0.2119	1177668	CBDivE_003460	CC(=O)Oc1ccc(cc1c2ccccc2)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N01	compound treatment	1.155	0.0403	0.54	1.182	-0.00101	-0.01	0.3748	0.689	1914634	CBDivE_003461	CN1/C(=C\C=N\Cc2ccccc2)/C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N02	compound treatment	1.087	-0.0277	-0.37	1.187	0.00399	0.05	-0.2257	-0.5978	1914635	CBDivE_003462	Cc1cc(cc(C)c1O)C2(C(=O)N(Cc3ccccc3)c4ccccc42)c5cc(C)c(O)c(C)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N03	compound treatment	1.171	0.0563	0.76	1.142	-0.041	-0.56	0.1417	0.1502	1914636	CBDivE_003463	OCC(NC(=S)Nc1ccccc1)C(O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N04	compound treatment	1.124	0.00931	0.13	1.18	-0.00301	-0.04	0.0598	0.4525	1914637	CBDivE_003464	[O-][N+](=O)C1(CN(CN2CN(C1)C(=O)c3ccco3)C(=O)c4ccco4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N05	compound treatment	1.165	0.0503	0.68	1.202	0.019	0.26	0.663	0.9127	1914638	CBDivE_003465	NC(CC(=O)O)c1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N06	compound treatment	1.071	-0.0437	-0.59	1.185	0.00199	0.03	-0.3976	-0.6738	1258567	CBDivE_003466	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N07	compound treatment	1.073	-0.0417	-0.56	1.14	-0.043	-0.59	-0.8124	-0.9998	1914639	CBDivE_003467	C=COCCNC(=S)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N08	compound treatment	1.061	-0.0537	-0.72	1.21	0.027	0.37	-0.2519	-0.3101	1914640	CBDivE_003468	OC(=O)c1ccccc1NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N09	compound treatment	1.134	0.0193	0.26	1.221	0.038	0.52	0.5505	0.9494	1489126	CBDivE_003469	COc1ccc(Cn2c(nc3ccccc23)c4ccc(OC)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N10	compound treatment	1.111	-0.00369	-0.05	1.19	0.00699	0.1	0.0322	0.2994	1914641	CBDivE_003470	OCC(C(O)c1ccc(cc1)[N+](=O)[O-])N2C(=O)c3cccc4cccc(C2=O)c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N11	compound treatment	1.137	0.0223	0.3	1.17	-0.013	-0.18	0.0874	0.2501	1914642	CBDivE_003471	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(cc2)c3ccc(OS(=O)(=O)c4ccccc4[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N12	compound treatment	1.085	-0.0297	-0.4	1.192	0.00899	0.12	-0.1965	-0.4692	1914643	CBDivE_003472	Clc1ccc(cc1)C(=O)Oc2ccc(cc2)C3(c4ccccc4-c5ccccc53)c6ccc(OC(=O)c7ccc(Cl)cc7)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N13	compound treatment	1.148	0.0333	0.45	1.109	-0.074	-1.01	-0.3959	-0.3583	1775336	CBDivE_003473	[O-][N+](=O)c1cccc(C(=O)OCC(=O)c2ccccc2)c1C(=O)OCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N14	compound treatment	1.094	-0.0207	-0.28	1.204	0.021	0.29	0.005	0.0126	3106069	CBDivE_003474	CC[n+]1c(/C=C/Nc2ccccc2)sc(c1c3ccccc3)c4ccccc4.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N15	compound treatment	1.1	-0.0147	-0.2	1.128	-0.055	-0.75	-0.6706	-0.8643	1386221	CBDivE_003475	CN1CCN(CC1)c2c(N)c(=O)oc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N16	compound treatment	1.049	-0.0657	-0.89	1.18	-0.00301	-0.04	-0.6557	-0.7391	1914645	CBDivE_003476	CC1CCCC(C)N1CC(O)COc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N17	compound treatment	1.118	0.00331	0.04	1.167	-0.016	-0.22	-0.1228	-0.5511	1914646	CBDivE_003477	CN(C)CCCOC(=O)c1ccc2n(Cc3ccccc3)c(C)c(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N18	compound treatment	1.05	-0.0647	-0.87	1.174	-0.00901	-0.12	-0.704	-0.7988	1914647	CBDivE_003478	COc1ccc(NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N19	compound treatment	1.133	0.0183	0.25	1.146	-0.037	-0.5	-0.1822	-0.3243	1914648	CBDivE_003479	OCCNC(=O)C(C1CCS(=O)(=O)C1)C(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	N20	compound treatment	1.111	-0.00369	-0.05	1.2	0.017	0.23	0.1286	0.5428	1914649	CBDivE_003480	CC(=O)COc1ccccc1OC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O01	compound treatment	1.146	0.0313	0.42	1.229	0.046	0.63	0.7421	0.9815	1914434	CBDivE_003481	C(Cc1ccncc1)SCc2ccc3CCc4cccc2c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O02	compound treatment	1.131	0.0163	0.22	1.279	0.096	1.31	1.0812	0.8145	1775351	CBDivE_003482	[O-][N+](=O)c1ccc(C(=O)OCC(=O)c2ccccc2)c(c1)C(=O)OCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O03	compound treatment	1.147	0.0323	0.44	1.24	0.057	0.78	0.8577	0.9626	1914650	CBDivE_003483	OC(=O)C1(CC2(CC3(CC(C1)(C(=O)O)C2(N=O)[N+](=O)[O-])C(=O)O)C(=O)O)C3(N=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O04	compound treatment	1.118	0.00331	0.04	1.168	-0.015	-0.2	-0.1132	-0.5402	1914651	CBDivE_003484	Clc1ccc(cc1)C(=O)CCC(=O)OCC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O05	compound treatment	1.059	-0.0557	-0.75	1.186	0.00299	0.04	-0.5024	-0.6677	1914652	CBDivE_003485	COc1ccc(OCC(O)CNC(C)(C)CC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O06	compound treatment	1.118	0.00331	0.04	1.177	-0.00601	-0.08	-0.0264	-0.2826	1914653	CBDivE_003486	OC(=O)/C=C/C(=O)NNC(=O)COc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O07	compound treatment	1.116	0.00131	0.02	1.214	0.031	0.42	0.3113	0.736	1914654	CBDivE_003487	Cc1ccc(cc1)C(=O)N/C(=C\c2cccc(Oc3ccccc3)c2)/C(=O)NC4CCS(=O)(=O)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O08	compound treatment	1.135	0.0203	0.27	1.235	0.052	0.71	0.6951	0.9145	1914655	CBDivE_003488	CCOC(C(=O)OC(C)CN(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O09	compound treatment	1.192	0.0773	1.04	1.195	0.012	0.16	0.8531	0.8081	1914656	CBDivE_003489	CC(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O10	compound treatment	1.178	0.0633	0.85	1.19	0.00699	0.1	0.6713	0.7812	1914657	CBDivE_003490	Oc1ccc2ccccc2c1/C=N/C3CCCCC3\N=C\c4c(O)ccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O11	compound treatment	1.129	0.0143	0.19	1.161	-0.022	-0.3	-0.0757	-0.2122	1020333	CBDivE_003491	CC1NC(Cc2c1[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O12	compound treatment	1.146	0.0313	0.42	1.241	0.058	0.79	0.8578	0.9569	1914658	CBDivE_003492	Cc1cc(O)c(C2=NCCSC(C2)c3ccc4OCOc4c3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O13	compound treatment	1.105	-0.00969	-0.13	1.227	0.044	0.6	0.3317	0.5403	1538301	CBDivE_003493	OC(=O)CCn1nc(Nc2ccccc2)n(c3ccccc3)c1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O14	compound treatment	1.151	0.0363	0.49	1.193	0.00999	0.14	0.4427	0.8707	1914659	CBDivE_003494	Clc1ccc(cc1)C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O15	compound treatment	1.159	0.0443	0.6	1.191	0.00799	0.11	0.4997	0.8224	1914660	CBDivE_003495	COc1ccc(cc1NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O16	compound treatment	1.143	0.0283	0.38	1.257	0.074	1.01	0.9835	0.9116	1914661	CBDivE_003496	NNC(=O)c1ccc(CNC(=O)C(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O17	compound treatment	1.164	0.0493	0.67	1.24	0.057	0.78	1.0199	0.997	1914662	CBDivE_003497	ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O18	compound treatment	1.151	0.0363	0.49	1.231	0.048	0.65	0.8091	0.9898	1914663	CBDivE_003498	[O-][N+](=O)c1ccc(C(=O)OCC(=O)c2ccc(Br)cc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O19	compound treatment	1.16	0.0453	0.61	1.197	0.014	0.19	0.5671	0.8857	1215224	CBDivE_003499	CCN(CC)Cc1c(O)ccc2c(CN(CC)CC)c(O)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	O20	compound treatment	1.151	0.0363	0.49	1.214	0.031	0.42	0.6452	0.9973	1914664	CBDivE_003500	Clc1ccc(cc1)C(=O)CCC(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P01	compound treatment	1.135	0.0203	0.27	1.173	-0.01	-0.14	0.0972	0.3176	1914665	CBDivE_003501	Cc1ccc(/N=C(\CS(=O)(=O)Cc2ccccc2)/C(F)(F)C(F)(F)C(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P02	compound treatment	1.103	-0.0117	-0.16	1.196	0.013	0.18	0.0137	0.0579	1637410	CBDivE_003502	Clc1ccc(cc1Cl)S(=O)(=O)c2ccccc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P03	compound treatment	1.173	0.0583	0.79	1.222	0.039	0.53	0.9322	0.9818	1002857	CBDivE_003503	OCCOc1ccc(OCCO)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P04	compound treatment	1.129	0.0143	0.19	1.212	0.029	0.4	0.416	0.9457	1115099	CBDivE_003504	OC(=O)COc1c(Cl)cccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P05	compound treatment	1.174	0.0593	0.8	1.128	-0.055	-0.75	0.0353	0.0322	1914666	CBDivE_003505	C/C(=N/NC(=O)CCc1ccccc1)/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P06	compound treatment	1.097	-0.0177	-0.24	1.15	-0.033	-0.45	-0.487	-0.956	1914667	CBDivE_003506	CN1CCCC(C1)C(N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P07	compound treatment	1.156	0.0413	0.56	1.127	-0.056	-0.76	-0.146	-0.1544	1914668	CBDivE_003507	CCOP(=O)(OCC)C(C)(C)NC(=S)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P08	compound treatment	1.124	0.00931	0.13	1.156	-0.027	-0.37	-0.1716	-0.4411	1914669	CBDivE_003508	Clc1ccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P09	compound treatment	1.18	0.0653	0.88	1.208	0.025	0.34	0.864	0.9146	1175330	CBDivE_003509	O=C(NCc1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P10	compound treatment	1.061	-0.0537	-0.72	1.196	0.013	0.18	-0.3869	-0.5189	1914670	CBDivE_003510	COc1ccccc1NC(=O)CCCN2C(=O)c3cccc4cccc(C2=O)c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P11	compound treatment	1.123	0.00831	0.11	1.114	-0.069	-0.94	-0.5862	-0.6185	1914671	CBDivE_003511	Brc1ccc(cc1)C(=O)COC(=O)c2ccc(C(=O)OCC(=O)c3ccc(Br)cc3)c(c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P12	compound treatment	1.104	-0.0107	-0.14	1.152	-0.031	-0.42	-0.401	-0.8975	1914672	CBDivE_003512	Cc1cc(C)c(NC(=O)CN2CCN(Cc3ccccc3)CC2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P13	compound treatment	1.118	0.00331	0.04	1.177	-0.00601	-0.08	-0.0264	-0.2826	1775331	CBDivE_003513	Cc1ccccc1OCC(=O)OCC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P14	compound treatment	1.151	0.0363	0.49	1.137	-0.046	-0.63	-0.0973	-0.1222	1318997	CBDivE_003514	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P15	compound treatment	1.098	-0.0167	-0.23	1.171	-0.012	-0.16	-0.275	-0.9878	1914673	CBDivE_003515	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(OS(=O)(=O)c3ccccc3[N+](=O)[O-])c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P16	compound treatment	1.062	-0.0527	-0.71	1.147	-0.036	-0.49	-0.8499	-0.9837	1303315	CBDivE_003516	COC(=O)c1ccc(NC(=O)c2ccccc2C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P17	compound treatment	1.172	0.0573	0.77	1.209	0.026	0.35	0.7973	0.9374	1914674	CBDivE_003517	Oc1ccc(Br)cc1/C=N/c2ccc(cc2)S(=O)(=O)c3ccc(\N=C\c4cc(Br)ccc4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P18	compound treatment	1.116	0.00131	0.02	1.167	-0.016	-0.22	-0.1419	-0.6478	1914675	CBDivE_003518	COc1ccc(cc1NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P19	compound treatment	1.122	0.00731	0.1	1.169	-0.014	-0.19	-0.0654	-0.304	1337601	CBDivE_003519	Brc1ccc(cc1)C(=O)COC(=O)c2ccc(NC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.11	P20	compound treatment	1.098	-0.0167	-0.23	1.21	0.027	0.37	0.101	0.2342	1914676	CBDivE_003520	Oc1ccc(cc1)C2(C(=O)N(Cc3ccccc3)c4ccccc42)c5ccc(O)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A01	compound treatment	1.163	0.0276	0.37	1.233	0.0463	0.63	0.7101	0.9685	1914677	CBDivE_003521	COC(=O)c1ccc(NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A02	compound treatment	1.092	-0.0434	-0.58	1.253	0.0663	0.9	0.2256	0.2095	1914678	CBDivE_003522	COc1ccccc1OS(=O)(=O)CCS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A03	compound treatment	1.163	0.0276	0.37	1.247	0.0603	0.82	0.8451	0.9361	1561567	CBDivE_003523	CN(C(=O)c1cccc(c1)C(=O)N(C)c2ccc(N)cc2)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A04	compound treatment	1.167	0.0316	0.43	1.239	0.0523	0.71	0.8061	0.9699	1914679	CBDivE_003524	C(C1OCC2(CO1)COC(CN3CCOCC3)OC2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A05	compound treatment	1.081	-0.0544	-0.73	1.2	0.0133	0.18	-0.3904	-0.5168	1914680	CBDivE_003525	CC(C)(C)c1cc(CNCCS(=O)(=O)O)c(O)c(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A06	compound treatment	1.202	0.0666	0.9	1.217	0.0303	0.41	0.9278	0.9377	1914681	CBDivE_003526	C/C(=N\NC(=O)c1cc2ccccc2cc1O)/c3cc4ccc(O)cc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A07	compound treatment	1.174	0.0386	0.52	1.215	0.0283	0.39	0.6414	0.989	1199091	CBDivE_003527	COc1ccc2[nH]cc(CCNC(=O)Cc3c[nH]c4ccccc34)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A08	compound treatment	1.188	0.0526	0.71	1.192	0.00529	0.07	0.5532	0.775	1914682	CBDivE_003528	OC(C/N=C/c1ccc(Br)cc1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A09	compound treatment	1.085	-0.0504	-0.68	1.189	0.00229	0.03	-0.4583	-0.6739	1914683	CBDivE_003529	Nc1ccc(Oc2c(F)c(F)c(Oc3ccc(N)c(c3)[N+](=O)[O-])c(F)c2F)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A10	compound treatment	1.16	0.0246	0.33	1.244	0.0573	0.78	0.7875	0.9275	1004675	CBDivE_003530	OC(=O)C(Br)CCCCNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A11	compound treatment	1.174	0.0386	0.52	1.19	0.00329	0.04	0.4004	0.7652	1914684	CBDivE_003531	NS(=O)(=O)c1ccc(NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A12	compound treatment	1.159	0.0236	0.32	1.236	0.0493	0.67	0.7008	0.942	1914685	CBDivE_003532	COc1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A13	compound treatment	1.162	0.0266	0.36	1.214	0.0273	0.37	0.5173	0.9998	1914686	CBDivE_003533	CCCCCC(=O)NC(NCc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A14	compound treatment	1.149	0.0136	0.18	1.118	-0.0687	-0.94	-0.5324	-0.5575	1914687	CBDivE_003534	ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)Nc3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A15	compound treatment	1.097	-0.0384	-0.52	1.209	0.0223	0.3	-0.1509	-0.2515	1914688	CBDivE_003535	CCCC(=O)NC(Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A16	compound treatment	1.207	0.0716	0.97	1.197	0.0103	0.14	0.7827	0.8014	1140669	CBDivE_003536	CC(C)(C)S(=O)(=O)c1ccc2nc3CCCCc3n2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A17	compound treatment	1.114	-0.0214	-0.29	1.226	0.0393	0.54	0.1751	0.2879	1914689	CBDivE_003537	[O-][N+](=O)c1cccc(NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A18	compound treatment	1.183	0.0476	0.64	1.219	0.0323	0.44	0.7659	0.983	1914690	CBDivE_003538	COc1cccc(c1)C(=O)NC(NC(=S)Nc2ccc(cc2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A19	compound treatment	1.098	-0.0374	-0.5	1.24	0.0533	0.73	0.1575	0.1781	1914691	CBDivE_003539	CCCCCC(=O)NC(Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	A20	compound treatment	1.143	0.00764	0.1	1.235	0.0483	0.66	0.5386	0.808	1914692	CBDivE_003540	NNc1ncnc(NCc2ccccc2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B01	compound treatment	1.158	0.0226	0.31	1.235	0.0483	0.66	0.6817	0.939	1914693	CBDivE_003541	[O-][N+](=O)c1ccccc1NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B02	compound treatment	1.163	0.0276	0.37	1.187	2.92E-4	0.0	0.2665	0.7146	1199318	CBDivE_003542	COc1ccc(CCc2nc(C)cc(CN(C)C)c2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B03	compound treatment	1.144	0.00864	0.12	1.169	-0.0177	-0.24	-0.0883	-0.3293	1914694	CBDivE_003543	NC(=O)N/N=C/c1ccc(o1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B04	compound treatment	1.223	0.0876	1.18	1.271	0.0843	1.15	1.6488	0.9999	1914695	CBDivE_003544	O=C/1Nc2ccccc2\C1=N\c3ccc(N=Nc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B05	compound treatment	1.19	0.0546	0.74	1.218	0.0313	0.43	0.823	0.9662	1914696	CBDivE_003545	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B06	compound treatment	1.144	0.00864	0.12	1.172	-0.0147	-0.2	-0.0594	-0.2559	1914697	CBDivE_003546	CC(C)(CCC(=O)Nc1cccc2ccccc12)C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B07	compound treatment	1.079	-0.0564	-0.76	1.228	0.0413	0.56	-0.1395	-0.1474	1914698	CBDivE_003547	CN(C)c1ccc(/C=N/CCCCCC\N=C\c2ccc(cc2)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B08	compound treatment	1.154	0.0186	0.25	1.124	-0.0627	-0.86	-0.4268	-0.4788	1914699	CBDivE_003548	CC(=O)c1cccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B09	compound treatment	1.076	-0.0594	-0.8	1.175	-0.0117	-0.16	-0.6791	-0.8317	1327152	CBDivE_003549	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)NC(=O)c3ccccc3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B10	compound treatment	1.121	-0.0144	-0.19	1.217	0.0303	0.41	0.1551	0.34	1914700	CBDivE_003550	COc1ccc(/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B11	compound treatment	1.038	-0.0974	-1.31	1.136	-0.0507	-0.69	-1.4177	-0.9551	1914701	CBDivE_003551	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B12	compound treatment	1.161	0.0256	0.35	1.131	-0.0557	-0.76	-0.2925	-0.3505	1914702	CBDivE_003552	Oc1ccc2ccccc2c1/C=N/c3ccc(N=Nc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B13	compound treatment	1.187	0.0516	0.7	1.195	0.00829	0.11	0.5726	0.8112	1914703	CBDivE_003553	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(cc2)[N+](=O)[O-])C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B14	compound treatment	1.085	-0.0504	-0.68	1.238	0.0513	0.7	0.0142	0.0146	1914704	CBDivE_003554	COc1cc(/C=C/2\C(=NN(C2=O)c3ccc(cc3)[N+](=O)[O-])C)cc(Cl)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B15	compound treatment	1.166	0.0306	0.41	1.208	0.0213	0.29	0.4976	0.9851	1914705	CBDivE_003555	OC(=O)c1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B16	compound treatment	1.204	0.0686	0.93	1.187	2.92E-4	0.0	0.6576	0.7101	1914706	CBDivE_003556	CCN(CC)c1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B17	compound treatment	1.155	0.0196	0.27	1.144	-0.0427	-0.58	-0.2244	-0.3507	1914707	CBDivE_003557	O=C(CN1CCCCC1)N2CCN(CC2)c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B18	compound treatment	1.161	0.0256	0.35	1.17	-0.0167	-0.23	0.0835	0.2016	1324727	CBDivE_003558	Oc1cc(Cc2ccccc2)cnc1CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B19	compound treatment	1.191	0.0556	0.75	1.238	0.0513	0.7	1.0254	0.9994	1914708	CBDivE_003559	O=C(CCCCCCC(=O)n1nnc2ccccc12)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	B20	compound treatment	1.161	0.0256	0.35	1.165	-0.0217	-0.3	0.0353	0.0775	1914709	CBDivE_003560	[O-][N+](=O)c1ccc(N/N=C(/c2ccccc2)\c3ccc(Br)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C01	compound treatment	1.091	-0.0444	-0.6	1.211	0.0243	0.33	-0.1889	-0.2762	1914710	CBDivE_003561	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C02	compound treatment	1.188	0.0526	0.71	1.236	0.0493	0.67	0.9775	0.9996	1914711	CBDivE_003562	CCNc1ccc(cc1[N+](=O)[O-])C(=O)N2CCN(CC2)C(=O)c3ccc(NCC)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C03	compound treatment	1.151	0.0156	0.21	1.165	-0.0217	-0.3	-0.0601	-0.1653	1166133	CBDivE_003563	CN(C)CCOC(=O)c1ccc2n(CCN(C)C)c(C)c(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C04	compound treatment	1.198	0.0626	0.85	1.208	0.0213	0.29	0.8029	0.8985	1914712	CBDivE_003564	[O-][N+](=O)c1ccc(cc1)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C05	compound treatment	1.12	-0.0154	-0.21	1.199	0.0123	0.17	-0.028	-0.105	1914713	CBDivE_003565	CN(C)c1ccc(/C=N/Nc2cccc(c2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C06	compound treatment	1.169	0.0336	0.45	1.221	0.0343	0.47	0.6516	0.9999	1914714	CBDivE_003566	C/C(=N/NC(=O)c1cc2ccccc2cc1O)/c3cc4c(ccc5ccccc54)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C07	compound treatment	1.117	-0.0184	-0.25	1.166	-0.0207	-0.28	-0.3748	-0.9979	1360797	CBDivE_003567	CC(=O)Nc1cccc(Oc2c(F)c(F)c(Oc3cccc(NC(=O)C)c3)c(F)c2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C08	compound treatment	1.194	0.0586	0.79	1.254	0.0673	0.92	1.2083	0.9973	1448795	CBDivE_003568	Cc1ccc(Nc2ccccc2C(=O)O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C09	compound treatment	1.122	-0.0134	-0.18	1.151	-0.0357	-0.49	-0.4717	-0.9086	1914715	CBDivE_003569	Nc1ccc(OS(=O)(=O)c2ccc(Cl)c(N)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C10	compound treatment	1.154	0.0186	0.25	1.18	-0.00671	-0.09	0.1132	0.4228	1914716	CBDivE_003570	Cc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C11	compound treatment	1.157	0.0216	0.29	1.177	-0.00971	-0.13	0.1129	0.352	1914717	CBDivE_003571	COc1ccccc1C(=O)NC(Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C12	compound treatment	1.171	0.0356	0.48	1.205	0.0183	0.25	0.5164	0.9533	1914718	CBDivE_003572	Clc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C13	compound treatment	1.105	-0.0304	-0.41	1.156	-0.0307	-0.42	-0.5857	-0.9999	1914719	CBDivE_003573	CCCCCC(=O)NC(N1CCCCC1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C14	compound treatment	1.146	0.0106	0.14	1.21	0.0233	0.32	0.3261	0.9356	1914720	CBDivE_003574	ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)Nc3ccccc3I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C15	compound treatment	1.184	0.0486	0.66	1.156	-0.0307	-0.42	0.1679	0.2157	1914721	CBDivE_003575	[O-][N+](=O)c1ccc(cc1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C16	compound treatment	1.196	0.0606	0.82	1.201	0.0143	0.19	0.7163	0.8517	1914722	CBDivE_003576	Oc1ccc(/C=N/c2cccc3c(\N=C\c4ccc(O)cc4)cccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C17	compound treatment	1.146	0.0106	0.14	1.17	-0.0167	-0.23	-0.0596	-0.2212	1914723	CBDivE_003577	COc1ccc(cc1)C(=O)NC(Nc2ccc(cc2)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C18	compound treatment	1.107	-0.0284	-0.38	1.216	0.0293	0.4	0.0119	0.0216	1914724	CBDivE_003578	COc1cccc(c1)C(=O)NC(NC(=S)Nn2cnnc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C19	compound treatment	1.144	0.00864	0.12	1.206	0.0193	0.26	0.2685	0.933	1914725	CBDivE_003579	COc1ccc(cc1)C(=O)NC(Nc2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	C20	compound treatment	1.156	0.0206	0.28	1.197	0.0103	0.14	0.2962	0.9497	1451690	CBDivE_003580	Cc1nc2c(ncnc2[nH]1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D01	compound treatment	1.147	0.0116	0.16	1.195	0.00829	0.11	0.191	0.987	1914726	CBDivE_003581	OCC(=O)N/N=C/c1cccc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D02	compound treatment	1.156	0.0206	0.28	1.15	-0.0367	-0.5	-0.157	-0.2741	1302919	CBDivE_003582	COc1ccc(CCc2nc(C)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D03	compound treatment	1.089	-0.0464	-0.63	1.181	-0.00571	-0.08	-0.4973	-0.789	1914727	CBDivE_003583	NC(=O)N/N=C/c1ccc(o1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D04	compound treatment	1.114	-0.0214	-0.29	1.161	-0.0257	-0.35	-0.4516	-0.9953	1914728	CBDivE_003584	CCOC(=O)c1c(NC(=O)Nc2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D05	compound treatment	1.165	0.0296	0.4	1.18	-0.00671	-0.09	0.2181	0.5316	1083802	CBDivE_003585	Cc1ccc2nc(sc2c1S(=O)(=O)O)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D06	compound treatment	1.101	-0.0344	-0.46	1.116	-0.0707	-0.96	-1.0095	-0.9436	1914729	CBDivE_003586	CC(C)(CCC(=O)n1nnc2ccccc12)C(=O)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D07	compound treatment	1.174	0.0386	0.52	1.182	-0.00471	-0.06	0.3232	0.6154	1914730	CBDivE_003587	NCCOCCOCCOCCN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D08	compound treatment	1.166	0.0306	0.41	1.18	-0.00671	-0.09	0.2276	0.5376	1914731	CBDivE_003588	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D09	compound treatment	1.119	-0.0164	-0.22	1.191	0.00429	0.06	-0.1146	-0.5022	1701540	CBDivE_003589	OC(=O)c1ccc(cc1)S(=O)(=O)c2cc(Br)c(O)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D10	compound treatment	1.179	0.0436	0.59	1.181	-0.00571	-0.08	0.3613	0.6083	1914732	CBDivE_003590	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D11	compound treatment	1.174	0.0386	0.52	1.143	-0.0437	-0.6	-0.0528	-0.0667	1725963	CBDivE_003591	OC(=O)c1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D12	compound treatment	1.127	-0.00836	-0.11	1.165	-0.0217	-0.3	-0.289	-0.9125	1914733	CBDivE_003592	COc1ccc(/C=N\NC(=O)c2cccc(c2)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D13	compound treatment	1.176	0.0406	0.55	1.173	-0.0137	-0.19	0.2555	0.4411	1914734	CBDivE_003593	COc1ccc(CC(=O)NC(NC(=S)Nc2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D14	compound treatment	1.135	-3.56E-4	0.0	1.182	-0.00471	-0.06	-0.0488	-0.7579	1396775	CBDivE_003594	Brc1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D15	compound treatment	1.128	-0.00736	-0.1	1.122	-0.0647	-0.88	-0.6941	-0.7817	1914735	CBDivE_003595	COc1ccc(CC(=O)NC(NC(=S)Nc2ccccc2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D16	compound treatment	1.165	0.0296	0.4	1.159	-0.0277	-0.38	0.0156	0.0284	1914736	CBDivE_003596	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D17	compound treatment	1.143	0.00764	0.1	1.141	-0.0457	-0.62	-0.3678	-0.5822	1914737	CBDivE_003597	COc1ccc(CC(=O)NC(NC(=S)Nc2cccc(c2)C(=O)O)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D18	compound treatment	1.175	0.0396	0.53	1.214	0.0273	0.37	0.6413	0.9843	1570440	CBDivE_003598	Oc1cc(Cc2ccccc2)cnc1CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D19	compound treatment	1.132	-0.00336	-0.05	1.238	0.0513	0.7	0.4626	0.66	1914738	CBDivE_003599	Brc1ccc(/C=N/OC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	D20	compound treatment	1.171	0.0356	0.48	1.169	-0.0177	-0.24	0.1693	0.3146	1914739	CBDivE_003600	CC(=O)Nc1ccc(cc1)/C(=N\Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E01	compound treatment	1.231	0.0956	1.29	1.257	0.0703	0.96	1.5902	0.9893	1914740	CBDivE_003601	OC(=O)c1ccc(NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E02	compound treatment	1.163	0.0276	0.37	1.168	-0.0187	-0.26	0.0833	0.1844	1914741	CBDivE_003602	OC(=O)CSc1ccc(cc1[N+](=O)[O-])C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E03	compound treatment	1.164	0.0286	0.39	1.172	-0.0147	-0.2	0.1314	0.3018	1775247	CBDivE_003603	[O-][N+](=O)c1cccc2C(=O)N(C(=O)c21)c3ccc(cc3)C(=O)OCC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E04	compound treatment	1.202	0.0666	0.9	1.213	0.0263	0.36	0.8893	0.9187	1914742	CBDivE_003604	ClC(Cl)(Cl)C(NC(=O)c1ccccc1)OCCOC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E05	compound treatment	1.094	-0.0414	-0.56	1.128	-0.0587	-0.8	-0.9606	-0.9844	1914743	CBDivE_003605	CCCN1C(=O)/C(=C/C=C\2/Oc3ccccc3N2CCC(=O)O)/N(CCO)C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E06	compound treatment	1.198	0.0626	0.85	1.185	-0.00171	-0.02	0.5811	0.6874	1914744	CBDivE_003606	C/C(=N/NC(=O)c1cc2ccccc2cc1O)/c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E07	compound treatment	1.099	-0.0364	-0.49	1.213	0.0263	0.36	-0.0933	-0.1536	1914745	CBDivE_003607	CCC(NC1CS(=O)(=O)C=C1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E08	compound treatment	1.168	0.0326	0.44	1.192	0.00529	0.07	0.3624	0.8121	1380275	CBDivE_003608	Brc1cnc2[nH]c(COc3ccccc3)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E09	compound treatment	1.216	0.0806	1.09	1.159	-0.0277	-0.38	0.5021	0.436	1914746	CBDivE_003609	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc(OC(F)(F)C(F)F)c(NC(=O)c3ccc(cc3)[N+](=O)[O-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E10	compound treatment	1.141	0.00564	0.08	1.177	-0.00971	-0.13	-0.0398	-0.2604	1914747	CBDivE_003610	Cc1cccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E11	compound treatment	1.066	-0.0694	-0.94	1.159	-0.0277	-0.38	-0.9288	-0.9204	1914748	CBDivE_003611	COc1ccccc1C(=O)NC(Nc2ccc(cc2)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E12	compound treatment	1.144	0.00864	0.12	1.235	0.0483	0.66	0.5481	0.8196	1914749	CBDivE_003612	Clc1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E13	compound treatment	1.083	-0.0524	-0.71	1.237	0.0503	0.69	-0.0145	-0.0147	1914750	CBDivE_003613	CCN(CC)C(NC(=O)Cc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E14	compound treatment	1.148	0.0126	0.17	1.235	0.0483	0.66	0.5863	0.8618	1914751	CBDivE_003614	ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E15	compound treatment	1.146	0.0106	0.14	1.213	0.0263	0.36	0.355	0.9193	1914752	CBDivE_003615	[O-][N+](=O)c1ccc(cc1)C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E16	compound treatment	1.085	-0.0504	-0.68	1.196	0.00929	0.13	-0.3908	-0.5655	1914753	CBDivE_003616	OCCCNC(=O)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E17	compound treatment	1.108	-0.0274	-0.37	1.153	-0.0337	-0.46	-0.586	-0.9941	1914754	CBDivE_003617	COc1ccc(cc1)C(=O)NC(Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E18	compound treatment	1.127	-0.00836	-0.11	1.165	-0.0217	-0.3	-0.289	-0.9125	1914755	CBDivE_003618	COc1cccc(c1)C(=O)NC(NC(=S)Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E19	compound treatment	1.144	0.00864	0.12	1.165	-0.0217	-0.3	-0.1269	-0.3987	1914756	CBDivE_003619	COc1ccc(cc1)C(=O)NC(Nc2ccccc2OC)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	E20	compound treatment	1.118	-0.0174	-0.23	1.201	0.0143	0.19	-0.0278	-0.0911	1478136	CBDivE_003620	OC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F01	compound treatment	1.067	-0.0684	-0.92	1.186	-7.08E-4	-0.01	-0.6589	-0.7145	3105598	CBDivE_003621	Nc1c2CCCc2nc3ccccc13.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F02	compound treatment	1.116	-0.0194	-0.26	1.171	-0.0157	-0.21	-0.3361	-0.9952	1296804	CBDivE_003622	Cc1ccc(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F03	compound treatment	1.111	-0.0244	-0.33	1.163	-0.0237	-0.32	-0.4609	-1.0	1914757	CBDivE_003623	COc1ccc(cc1NC(=S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F04	compound treatment	1.128	-0.00736	-0.1	1.208	0.0213	0.29	0.1351	0.4404	1914758	CBDivE_003624	Cc1cc(C)c(C(=C)c2c(C)cc(C)c(/C=N/NC(=O)N)c2C)c(C)c1/C=N/NC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F05	compound treatment	1.209	0.0736	0.99	1.198	0.0113	0.15	0.8114	0.8071	1592201	CBDivE_003625	CN1CCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F06	compound treatment	1.125	-0.0104	-0.14	1.148	-0.0387	-0.53	-0.472	-0.8645	1914759	CBDivE_003626	CC(C)(CCC(=O)Nc1ccc(Cl)cc1Cl)C(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F07	compound treatment	1.135	-3.56E-4	0.0	1.124	-0.0627	-0.86	-0.6081	-0.7111	1914760	CBDivE_003627	O=C(C(=C1Nc2ccccc2N1)C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F08	compound treatment	1.177	0.0416	0.56	1.199	0.0123	0.17	0.5158	0.8798	1495504	CBDivE_003628	O=C(Oc1ccc(cc1)C2N(CCN2c3ccccc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F09	compound treatment	1.132	-0.00336	-0.05	1.178	-0.00871	-0.12	-0.116	-0.9126	1914761	CBDivE_003629	C[n+]1ccc(cc1)C(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F10	compound treatment	1.137	0.00164	0.02	1.174	-0.0127	-0.17	-0.1069	-0.6116	1914762	CBDivE_003630	COc1ccc(/C=N/c2ccc(cc2)c3ccc(\N=C\c4ccc(OC)cc4)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F11	compound treatment	1.14	0.00464	0.06	1.159	-0.0277	-0.38	-0.2229	-0.5819	1914763	CBDivE_003631	COc1ccc(NC(=S)NC(NC(=O)Cc2ccc(OC)c(OC)c2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F12	compound treatment	1.145	0.00964	0.13	1.133	-0.0537	-0.73	-0.4259	-0.5725	1914764	CBDivE_003632	COc1ccc(/C(=N\NC(=O)c2ccccc2O)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F13	compound treatment	1.138	0.00264	0.04	1.186	-7.08E-4	-0.01	0.0184	0.4976	1914765	CBDivE_003633	COc1ccc(CC(=O)NC(NC(=S)Nc2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F14	compound treatment	1.185	0.0496	0.67	1.253	0.0663	0.9	1.1128	0.9891	1914766	CBDivE_003634	Brc1ccc(/C=N/c2ccc(Cc3ccc(\N=C\c4ccc(Br)cc4)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F15	compound treatment	1.147	0.0116	0.16	1.144	-0.0427	-0.58	-0.3007	-0.4986	1914767	CBDivE_003635	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(C)cc2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F16	compound treatment	1.096	-0.0394	-0.53	1.141	-0.0457	-0.62	-0.8162	-0.9968	1914768	CBDivE_003636	C(=N/c1cccc2c(\N=C\c3ccco3)cccc12)\c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F17	compound treatment	1.153	0.0176	0.24	1.161	-0.0257	-0.35	-0.0796	-0.1878	1203095	CBDivE_003637	CCOC(=O)c1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F18	compound treatment	1.163	0.0276	0.37	1.209	0.0223	0.3	0.4786	0.9949	1914769	CBDivE_003638	[O-][N+](=O)c1ccccc1/C=N\c2cccc3c(/N=C\c4ccccc4[N+](=O)[O-])cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F19	compound treatment	1.158	0.0226	0.31	1.186	-7.08E-4	-0.01	0.2092	0.6844	1914770	CBDivE_003639	CCC1(CC)C(=O)NC(=Nc2ccc(OC)cc2)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	F20	compound treatment	1.142	0.00664	0.09	1.178	-0.00871	-0.12	-0.0206	-0.1384	1914771	CBDivE_003640	C/C(=N\N=C(/C)\c1ccc(cc1)c2ccccc2)/c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G01	compound treatment	1.209	0.0736	0.99	1.269	0.0823	1.12	1.496	0.9982	1914772	CBDivE_003641	OC(=O)c1cccc(NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G02	compound treatment	1.128	-0.00736	-0.1	1.182	-0.00471	-0.06	-0.1156	-0.9778	1914773	CBDivE_003642	OS(=O)(=O)C1CS(=O)(=O)CC1S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G03	compound treatment	1.22	0.0846	1.14	1.192	0.00529	0.07	0.8585	0.7503	1447122	CBDivE_003643	O=C(COC(=O)c1ccccc1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G04	compound treatment	1.121	-0.0144	-0.19	1.173	-0.0137	-0.19	-0.2691	-0.9998	1426520	CBDivE_003644	CN(C)CCSc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G05	compound treatment	1.126	-0.00936	-0.13	1.164	-0.0227	-0.31	-0.3082	-0.9217	1123196	CBDivE_003645	CC(C)(c1ccc(Oc2ccc(C(=O)O)c(c2)C(=O)O)cc1)c3ccc(Oc4ccc(C(=O)O)c(c4)C(=O)O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G06	compound treatment	1.142	0.00664	0.09	1.223	0.0363	0.49	0.4133	0.8218	1914774	CBDivE_003646	C/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G07	compound treatment	1.106	-0.0294	-0.4	1.177	-0.00971	-0.13	-0.3737	-0.8948	1369044	CBDivE_003647	O=C(Oc1ccccc1)N(Cc2ccccc2)C3CS(=O)(=O)CC3OC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G08	compound treatment	1.154	0.0186	0.25	1.218	0.0313	0.43	0.4796	0.9682	1914775	CBDivE_003648	FC(F)(F)C(Nc1ccccc1)(Nc2ccccc2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G09	compound treatment	1.14	0.00464	0.06	1.189	0.00229	0.03	0.0664	0.9484	1272472	CBDivE_003649	NC(=O)c1cc2ccc(O)cc2oc1=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G10	compound treatment	1.085	-0.0504	-0.68	1.198	0.0113	0.15	-0.3715	-0.5333	1914776	CBDivE_003650	Cc1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G11	compound treatment	1.181	0.0456	0.62	1.185	-0.00171	-0.02	0.4189	0.6799	1914777	CBDivE_003651	Cc1cccc(c1)C(=O)NC(Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G12	compound treatment	1.119	-0.0164	-0.22	1.212	0.0253	0.34	0.0878	0.2145	1914778	CBDivE_003652	Clc1cccc(Cl)c1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G13	compound treatment	1.104	-0.0314	-0.42	1.151	-0.0357	-0.49	-0.6434	-0.9975	1914779	CBDivE_003653	CC(C)(C)NC(NC(=O)Cc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G14	compound treatment	1.149	0.0136	0.18	1.214	0.0273	0.37	0.3933	0.9473	1914780	CBDivE_003654	[O-][N+](=O)c1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G15	compound treatment	1.168	0.0326	0.44	1.2	0.0133	0.18	0.4396	0.923	1914781	CBDivE_003655	[O-][N+](=O)c1ccc(cc1)C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G16	compound treatment	1.216	0.0806	1.09	1.168	-0.0187	-0.26	0.5889	0.527	1914782	CBDivE_003656	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(cc2)C(=O)O)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G17	compound treatment	1.174	0.0386	0.52	1.139	-0.0477	-0.65	-0.0914	-0.1096	1914783	CBDivE_003657	NS(=O)(=O)c1ccc(NC(NC(=O)c2ccc(cc2)[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G18	compound treatment	1.148	0.0126	0.17	1.199	0.0123	0.17	0.2391	1.0	1914784	CBDivE_003658	COc1cccc(c1)C(=O)NC(NC(=S)Nc2ccccn2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G19	compound treatment	1.172	0.0366	0.49	1.216	0.0293	0.4	0.632	0.9944	1914785	CBDivE_003659	Oc1ccc(cc1CNC(=O)CN2C(=O)c3ccccc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	G20	compound treatment	1.237	0.102	1.37	1.201	0.0143	0.19	1.1074	0.7996	1331982	CBDivE_003660	Cc1nc2cc(CC(=O)O)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H01	compound treatment	1.142	0.00664	0.09	1.209	0.0223	0.3	0.2783	0.8782	3007629	CBDivE_003661	CCCc1nc2ccccc2c(N)c1CC.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H02	compound treatment	1.073	-0.0624	-0.84	1.126	-0.0607	-0.83	-1.1802	-1.0	1342094	CBDivE_003662	Oc1cccnc1CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H03	compound treatment	1.143	0.00764	0.1	1.128	-0.0587	-0.8	-0.4932	-0.611	1677572	CBDivE_003663	Oc1ccccc1C(=O)Nc2nc[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H04	compound treatment	1.16	0.0246	0.33	1.193	0.00629	0.09	0.2958	0.8614	1914786	CBDivE_003664	CCc1cc(CC)c(/C=N/NC(=O)N)c(CC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H05	compound treatment	1.141	0.00564	0.08	1.186	-7.08E-4	-0.01	0.047	0.6125	1914787	CBDivE_003665	CN(C)CCCNC(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H06	compound treatment	1.128	-0.00736	-0.1	1.183	-0.00371	-0.05	-0.1059	-0.9511	1914788	CBDivE_003666	[O-][N+](=O)c1ccc(/C=N/c2ccccc2c3ccccc3\N=C\c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H07	compound treatment	1.145	0.00964	0.13	1.154	-0.0327	-0.45	-0.2234	-0.4808	1606403	CBDivE_003667	CC(NC(=O)C1CCC(C)(C(=O)O)C1(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H08	compound treatment	1.169	0.0336	0.45	1.185	-0.00171	-0.02	0.3045	0.6699	1914789	CBDivE_003668	[O-][N+](=O)c1ccc(NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H09	compound treatment	1.143	0.00764	0.1	1.127	-0.0597	-0.81	-0.5028	-0.6127	1914790	CBDivE_003669	OCC/N=C(\S)/Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H10	compound treatment	1.122	-0.0134	-0.18	1.188	0.00129	0.02	-0.115	-0.635	1914791	CBDivE_003670	Oc1ccccc1/C=N/c2ccc(\N=C\c3ccccc3O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H11	compound treatment	1.199	0.0636	0.86	1.222	0.0353	0.48	0.9474	0.9626	1914792	CBDivE_003671	COc1ccccc1NC(=S)NC(NC(=O)Cc2ccc(OC)c(OC)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H12	compound treatment	1.143	0.00764	0.1	1.111	-0.0757	-1.03	-0.6571	-0.6333	1914793	CBDivE_003672	Oc1cc2ccccc2cc1C(=O)N/N=C/3\C(=O)Nc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H13	compound treatment	1.147	0.0116	0.16	1.141	-0.0457	-0.62	-0.3297	-0.5129	1914794	CBDivE_003673	COc1ccc(cc1NC(=S)NC(NC(=O)Cc2ccc(OC)c(OC)c2)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H14	compound treatment	1.145	0.00964	0.13	1.183	-0.00371	-0.05	0.0562	0.4029	1914795	CBDivE_003674	[O-][N+](=O)c1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H15	compound treatment	1.095	-0.0404	-0.54	1.208	0.0213	0.29	-0.1797	-0.2912	1914796	CBDivE_003675	COc1ccc(CC(=O)NC(NC(=S)Nc2cccc(C)c2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H16	compound treatment	1.148	0.0126	0.17	1.175	-0.0117	-0.16	0.0077	0.033	1275980	CBDivE_003676	Clc1ccc(OCC(=O)NCC=C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H17	compound treatment	1.158	0.0226	0.31	1.188	0.00129	0.02	0.2285	0.7466	1400886	CBDivE_003677	CCCOc1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H18	compound treatment	1.126	-0.00936	-0.13	1.137	-0.0497	-0.68	-0.5686	-0.8246	1685700	CBDivE_003678	O=C(CC(Nc1cccc2Cc3ccccc3-c21)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H19	compound treatment	1.117	-0.0184	-0.25	1.176	-0.0107	-0.15	-0.2784	-0.9683	1527481	CBDivE_003679	CC1(C)CC(=C(CC2=C(O)CC(C)(C)CC2=O)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	H20	compound treatment	1.209	0.0736	0.99	1.179	-0.00771	-0.11	0.6282	0.6288	1914797	CBDivE_003680	CCC(=O)CC(Sc1cc(=O)oc2ccccc12)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I01	compound treatment	1.09	-0.0454	-0.61	1.305	0.118	1.61	0.7079	0.4104	1914798	CBDivE_003681	ClC(Cl)(Cl)C(NC(=O)c1cccc2ccccc12)NC(=S)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I02	compound treatment	1.125	-0.0104	-0.14	1.232	0.0453	0.62	0.3379	0.5337	1914799	CBDivE_003682	Oc1cccc(c1)N2Cc3ccccc3C2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I03	compound treatment	1.129	-0.00636	-0.09	1.201	0.0143	0.19	0.0772	0.3624	1019710	CBDivE_003683	COc1ccc(cc1)C(=O)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I04	compound treatment	1.105	-0.0304	-0.41	1.141	-0.0457	-0.62	-0.7303	-0.9792	1914800	CBDivE_003684	CC(/N=C/c1ccc(O)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I05	compound treatment	1.111	-0.0244	-0.33	1.136	-0.0507	-0.69	-0.7213	-0.9422	1505523	CBDivE_003685	O=C(Cc1c[nH]c2ccccc12)NCCc3c[nH]c4ccc(OCc5ccccc5)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I06	compound treatment	1.129	-0.00636	-0.09	1.202	0.0153	0.21	0.0868	0.385	1914801	CBDivE_003686	CCCCCCc1cc2cc(/C(=N\NC(=O)c3ccccc3)/C)c(=O)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I07	compound treatment	1.178	0.0426	0.58	1.159	-0.0277	-0.38	0.1396	0.2028	1914802	CBDivE_003687	Oc1cccc(Oc2c(F)c(F)c(Oc3cccc(O)c3)c(F)c2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I08	compound treatment	1.062	-0.0734	-0.99	1.133	-0.0537	-0.73	-1.2176	-0.989	1416442	CBDivE_003688	CCN(CC)CCC1S(=O)(=O)CC(CS1(=O)=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I09	compound treatment	1.202	0.0666	0.9	1.166	-0.0207	-0.28	0.4361	0.4627	1914803	CBDivE_003689	Oc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I10	compound treatment	1.126	-0.00936	-0.13	1.227	0.0403	0.55	0.2993	0.5308	1914804	CBDivE_003690	Cc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I11	compound treatment	1.121	-0.0144	-0.19	1.179	-0.00771	-0.11	-0.2113	-0.9588	1914805	CBDivE_003691	[O-][N+](=O)c1ccccc1C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I12	compound treatment	1.122	-0.0134	-0.18	1.248	0.0613	0.84	0.4636	0.5422	1914806	CBDivE_003692	Clc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I13	compound treatment	1.186	0.0506	0.68	1.244	0.0573	0.78	1.0355	0.9978	1914807	CBDivE_003693	ClC(Cl)(Cl)C(NCc1ccccc1)NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I14	compound treatment	1.11	-0.0254	-0.34	1.19	0.00329	0.04	-0.2101	-0.6091	1914808	CBDivE_003694	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I15	compound treatment	1.119	-0.0164	-0.22	1.194	0.00729	0.1	-0.0857	-0.3542	1914809	CBDivE_003695	COc1ccc(cc1)C(=O)NC(NC(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I16	compound treatment	1.136	6.44E-4	0.01	1.222	0.0353	0.48	0.3464	0.7197	1914810	CBDivE_003696	COC(=O)c1ccccc1NC(=S)NC(NC(=O)Cc2ccc(OC)c(OC)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I17	compound treatment	1.126	-0.00936	-0.13	1.235	0.0483	0.66	0.3764	0.5614	1914811	CBDivE_003697	[O-][N+](=O)c1ccc(cc1)C(=O)NC(Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I18	compound treatment	1.115	-0.0204	-0.27	1.231	0.0443	0.6	0.2329	0.351	1914812	CBDivE_003698	COc1cccc(c1)C(=O)NC(NC(=S)Nc2c(Cl)cc(Cl)cc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I19	compound treatment	1.145	0.00964	0.13	1.193	0.00629	0.09	0.1527	0.9796	1914813	CBDivE_003699	Oc1ccc(cc1CNC(=O)CCl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	I20	compound treatment	1.155	0.0196	0.27	1.23	0.0433	0.59	0.6048	0.9347	1250161	CBDivE_003700	NC(=O)CCS(=O)(=O)CCN1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J01	compound treatment	1.117	-0.0184	-0.25	1.216	0.0293	0.4	0.1073	0.2284	1661386	CBDivE_003701	CCc1cc2c(=O)c(coc2cc1O)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J02	compound treatment	1.177	0.0416	0.56	1.305	0.118	1.61	1.5379	0.9003	1914814	CBDivE_003702	COc1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J03	compound treatment	1.085	-0.0504	-0.68	1.195	0.00829	0.11	-0.4004	-0.5814	1914815	CBDivE_003703	C(=N/N=C/c1c2ccccc2cc3ccccc13)\c4c5ccccc5cc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J04	compound treatment	1.113	-0.0224	-0.3	1.201	0.0143	0.19	-0.0755	-0.2101	1914816	CBDivE_003704	[O-][N+](=O)c1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J05	compound treatment	1.15	0.0146	0.2	1.119	-0.0677	-0.92	-0.5132	-0.5435	1914817	CBDivE_003705	OC(=O)c1ccccc1N/N=C/c2ccc(\C=N\Nc3ccccc3C(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J06	compound treatment	1.186	0.0506	0.68	1.231	0.0443	0.6	0.9102	0.9981	1914818	CBDivE_003706	ClC(=C(Cl)COC(=O)CCCC(=O)n1nnc2ccccc12)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J07	compound treatment	1.158	0.0226	0.31	1.188	0.00129	0.02	0.2285	0.7466	1914819	CBDivE_003707	CC(=O)c1cccc(/N=C/c2ccccc2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J08	compound treatment	1.095	-0.0404	-0.54	1.163	-0.0237	-0.32	-0.6136	-0.969	1118121	CBDivE_003708	CC1(C)CC(=C(CC2C(=O)CC(C)(C)CC2=O)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J09	compound treatment	1.164	0.0286	0.39	1.176	-0.0107	-0.15	0.17	0.4115	3105649	CBDivE_003709	NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-].OP(=O)(O)CCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J10	compound treatment	1.165	0.0296	0.4	1.199	0.0123	0.17	0.4013	0.9255	1601299	CBDivE_003710	O=C(Nc1ccc(Cc2ccc(NC(=O)N3CCCCC3)cc2)cc1)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J11	compound treatment	1.134	-0.00136	-0.02	1.181	-0.00571	-0.08	-0.068	-0.8501	1914821	CBDivE_003711	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(Cl)c(Cl)c2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J12	compound treatment	1.151	0.0156	0.21	1.187	2.92E-4	0.0	0.152	0.7203	1914822	CBDivE_003712	Oc1ccc2ccccc2c1/C=N/c3ccc(cc3)c4ccc(\N=C\c5c(O)ccc6ccccc56)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J13	compound treatment	1.144	0.00864	0.12	1.168	-0.0187	-0.26	-0.0979	-0.3492	1914823	CBDivE_003713	COc1ccc(cc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J14	compound treatment	1.125	-0.0104	-0.14	1.18	-0.00671	-0.09	-0.1635	-0.9789	1914824	CBDivE_003714	Cc1nn(c(Cl)c1N=Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J15	compound treatment	1.165	0.0296	0.4	1.157	-0.0297	-0.41	-0.0037	-0.0065	1914825	CBDivE_003715	COc1ccc(CC(=O)NC(NC(=S)Nc2ccccc2C)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J16	compound treatment	1.084	-0.0514	-0.69	1.166	-0.0207	-0.28	-0.6896	-0.9217	1914826	CBDivE_003716	Cc1cc2/C(=C/c3ccc(C#Cc4ccccc4)o3)/OC(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J17	compound treatment	1.157	0.0216	0.29	1.151	-0.0357	-0.49	-0.1378	-0.2428	1914827	CBDivE_003717	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cc(ccc3O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J18	compound treatment	1.138	0.00264	0.04	1.205	0.0183	0.25	0.2016	0.8001	1914828	CBDivE_003718	[O-][N+](=O)c1ccc(N/N=C(/C=C/c2ccccc2)\c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J19	compound treatment	1.129	-0.00636	-0.09	1.182	-0.00471	-0.06	-0.106	-0.9898	1914829	CBDivE_003719	[O-][N+](=O)c1cccc(/C=N/n2cnnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	J20	compound treatment	1.115	-0.0204	-0.27	1.182	-0.00471	-0.06	-0.2396	-0.8495	1914830	CBDivE_003720	ClC(Cl)(Cl)C(NS(=O)(=O)c1ccccc1)P2(=O)OCCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K01	compound treatment	1.126	-0.00936	-0.13	1.219	0.0323	0.44	0.2221	0.4849	1914831	CBDivE_003721	CCCOc1ccc(cc1)C(=O)NCCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K02	compound treatment	1.116	-0.0194	-0.26	1.192	0.00529	0.07	-0.1336	-0.4932	1914832	CBDivE_003722	CCN(CC)CCOC(=O)c1ccc(cc1)N2Cc3ccccc3C2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K03	compound treatment	1.114	-0.0214	-0.29	1.193	0.00629	0.09	-0.1431	-0.4759	1914833	CBDivE_003723	Cc1ccc(N2C(=O)c3ccc(cc3C2=O)C(=O)c4ccc5C(=O)N(C(=O)c5c4)c6ccc(C)cc6O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K04	compound treatment	1.127	-0.00836	-0.11	1.186	-7.08E-4	-0.01	-0.0865	-0.7649	1620396	CBDivE_003724	OC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K05	compound treatment	1.124	-0.0114	-0.15	1.218	0.0313	0.43	0.1934	0.4266	1381112	CBDivE_003725	O=C(N(CN1C(=O)c2ccccc2C1=O)c3ccc(Oc4ccccc4)cc3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K06	compound treatment	1.127	-0.00836	-0.11	1.154	-0.0327	-0.45	-0.3951	-0.8588	1914834	CBDivE_003726	CCCCCCc1cc2cc(/C(=N\NC(=S)N)/C)c(=O)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K07	compound treatment	1.053	-0.0824	-1.11	1.126	-0.0607	-0.83	-1.371	-0.9895	1914835	CBDivE_003727	Oc1ccccc1/C=N/c2ccc(OC(F)(F)C(F)F)c(\N=C\c3ccccc3O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K08	compound treatment	1.155	0.0196	0.27	1.126	-0.0607	-0.83	-0.398	-0.4579	1162219	CBDivE_003728	O=S1(=O)CC(CS(=O)(=O)C1CCN2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K09	compound treatment	1.109	-0.0264	-0.36	1.177	-0.00971	-0.13	-0.345	-0.9094	1914836	CBDivE_003729	CCCCCCc1cc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])c(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K10	compound treatment	1.107	-0.0284	-0.38	1.215	0.0283	0.39	0.0023	0.0042	1914837	CBDivE_003730	Cc1ccc(C)c(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K11	compound treatment	1.148	0.0126	0.17	1.184	-0.00271	-0.04	0.0945	0.5415	1914838	CBDivE_003731	NS(=O)(=O)c1ccc(NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K12	compound treatment	1.146	0.0106	0.14	1.364	0.177	2.42	1.8111	0.7478	1914839	CBDivE_003732	Clc1cc(Cl)c(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K13	compound treatment	1.085	-0.0504	-0.68	1.161	-0.0257	-0.35	-0.7283	-0.9526	1914840	CBDivE_003733	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K14	compound treatment	1.201	0.0656	0.89	1.19	0.00329	0.04	0.6579	0.742	1914841	CBDivE_003734	[O-][N+](=O)c1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K15	compound treatment	1.149	0.0136	0.18	1.2	0.0133	0.18	0.2583	1.0	1914842	CBDivE_003735	COc1ccc(cc1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K16	compound treatment	1.185	0.0496	0.67	1.187	2.92E-4	0.0	0.4764	0.7113	1914843	CBDivE_003736	ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K17	compound treatment	1.129	-0.00636	-0.09	1.209	0.0223	0.3	0.1543	0.4886	1914844	CBDivE_003737	NS(=O)(=O)c1ccc(NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K18	compound treatment	1.192	0.0566	0.76	1.245	0.0583	0.79	1.1024	0.9998	1914845	CBDivE_003738	OC(=O)c1ccc(NC(=S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K19	compound treatment	1.139	0.00364	0.05	1.24	0.0533	0.73	0.5486	0.7532	1914846	CBDivE_003739	OC(=O)c1ccc(/N=C/c2cc(ccc2O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	K20	compound treatment	1.19	0.0546	0.74	1.214	0.0273	0.37	0.7844	0.9499	1011870	CBDivE_003740	CCN(CC)Cc1cc(O)c(CN(CC)CC)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L01	compound treatment	1.141	0.00564	0.08	1.196	0.00929	0.13	0.1434	0.9703	1914847	CBDivE_003741	S=C(N/N=C/c1ccc(\C=N\NC(=S)Nc2ccccc2)cc1)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L02	compound treatment	1.056	-0.0794	-1.07	1.201	0.0143	0.19	-0.6192	-0.569	1318480	CBDivE_003742	OC(=O)c1ccccc1C(=O)Nc2cccc3c(NC(=O)c4ccccc4C(=O)O)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L03	compound treatment	1.144	0.00864	0.12	1.193	0.00629	0.09	0.1431	0.9886	1914848	CBDivE_003743	NC1(Oc2ccccc2O1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L04	compound treatment	1.135	-3.56E-4	0.0	1.19	0.00329	0.04	0.0283	0.6278	1011775	CBDivE_003744	Cc1ccc(cc1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L05	compound treatment	1.085	-0.0504	-0.68	1.198	0.0113	0.15	-0.3715	-0.5333	1437248	CBDivE_003745	OC(=O)CCC(=O)NCc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L06	compound treatment	1.11	-0.0254	-0.34	1.193	0.00629	0.09	-0.1812	-0.5138	1914849	CBDivE_003746	Fc1ccc(NC(=O)CCCC(=O)OCC#C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L07	compound treatment	1.126	-0.00936	-0.13	1.155	-0.0317	-0.43	-0.395	-0.8769	1914850	CBDivE_003747	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(Br)cc2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L08	compound treatment	1.167	0.0316	0.43	1.138	-0.0487	-0.66	-0.1678	-0.2125	1914851	CBDivE_003748	CC1(C)COP(=O)(OC1)C(NS(=O)(=O)c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L09	compound treatment	1.162	0.0266	0.36	1.199	0.0123	0.17	0.3727	0.9397	1914852	CBDivE_003749	COC(=O)c1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L10	compound treatment	1.152	0.0166	0.22	1.153	-0.0337	-0.46	-0.1663	-0.325	1219934	CBDivE_003750	O=C(Oc1ccc2ccccc2c1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L11	compound treatment	1.117	-0.0184	-0.25	1.2	0.0133	0.18	-0.0469	-0.153	1914853	CBDivE_003751	COc1ccc(CC(=O)NC(NC(=S)Nc2ccc(C)cc2C)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L12	compound treatment	1.09	-0.0454	-0.61	1.187	2.92E-4	0.0	-0.4299	-0.7025	1914854	CBDivE_003752	CC(=O)c1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L13	compound treatment	1.126	-0.00936	-0.13	1.155	-0.0317	-0.43	-0.395	-0.8769	1775906	CBDivE_003753	Cc1ccccc1OCC(=O)Nc2cccc(c2)N3C(=O)c4ccc(cc4C3=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L14	compound treatment	1.173	0.0376	0.51	1.131	-0.0557	-0.76	-0.1781	-0.1949	1914855	CBDivE_003754	COc1ccc2sc(C)[n+](CCCS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L15	compound treatment	1.132	-0.00336	-0.05	1.123	-0.0637	-0.87	-0.6463	-0.743	1914856	CBDivE_003755	OCc1n[nH]c(CCN2C(=O)c3ccccc3C2=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L16	compound treatment	1.13	-0.00536	-0.07	1.183	-0.00371	-0.05	-0.0869	-0.9848	1013087	CBDivE_003756	NCC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L17	compound treatment	1.087	-0.0484	-0.65	1.199	0.0123	0.17	-0.3428	-0.5089	2431	CBDivE_003757	CCN(CC)CCNC(=O)c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L18	compound treatment	1.096	-0.0394	-0.53	1.221	0.0343	0.47	-0.0448	-0.0633	1914857	CBDivE_003758	Brc1ccc(/C=C\2/N=C(OC2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L19	compound treatment	1.18	0.0446	0.6	1.218	0.0313	0.43	0.7276	0.9858	1914858	CBDivE_003759	COc1ccc(/C=N/CCCCCC\N=C\c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	L20	compound treatment	1.068	-0.0674	-0.91	1.185	-0.00171	-0.02	-0.659	-0.725	1253454	CBDivE_003760	Cc1ccc(O)c(CCc2ccc(O)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M01	compound treatment	1.146	0.0106	0.14	1.227	0.0403	0.55	0.49	0.8629	1914859	CBDivE_003761	OC(=O)c1ccc(C(=O)O)c(c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M02	compound treatment	1.137	0.00164	0.02	1.186	-7.08E-4	-0.01	0.0088	0.3658	1914860	CBDivE_003762	CN1/C(=C\C=N\Cc2ccco2)/C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M03	compound treatment	1.077	-0.0584	-0.79	1.198	0.0113	0.15	-0.4478	-0.5582	1363766	CBDivE_003763	Cc1cccc(c1)N(CC(=O)O)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M04	compound treatment	1.145	0.00964	0.13	1.207	0.0203	0.28	0.2877	0.9408	1634249	CBDivE_003764	OC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M05	compound treatment	1.14	0.00464	0.06	1.179	-0.00771	-0.11	-0.03	-0.2454	1914861	CBDivE_003765	C(Cc1c[nH]c2ccccc12)NC(c3ccccc3)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M06	compound treatment	1.14	0.00464	0.06	1.208	0.0213	0.29	0.2496	0.8403	1914862	CBDivE_003766	C/C(=N\NC(=S)N)/c1cc2ccc(O)cc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M07	compound treatment	1.117	-0.0184	-0.25	1.177	-0.00971	-0.13	-0.2687	-0.957	1914863	CBDivE_003767	Nc1ccc(cc1)C(=O)Nc2ccc(OC(F)(F)C(F)F)c(NC(=O)c3ccc(N)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M08	compound treatment	1.147	0.0116	0.16	1.16	-0.0267	-0.36	-0.1465	-0.3693	1914864	CBDivE_003768	C(SCc1nc2ccccc2[nH]1)SCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M09	compound treatment	1.164	0.0286	0.39	1.214	0.0273	0.37	0.5364	0.9998	1914865	CBDivE_003769	CCCCCCc1cc2cc(/C(=N\NC(=O)c3cc4ccccc4cc3O)/C)c(=O)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M10	compound treatment	1.124	-0.0114	-0.15	1.187	2.92E-4	0.0	-0.1055	-0.6885	1914866	CBDivE_003770	COc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M11	compound treatment	1.141	0.00564	0.08	1.18	-0.00671	-0.09	-0.0108	-0.0911	1914867	CBDivE_003771	COc1ccccc1C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M12	compound treatment	1.115	-0.0204	-0.27	1.181	-0.00571	-0.08	-0.2492	-0.8731	1914868	CBDivE_003772	ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)Nc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M13	compound treatment	1.093	-0.0424	-0.57	1.159	-0.0277	-0.38	-0.6712	-0.9798	1914869	CBDivE_003773	CCCCCC(=O)NC(NC(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M14	compound treatment	1.085	-0.0504	-0.68	1.209	0.0223	0.3	-0.2654	-0.3566	1914870	CBDivE_003774	COc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M15	compound treatment	1.135	-3.56E-4	0.0	1.178	-0.00871	-0.12	-0.0874	-0.7351	1914871	CBDivE_003775	COc1ccc(cc1)C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M16	compound treatment	1.196	0.0606	0.82	1.207	0.0203	0.28	0.7742	0.8964	1914872	CBDivE_003776	COc1cccc(c1)C(=O)NC(NC(=S)Nc2cccc(c2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M17	compound treatment	1.142	0.00664	0.09	1.232	0.0453	0.62	0.5001	0.8013	1914873	CBDivE_003777	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M18	compound treatment	1.141	0.00564	0.08	1.243	0.0563	0.77	0.5966	0.7734	1914874	CBDivE_003778	Fc1ccc(NC(=S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M19	compound treatment	1.12	-0.0154	-0.21	1.169	-0.0177	-0.24	-0.3172	-0.9971	1027187	CBDivE_003779	OC(=O)COc1ccc(cc1)S(=O)(=O)c2ccc(OCC(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	M20	compound treatment	1.129	-0.00636	-0.09	1.21	0.0233	0.32	0.164	0.4984	1914875	CBDivE_003780	COC(=O)c1ccccc1NC(=S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N01	compound treatment	1.068	-0.0674	-0.91	1.152	-0.0347	-0.47	-0.9772	-0.9538	1914876	CBDivE_003781	COc1cc(ccc1/N=C/c2ccccc2O)c3ccc(/N=C/c4ccccc4O)c(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N02	compound treatment	1.149	0.0136	0.18	1.192	0.00529	0.07	0.1812	0.9164	1914877	CBDivE_003782	Oc1ccc(cc1/N=C/c2cccc(c2)[N+](=O)[O-])S(=O)(=O)c3ccc(O)c(/N=C/c4cccc(c4)[N+](=O)[O-])c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N03	compound treatment	1.061	-0.0744	-1.0	1.145	-0.0417	-0.57	-1.1115	-0.9639	1914878	CBDivE_003783	COC(=O)NC1(Oc2ccccc2O1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N04	compound treatment	1.131	-0.00436	-0.06	1.159	-0.0277	-0.38	-0.3087	-0.8074	1785940	CBDivE_003784	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N05	compound treatment	1.183	0.0476	0.64	1.193	0.00629	0.09	0.5152	0.7944	1556528	CBDivE_003785	Oc1ccc2c(CN3CCOCC3)c(O)ccc2c1CN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N06	compound treatment	1.124	-0.0114	-0.15	1.181	-0.00571	-0.08	-0.1634	-0.9507	1914879	CBDivE_003786	O=C(Oc1ccc(/C=N/c2ccc3ccccc3c2)cc1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N07	compound treatment	1.059	-0.0764	-1.03	1.138	-0.0487	-0.66	-1.1981	-0.9775	1914880	CBDivE_003787	COc1ccc(CC(=O)NC(NC(=S)Nc2cccc(Br)c2)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N08	compound treatment	1.054	-0.0814	-1.1	1.174	-0.0127	-0.17	-0.8986	-0.8087	1914881	CBDivE_003788	[O-][N+](=O)c1ccc(/C=N/c2nccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N09	compound treatment	1.073	-0.0624	-0.84	1.164	-0.0227	-0.31	-0.8138	-0.9078	1914882	CBDivE_003789	COC(=O)c1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N10	compound treatment	1.131	-0.00436	-0.06	1.203	0.0163	0.22	0.1155	0.5028	1914883	CBDivE_003790	Cc1cc(ccc1/N=C/c2c(O)ccc3ccccc23)c4ccc(/N=C/c5c(O)ccc6ccccc56)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N11	compound treatment	1.106	-0.0294	-0.4	1.185	-0.00171	-0.02	-0.2965	-0.7474	1914884	CBDivE_003791	C/C(=N\NC(=O)Nc1ccccc1)/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N12	compound treatment	1.114	-0.0214	-0.29	1.188	0.00129	0.02	-0.1913	-0.6626	1105037	CBDivE_003792	O=C(NCCNC(=O)C1(CC2CC3CC(C2)C1)C3)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N13	compound treatment	1.143	0.00764	0.1	1.076	-0.111	-1.51	-0.9946	-0.6573	1774707	CBDivE_003793	Cc1ccccc1OCC(=O)Nc2cccc(c2)N3C(=O)c4cccc([N+](=O)[O-])c4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N14	compound treatment	1.115	-0.0204	-0.27	1.187	2.92E-4	0.0	-0.1914	-0.6968	1914885	CBDivE_003794	COc1ccc(cc1)C(=O)Nc2ccc(N=Nc3ccccc3C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N15	compound treatment	1.09	-0.0454	-0.61	1.118	-0.0687	-0.94	-1.0952	-0.9787	1914886	CBDivE_003795	CC(C)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N16	compound treatment	1.077	-0.0584	-0.79	1.19	0.00329	0.04	-0.5249	-0.6657	1914887	CBDivE_003796	Cc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1/N=C/c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N17	compound treatment	1.086	-0.0494	-0.67	1.163	-0.0237	-0.32	-0.6994	-0.9449	1914888	CBDivE_003797	OCCNC(=O)/C(=C/c1ccc(o1)c2ccc(Br)cc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N18	compound treatment	1.09	-0.0454	-0.61	1.185	-0.00171	-0.02	-0.4491	-0.7335	1582641	CBDivE_003798	Cc1cc(CO)c(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N19	compound treatment	1.142	0.00664	0.09	1.116	-0.0707	-0.96	-0.6184	-0.6386	1914889	CBDivE_003799	COc1ccc(cc1)C(=O)NC(Oc2ccc(Br)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	N20	compound treatment	1.161	0.0256	0.35	1.202	0.0153	0.21	0.3921	0.9706	1914890	CBDivE_003800	CC(NC(=O)C1CC1(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O01	compound treatment	1.121	-0.0144	-0.19	1.221	0.0343	0.47	0.1937	0.3827	1774700	CBDivE_003801	[O-][N+](=O)c1cccc2C(=O)N(CNc3ccc(OCc4ccccc4)cc3)C(=O)c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O02	compound treatment	1.138	0.00264	0.04	1.269	0.0823	1.12	0.8187	0.7292	1914891	CBDivE_003802	COc1ccc(NC(=S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O03	compound treatment	1.109	-0.0264	-0.36	1.199	0.0123	0.17	-0.1329	-0.3381	1554905	CBDivE_003803	CN1CCN(CC1)c2ccc(nn2)N3CCN(C)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O04	compound treatment	1.117	-0.0184	-0.25	1.175	-0.0117	-0.16	-0.288	-0.9775	1914892	CBDivE_003804	Oc1ccc(cc1/C=N/c2ccc(cc2)S(=O)(=O)c3ccc(\N=C\c4cc(ccc4O)[N+](=O)[O-])cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O05	compound treatment	1.073	-0.0624	-0.84	1.169	-0.0177	-0.24	-0.7656	-0.8748	1914893	CBDivE_003805	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3ccc4ccccc4n3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O06	compound treatment	1.132	-0.00336	-0.05	1.189	0.00229	0.03	-0.0099	-0.1803	1278146	CBDivE_003806	O=C(Oc1ccc(cc1)N(C(=O)c2ccccc2)S(=O)(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O07	compound treatment	1.109	-0.0264	-0.36	1.149	-0.0377	-0.51	-0.615	-0.9838	1914894	CBDivE_003807	Nc1ccc(Oc2ccc(Oc3ccc(N)c(c3)[N+](=O)[O-])cc2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O08	compound treatment	1.162	0.0266	0.36	1.218	0.0313	0.43	0.5559	0.9964	1914895	CBDivE_003808	OCCCNC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O09	compound treatment	1.153	0.0176	0.24	1.188	0.00129	0.02	0.1808	0.7574	1914896	CBDivE_003809	NS(=O)(=O)c1ccc(NC(NC(=O)c2cccnc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O10	compound treatment	1.164	0.0286	0.39	1.19	0.00329	0.04	0.305	0.784	790507	CBDivE_003810	OC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O11	compound treatment	1.114	-0.0214	-0.29	1.155	-0.0317	-0.43	-0.5095	-0.9805	1914897	CBDivE_003811	COc1ccccc1C(=O)NC(NC(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O12	compound treatment	1.125	-0.0104	-0.14	1.196	0.00929	0.13	-0.0092	-0.0488	1914898	CBDivE_003812	COc1ccccc1/C=N/CCCCCC\N=C\c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O13	compound treatment	1.074	-0.0614	-0.83	1.174	-0.0127	-0.17	-0.7078	-0.837	1914899	CBDivE_003813	Cc1cccc(c1)C(=O)NC(Nc2ccc(cc2)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O14	compound treatment	1.131	-0.00436	-0.06	1.172	-0.0147	-0.2	-0.1834	-0.8774	1116039	CBDivE_003814	CC(=O)C(N=Nc1ccccc1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O15	compound treatment	1.189	0.0536	0.72	1.253	0.0663	0.9	1.1509	0.9939	1914900	CBDivE_003815	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccc(cc2)[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O16	compound treatment	1.116	-0.0194	-0.26	1.201	0.0143	0.19	-0.0468	-0.1438	1723076	CBDivE_003816	Cc1c(CCN)c2ccccc2n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O17	compound treatment	1.152	0.0166	0.22	1.205	0.0183	0.25	0.3351	0.9986	1914901	CBDivE_003817	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)Sc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O18	compound treatment	1.149	0.0136	0.18	1.227	0.0403	0.55	0.5187	0.8951	1914902	CBDivE_003818	CCOC(=O)CSc1nnc(Nc2ccccc2)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O19	compound treatment	1.126	-0.00936	-0.13	1.221	0.0343	0.47	0.2414	0.4984	1914903	CBDivE_003819	[O-][N+](=O)c1c(NN(c2ccccc2)c3ccccc3)ncnc1NN(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	O20	compound treatment	1.167	0.0316	0.43	1.246	0.0593	0.81	0.8736	0.9555	1774421	CBDivE_003820	CC1=C(C(NC(=O)N1)c2ccc(O)c(O)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P01	compound treatment	1.126	-0.00936	-0.13	1.176	-0.0107	-0.15	-0.1925	-0.9974	1914904	CBDivE_003821	COc1ccc(/C=N/c2ccc(cc2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P02	compound treatment	1.086	-0.0494	-0.67	1.201	0.0143	0.19	-0.333	-0.48	1914905	CBDivE_003822	CC(C)(CCC(=O)Nc1ccccc1Br)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P03	compound treatment	1.105	-0.0304	-0.41	1.197	0.0103	0.14	-0.1903	-0.4397	1914906	CBDivE_003823	CC(=O)C1=C(C)NC(=O)NC1c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P04	compound treatment	1.102	-0.0334	-0.45	1.183	-0.00371	-0.05	-0.354	-0.7817	1914907	CBDivE_003824	O=C(CCCC(=O)OCC#C)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P05	compound treatment	1.127	-0.00836	-0.11	1.144	-0.0427	-0.58	-0.4915	-0.8286	1914908	CBDivE_003825	Cc1ccc(cc1)C(=O)N/C(=C/c2cccc(Oc3ccccc3)c2)/C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P06	compound treatment	1.129	-0.00636	-0.09	1.164	-0.0227	-0.31	-0.2796	-0.8702	1914909	CBDivE_003826	C/C(=N\NC(=O)c1ccccc1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P07	compound treatment	1.092	-0.0434	-0.58	1.086	-0.101	-1.37	-1.3847	-0.9276	1914910	CBDivE_003827	COc1ccc(CC(=O)NC(NC(=S)Nc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P08	compound treatment	1.13	-0.00536	-0.07	1.132	-0.0547	-0.75	-0.5786	-0.772	1914911	CBDivE_003828	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P09	compound treatment	1.107	-0.0284	-0.38	1.189	0.00229	0.03	-0.2484	-0.6472	1914912	CBDivE_003829	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P10	compound treatment	1.077	-0.0584	-0.79	1.185	-0.00171	-0.02	-0.5732	-0.7277	1914913	CBDivE_003830	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P11	compound treatment	1.045	-0.0904	-1.22	1.116	-0.0707	-0.96	-1.5437	-0.9933	1692797	CBDivE_003831	CCOC(=O)c1ccccc1NC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P12	compound treatment	1.09	-0.0454	-0.61	1.139	-0.0477	-0.65	-0.8927	-0.9995	1914914	CBDivE_003832	Cc1ccccc1N=Nc2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P13	compound treatment	1.052	-0.0834	-1.12	1.155	-0.0317	-0.43	-1.1009	-0.9138	1774706	CBDivE_003833	[O-][N+](=O)c1cccc2C(=O)N(C(=O)c21)c3cccc(c3)C(=O)Nc4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P14	compound treatment	1.148	0.0126	0.17	1.161	-0.0257	-0.35	-0.1273	-0.3265	1914915	CBDivE_003834	CN1CCN(CC1)C(=O)/C=C(\C)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P15	compound treatment	1.07	-0.0654	-0.88	1.163	-0.0237	-0.32	-0.8521	-0.9073	1331432	CBDivE_003835	C(Nn1cnnc1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P16	compound treatment	1.076	-0.0594	-0.8	1.13	-0.0567	-0.77	-1.113	-0.9998	1914916	CBDivE_003836	[O-][N+](=O)c1cccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P17	compound treatment	1.058	-0.0774	-1.04	1.203	0.0163	0.22	-0.5808	-0.5444	1914917	CBDivE_003837	CC(C)Cc1ccc(cc1)C(C)C(=O)N/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P18	compound treatment	1.09	-0.0454	-0.61	1.139	-0.0477	-0.65	-0.8927	-0.9995	1914918	CBDivE_003838	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P19	compound treatment	1.077	-0.0584	-0.79	1.154	-0.0327	-0.45	-0.8721	-0.9638	1914919	CBDivE_003839	COc1ccc(Nc2ccc(cc2[N+](=O)[O-])C(=O)NC(C)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.12	P20	compound treatment	1.097	-0.0384	-0.52	1.21	0.0233	0.32	-0.1413	-0.2327	1914920	CBDivE_003840	CC/C(=C/c1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O)/SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A03	compound treatment	1.067	9.78E-4	0.01	1.313	0.00978	0.13	0.1036	0.7733	1907838	Bionet1_000081	CN(C)/C=N\C(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A04	compound treatment	1.088	0.022	0.3	1.328	0.0248	0.34	0.4486	0.9979	1156141	Bionet1_000082	COc1ccc(cc1)n2nc(C(=O)Nc3ccccc3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A05	compound treatment	1.048	-0.018	-0.24	1.317	0.0138	0.19	-0.0391	-0.1272	1907839	Bionet1_000083	O/N=C/NC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A06	compound treatment	1.064	-0.00202	-0.03	1.325	0.0218	0.3	0.1907	0.6395	1210239	Bionet1_000084	COc1ccc(cc1)n2nc(C(=O)Oc3ccccc3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A07	compound treatment	1.033	-0.033	-0.45	1.29	-0.0132	-0.18	-0.4425	-0.9207	1907840	Bionet1_000085	CO/N=C/NC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A08	compound treatment	1.051	-0.015	-0.2	1.361	0.0578	0.79	0.4138	0.5087	1907841	Bionet1_000086	FC(F)(F)c1nc2oc3ccccc3c(=O)c2cc1C(=O)NCc4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A09	compound treatment	1.039	-0.027	-0.36	1.277	-0.0262	-0.36	-0.5106	-1.0	1907842	Bionet1_000087	Clc1ccc(NC(=O)n2ccc(n2)c3ccc(cc3)n4ccnc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A10	compound treatment	1.093	0.027	0.36	1.288	-0.0152	-0.21	0.1106	0.2639	1907843	Bionet1_000088	FC(F)(F)c1nc2oc3ccccc3c(=O)c2cc1C(=O)NCc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A11	compound treatment	1.114	0.048	0.65	1.312	0.00878	0.12	0.5423	0.8239	1907844	Bionet1_000089	C/C(=N\OC(=O)Nc1ccc(Cl)cc1)/c2ccc(cc2)n3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A12	compound treatment	1.089	0.023	0.31	1.311	0.00778	0.11	0.2942	0.8979	1907845	Bionet1_000090	CC(C)NC(=O)c1cc2c(=O)c3ccccc3oc2nc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A13	compound treatment	1.036	-0.03	-0.41	1.307	0.00378	0.05	-0.25	-0.6122	1907846	Bionet1_000091	Oc1ccc(Cl)cc1N/C=C\2/Sc3cc(Cl)ccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A14	compound treatment	1.059	-0.00702	-0.09	1.319	0.0158	0.22	0.0851	0.3622	1907847	Bionet1_000092	CN(C)C(=O)Nc1cc2c(=O)c3ccccc3oc2nc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A15	compound treatment	1.052	-0.014	-0.19	1.35	0.0468	0.64	0.3173	0.4769	1907848	Bionet1_000093	CN(C)/C=N/S(=O)(=O)c1ccc(Oc2c(Cl)c(Cl)nn2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A16	compound treatment	1.072	0.00598	0.08	1.362	0.0588	0.8	0.6238	0.7743	1907849	Bionet1_000094	CON(C)C(=O)Nc1cc2c(=O)c3ccccc3oc2nc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A17	compound treatment	1.09	0.024	0.32	1.423	0.12	1.63	1.3837	0.831	1409233	Bionet1_000095	Clc1ccc(cc1)C2CC(=O)C3=C(C2)OC(=O)CC3c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A18	compound treatment	1.101	0.035	0.47	1.341	0.0378	0.52	0.6979	0.999	1907850	Bionet1_000096	CCSC(=O)Nc1cc2c(=O)c3ccccc3oc2nc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A19	compound treatment	1.052	-0.014	-0.19	1.262	-0.0412	-0.56	-0.5312	-0.8957	1907851	Bionet1_000097	FC(F)(F)c1ccccc1N/C=C\2/Sc3cc(Cl)ccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A20	compound treatment	1.054	-0.012	-0.16	1.319	0.0158	0.22	0.0375	0.139	1516152	Bionet1_000098	O=c1n(Cc2cccnc2)ccc3nc4oc5ccccc5c(=O)c4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A21	compound treatment	1.063	-0.00302	-0.04	1.298	-0.00522	-0.07	-0.0792	-0.965	1907852	Bionet1_000099	FC(F)(F)c1cccc(N/C=C\2/Sc3cc(Cl)ccc3NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	A22	compound treatment	1.047	-0.019	-0.26	1.277	-0.0262	-0.36	-0.4343	-0.9868	1736385	Bionet1_000100	O=c1n(Cc2ccncc2)ccc3nc4oc5ccccc5c(=O)c4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B03	compound treatment	1.083	0.017	0.23	1.267	-0.0362	-0.49	-0.1873	-0.344	1907853	Bionet1_000101	Clc1ccc(cc1)c2nc(nc(N3CCOCC3)c2C#N)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B04	compound treatment	1.004	-0.062	-0.84	1.329	0.0258	0.35	-0.3431	-0.378	1907854	Bionet1_000102	FC(F)(F)c1cccc(Cn2cc(ccc2=O)C(=O)Nc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B05	compound treatment	1.079	0.013	0.18	1.263	-0.0402	-0.55	-0.264	-0.4586	1907855	Bionet1_000103	CC(C)Nc1nc(nc(c1C#N)c2ccc(Cl)cc2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B06	compound treatment	1.031	-0.035	-0.47	1.332	0.0288	0.39	-0.0566	-0.0922	1568869	Bionet1_000104	Clc1cccc(Cl)c1Cn2cc(NC(=O)Nc3ccccc3)ccc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B07	compound treatment	1.069	0.00298	0.04	1.305	0.00178	0.02	0.0455	0.9707	1231829	Bionet1_000105	CC(C)Nc1nc(nc(c1C#N)c2ccc(Cl)cc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B08	compound treatment	1.055	-0.011	-0.15	1.36	0.0568	0.77	0.4423	0.5611	1489554	Bionet1_000106	Clc1cccc(Cl)c1Cn2cc(NC(=O)OCC#C)ccc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B09	compound treatment	1.047	-0.019	-0.26	1.314	0.0108	0.15	-0.0775	-0.2622	1907856	Bionet1_000107	CCN(CC)c1nc(nc(c1C#N)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B10	compound treatment	1.011	-0.055	-0.74	1.288	-0.0152	-0.21	-0.6717	-0.8714	1439159	Bionet1_000108	CC(C)(C)NC(=O)Nc1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B11	compound treatment	1.044	-0.022	-0.3	1.354	0.0508	0.69	0.2795	0.371	1369131	Bionet1_000109	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B12	compound treatment	1.017	-0.049	-0.66	1.326	0.0228	0.31	-0.248	-0.3394	1247971	Bionet1_000110	Clc1cccc(Cl)c1Cn2cc(ccc2=O)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B13	compound treatment	1.063	-0.00302	-0.04	1.336	0.0328	0.45	0.2872	0.64	1907857	Bionet1_000111	CCN(CC)c1nc(nc(c1C#N)c2ccc(Cl)cc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B14	compound treatment	1.031	-0.035	-0.47	1.322	0.0188	0.26	-0.153	-0.2848	1555183	Bionet1_000112	Clc1cccc(Cl)c1Cn2cc(ccc2=O)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B15	compound treatment	1.073	0.00698	0.09	1.245	-0.0582	-0.79	-0.4948	-0.6189	1419239	Bionet1_000113	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccccc3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B16	compound treatment	1.032	-0.034	-0.46	1.354	0.0508	0.69	0.1651	0.1987	1907858	Bionet1_000114	CN(C)CCCNC(=O)c1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B17	compound treatment	1.065	-0.00102	-0.01	1.275	-0.0282	-0.38	-0.2819	-0.732	1277711	Bionet1_000115	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccc(Cl)cc3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B18	compound treatment	1.024	-0.042	-0.57	1.242	-0.0612	-0.83	-0.9912	-0.9822	1125710	Bionet1_000116	CCN(CC)C(=O)c1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B19	compound treatment	1.048	-0.018	-0.24	1.297	-0.00622	-0.08	-0.2319	-0.9006	1561998	Bionet1_000117	CCN(CC)c1nc(nc(c1C#N)c2ccc(Cl)cc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B20	compound treatment	1.016	-0.05	-0.67	1.335	0.0318	0.43	-0.1708	-0.2129	1221478	Bionet1_000118	Clc1cccc(Cl)c1Cn2cc(ccc2=O)C(=O)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B21	compound treatment	1.042	-0.024	-0.32	1.317	0.0138	0.19	-0.0963	-0.2571	1636764	Bionet1_000119	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccc(Cl)cc3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	B22	compound treatment	1.03	-0.036	-0.49	1.31	0.00678	0.09	-0.2783	-0.5625	1907859	Bionet1_000120	FC(F)(F)Oc1ccc(NC(=O)c2ccc(=O)n(Cc3ccccc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C03	compound treatment	1.091	0.025	0.34	1.274	-0.0292	-0.4	-0.0435	-0.0834	1907860	Bionet1_000121	COc1cc(Br)cc(/C=N\c2cccc(c2)C(F)(F)F)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C04	compound treatment	1.108	0.042	0.57	1.345	0.0418	0.57	0.8033	1.0	1907861	Bionet1_000122	FC(F)(F)c1nc2oc3ccccc3c(=O)c2cc1C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C05	compound treatment	1.083	0.017	0.23	1.299	-0.00422	-0.06	0.1212	0.5134	1907862	Bionet1_000123	CCOC(=O)COc1c(OC)cc(Br)cc1/C=N\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C06	compound treatment	1.081	0.015	0.2	1.316	0.0128	0.17	0.2661	0.9973	1907863	Bionet1_000124	[O-][N+](=O)c1cc(/C=N/OC(=O)c2ccccc2)ccc1Oc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C07	compound treatment	1.077	0.011	0.15	1.36	0.0568	0.77	0.6522	0.8274	1664470	Bionet1_000125	NC(=O)Cn1nnc(n1)N(Cc2ccc(Cl)cc2)Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C08	compound treatment	1.077	0.011	0.15	1.34	0.0368	0.5	0.4593	0.8784	1907864	Bionet1_000126	[O-][N+](=O)c1cc(/C=N/OC(=O)c2ccccc2)ccc1Oc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C09	compound treatment	1.076	0.00998	0.13	1.321	0.0178	0.24	0.2666	0.9615	1907865	Bionet1_000127	CO/N=C\C(/C=C/c1ccccc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C10	compound treatment	1.039	-0.027	-0.36	1.332	0.0288	0.39	0.0197	0.0368	1672129	Bionet1_000128	CN1CCN(CC1)c2ccc(cc2)c3ccnn3C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C11	compound treatment	1.043	-0.023	-0.31	1.35	0.0468	0.64	0.2314	0.3262	1907866	Bionet1_000129	CN(NC(=O)Nc1cccc(c1)C(F)(F)F)c2c(Cl)c(Cl)nn2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C12	compound treatment	1.095	0.029	0.39	1.375	0.0718	0.98	0.9685	0.9189	1907867	Bionet1_000130	Clc1ccc(N/C=C/2\C(=O)N(CS2(=O)=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C13	compound treatment	1.111	0.045	0.61	1.33	0.0268	0.37	0.6873	0.9705	1907868	Bionet1_000131	COC(=O)c1sccc1NC(=O)c2cn(nc2C)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C14	compound treatment	1.083	0.017	0.23	1.347	0.0438	0.6	0.5841	0.9135	1907869	Bionet1_000132	Clc1ccc(N/C=C/2\C(=O)N(CS2=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C15	compound treatment	1.072	0.00598	0.08	1.282	-0.0212	-0.29	-0.1476	-0.4913	1907870	Bionet1_000133	O=C/1NN=C(\C1=C\Nc2ccc(Oc3ccccc3)cc2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C16	compound treatment	1.074	0.00798	0.11	1.365	0.0618	0.84	0.6718	0.791	1907871	Bionet1_000134	COc1ccc(N/C=C/2\C(=O)N(CS2(=O)=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C17	compound treatment	1.054	-0.012	-0.16	1.368	0.0648	0.88	0.5099	0.5678	1907872	Bionet1_000135	FC(F)(F)C/1=NN(C(=O)\C1=C/Nc2ccccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C18	compound treatment	1.051	-0.015	-0.2	1.358	0.0548	0.75	0.3849	0.4973	1907873	Bionet1_000136	FC(F)(F)c1cccc(NC(=O)N2CCSc3cc(Cl)ccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C19	compound treatment	1.042	-0.024	-0.32	1.341	0.0378	0.52	0.1351	0.222	1907874	Bionet1_000137	FC(F)(F)C/1=NN(C(=O)\C1=C/Nc2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C20	compound treatment	1.065	-0.00102	-0.01	1.291	-0.0122	-0.17	-0.1276	-0.763	1335060	Bionet1_000138	Clc1ccc(cc1)S(=O)(=O)N2CCSc3cc(Cl)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C21	compound treatment	1.104	0.038	0.51	1.299	-0.00422	-0.06	0.3216	0.6237	1907875	Bionet1_000139	FC(F)(F)C/1=NN(C(=O)\C1=C/Nc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	C22	compound treatment	1.07	0.00398	0.05	1.384	0.0808	1.1	0.8168	0.7407	1682580	Bionet1_000140	COc1ccc(cc1)S(=O)(=O)N2CCSc3cc(Cl)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D03	compound treatment	1.093	0.027	0.36	1.325	0.0218	0.3	0.4673	0.9949	1312830	Bionet1_000141	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D04	compound treatment	1.059	-0.00702	-0.09	1.361	0.0578	0.79	0.4901	0.6176	1907876	Bionet1_000142	FC(F)(F)c1cccc(c1)C2OCC3(CO2)CSc4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D05	compound treatment	1.08	0.014	0.19	1.338	0.0348	0.47	0.4687	0.9183	1907877	Bionet1_000143	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NOCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D06	compound treatment	1.016	-0.05	-0.67	1.307	0.00378	0.05	-0.4408	-0.6512	1907878	Bionet1_000144	FC(F)(F)c1cccc(Oc2nnc(Cc3ccccc3)c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D07	compound treatment	1.085	0.019	0.26	1.294	-0.00922	-0.13	0.0921	0.3229	1907879	Bionet1_000145	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NOCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D08	compound treatment	1.014	-0.052	-0.7	1.297	-0.00622	-0.08	-0.5563	-0.7869	1514069	Bionet1_000146	Clc1ccc(CSc2nnc(Cc3ccccc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D09	compound treatment	1.06	-0.00602	-0.08	1.341	0.0378	0.52	0.3068	0.5883	1907880	Bionet1_000147	Clc1ccc(cc1)c2ncc(s2)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D10	compound treatment	1.044	-0.022	-0.3	1.304	7.77E-4	0.01	-0.2026	-0.6814	1430963	Bionet1_000148	Clc1ccc(Cn2cccc(C(=O)Nc3ccccc3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D11	compound treatment	1.061	-0.00502	-0.07	1.264	-0.0392	-0.53	-0.4261	-0.7904	1596601	Bionet1_000149	Brc1ccc(cc1)C(=O)c2cnc(Nc3ccccc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D12	compound treatment	1.056	-0.01	-0.14	1.28	-0.0232	-0.32	-0.3195	-0.928	1423401	Bionet1_000150	Clc1ccc(Cn2cccc(C(=O)NCc3ccccc3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D13	compound treatment	1.11	0.044	0.59	1.274	-0.0292	-0.4	0.1377	0.1927	1907881	Bionet1_000151	Clc1ccc(cc1)c2ncc(s2)C(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D14	compound treatment	1.065	-0.00102	-0.01	1.219	-0.0842	-1.15	-0.8219	-0.7155	1477014	Bionet1_000152	Clc1ccc(Cn2cccc(C(=O)N3CCOCC3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D15	compound treatment	1.015	-0.051	-0.69	1.292	-0.0112	-0.15	-0.5949	-0.8437	1907882	Bionet1_000153	Clc1ccc(cc1)c2ncc(s2)C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D16	compound treatment	1.05	-0.016	-0.22	1.354	0.0508	0.69	0.3368	0.4643	1128049	Bionet1_000154	Clc1cccc(Cl)c1Cn2cccc(C(=O)Nc3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D17	compound treatment	1.091	0.025	0.34	1.258	-0.0452	-0.62	-0.1978	-0.2814	1531507	Bionet1_000155	Clc1ccc(cc1)c2ncc(s2)C(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D18	compound treatment	1.07	0.00398	0.05	1.315	0.0118	0.16	0.1515	0.8948	1584601	Bionet1_000156	Clc1cccc(Cl)c1Cn2cccc(C(=O)NCc3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D19	compound treatment	1.071	0.00498	0.07	1.321	0.0178	0.24	0.2189	0.8702	1740551	Bionet1_000157	O=C(c1cnc(Nc2ccccc2)s1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D20	compound treatment	1.034	-0.032	-0.43	1.335	0.0318	0.43	9.0E-4	0.0015	1907883	Bionet1_000158	FC(F)(F)c1cccc(Cn2cccc(C(=O)Nc3ccccc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D21	compound treatment	1.079	0.013	0.18	1.312	0.00878	0.12	0.2084	0.9828	1907884	Bionet1_000159	Clc1ccc(C(=O)c2cnc(Nc3ccccc3Cl)s2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	D22	compound treatment	1.01	-0.056	-0.76	1.304	7.77E-4	0.01	-0.5269	-0.6971	1907885	Bionet1_000160	Clc1ccc(NC(=O)c2cccn(Cc3cccc(Cl)c3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E03	compound treatment	1.05	-0.016	-0.22	1.305	0.00178	0.02	-0.1357	-0.6239	1907886	Bionet1_000161	FC(F)(F)C/1=NN(C(=O)\C1=C/Nc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E04	compound treatment	1.061	-0.00502	-0.07	1.357	0.0538	0.73	0.4706	0.6391	1907887	Bionet1_000162	Clc1cccc(Cl)c1CSc2nc3nccc(c4ccccc4)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E05	compound treatment	1.055	-0.011	-0.15	1.308	0.00478	0.07	-0.0591	-0.3639	1907888	Bionet1_000163	FC(F)(F)C/1=NN(C(=O)\C1=C/Nc2ccc(cc2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E06	compound treatment	1.067	9.78E-4	0.01	1.336	0.0328	0.45	0.3254	0.7277	1907889	Bionet1_000164	Clc1cccc(Cl)c1CSc2nc3nccc(c4ccccn4)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E07	compound treatment	1.053	-0.013	-0.18	1.352	0.0488	0.67	0.3461	0.5031	1177978	Bionet1_000165	O=S(=O)(c1ccccc1)n2cc(c(n2)N3CCOCC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E08	compound treatment	1.101	0.035	0.47	1.341	0.0378	0.52	0.6979	0.999	1907890	Bionet1_000166	Clc1ccc(/C=C/c2nc3ccccc3c(=O)n2c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E09	compound treatment	1.096	0.03	0.4	1.321	0.0178	0.24	0.4574	0.97	1907891	Bionet1_000167	CN(C)c1nn(cc1c2ccccc2)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E10	compound treatment	1.088	0.022	0.3	1.373	0.0698	0.95	0.8825	0.8855	1907892	Bionet1_000168	COc1ccc(/C=C/c2nc3ccccc3c(=O)n2c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E11	compound treatment	1.081	0.015	0.2	1.322	0.0188	0.26	0.3239	0.9931	1907893	Bionet1_000169	CN(C)c1nn(cc1c2ccccc2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E12	compound treatment	1.033	-0.033	-0.45	1.342	0.0388	0.53	0.0589	0.0852	1907894	Bionet1_000170	COc1cccc(/C=C/c2nc3ccccc3c(=O)n2c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E13	compound treatment	1.047	-0.019	-0.26	1.318	0.0148	0.2	-0.039	-0.1194	1907895	Bionet1_000171	CN(C)c1nn(cc1c2ccccc2)C(=S)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E14	compound treatment	1.055	-0.011	-0.15	1.294	-0.00922	-0.13	-0.1941	-0.9965	1907896	Bionet1_000172	CNc1nn(cc1[N+](=O)[O-])S(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E15	compound treatment	1.109	0.043	0.58	1.324	0.0208	0.28	0.6103	0.9458	1907897	Bionet1_000173	CN(C)c1nn(cc1c2ccccc2)C(=S)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E16	compound treatment	1.076	0.00998	0.13	1.292	-0.0112	-0.15	-0.013	-0.0639	1198543	Bionet1_000174	Cc1nc2oc3ccccc3c(=O)c2cc1C(=O)NCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E17	compound treatment	1.072	0.00598	0.08	1.354	0.0508	0.69	0.5466	0.7842	1907898	Bionet1_000175	COC(Cc1nnc(SCc2ccccc2)n1c3ccccc3)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E18	compound treatment	1.04	-0.026	-0.35	1.351	0.0478	0.65	0.2125	0.2871	1907899	Bionet1_000176	FC(F)(F)c1cccc(NC(=O)Cc2nc(=O)c3ccccc3s2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E19	compound treatment	1.106	0.04	0.54	1.304	7.77E-4	0.01	0.3889	0.7209	1907900	Bionet1_000177	COC(Cc1nnc(SCc2ccccc2)n1c3ccc(Cl)cc3)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E20	compound treatment	1.093	0.027	0.36	1.354	0.0508	0.69	0.747	0.9549	1655354	Bionet1_000178	CSc1nc2nccc(C(C)Oc3ccc(Cl)cc3Cl)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E21	compound treatment	1.097	0.031	0.42	1.358	0.0548	0.75	0.8237	0.9623	1907901	Bionet1_000179	COC(Cc1nnc(SCC#C)n1c2cccc(c2)C(F)(F)F)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	E22	compound treatment	1.049	-0.017	-0.23	1.39	0.0868	1.18	0.6744	0.5594	1907902	Bionet1_000180	CN(C)/C=C(/C(=O)c1ccc(Cl)cc1)\S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F03	compound treatment	1.066	-2.19E-5	0.0	1.289	-0.0142	-0.19	-0.1373	-0.7082	1443658	Bionet1_000181	Clc1ccccc1Nc2ncc(s2)C(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F04	compound treatment	1.04	-0.026	-0.35	1.265	-0.0382	-0.52	-0.6168	-0.9815	1907903	Bionet1_000182	Fc1ccc(NC(=O)c2cccn(Cc3cccc(Cl)c3)c2=O)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F05	compound treatment	1.082	0.016	0.22	1.332	0.0288	0.39	0.4299	0.9602	1907904	Bionet1_000183	Clc1ccccc1Nc2ncc(s2)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F06	compound treatment	1.051	-0.015	-0.2	1.246	-0.0572	-0.78	-0.6951	-0.8621	1907905	Bionet1_000184	CN(C)CCNC(=O)c1cccn(Cc2cccc(c2)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F07	compound treatment	1.08	0.014	0.19	1.26	-0.0432	-0.59	-0.2834	-0.458	1265704	Bionet1_000185	Clc1ccc(cc1Cl)C(=O)c2cnc(Nc3ccccc3Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F08	compound treatment	1.048	-0.018	-0.24	1.331	0.0278	0.38	0.0959	0.2131	1226268	Bionet1_000186	CN(C)CCNC(=O)c1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F09	compound treatment	1.063	-0.00302	-0.04	1.239	-0.0642	-0.88	-0.6481	-0.7392	1313674	Bionet1_000187	Fc1ccc(cc1)C(=O)c2cnc(Nc3ccc(Cl)c(Cl)c3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F10	compound treatment	1.023	-0.043	-0.58	1.224	-0.0792	-1.08	-1.1743	-0.9576	1321594	Bionet1_000188	CN1CCN(CC1)C(=O)c2cccn(Cc3c(Cl)cccc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F11	compound treatment	1.091	0.025	0.34	1.252	-0.0512	-0.7	-0.2556	-0.3296	1683152	Bionet1_000189	Clc1ccc(cc1)C(=O)c2cnc(Nc3ccc(Cl)c(Cl)c3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F12	compound treatment	1.053	-0.013	-0.18	1.286	-0.0172	-0.23	-0.2903	-0.9898	1907906	Bionet1_000190	FC(F)(F)c1cccc(NC(=O)c2cccn(Cc3ccccc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F13	compound treatment	1.09	0.024	0.32	1.28	-0.0232	-0.32	0.0048	0.0106	1907907	Bionet1_000191	N#Cc1c(Sc2ccccc2)nc(nc1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F14	compound treatment	1.032	-0.034	-0.46	1.259	-0.0442	-0.6	-0.751	-0.9909	1907908	Bionet1_000192	FC(F)(F)Oc1ccc(NC(=O)c2cccn(Cc3ccccc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F15	compound treatment	1.074	0.00798	0.11	1.285	-0.0182	-0.25	-0.0996	-0.3678	1907909	Bionet1_000193	NCCNC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F16	compound treatment	1.049	-0.017	-0.23	1.331	0.0278	0.38	0.1055	0.2381	1254840	Bionet1_000194	Fc1ccc(NC(=O)Nc2cccn(Cc3ccc(Cl)cc3)c2=O)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F17	compound treatment	1.078	0.012	0.16	1.315	0.0118	0.16	0.2278	1.0	1907910	Bionet1_000195	[O-][N+](=O)c1ccc(CO/N=C/c2c(nc3sccn23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F18	compound treatment	1.039	-0.027	-0.36	1.22	-0.0832	-1.13	-1.0602	-0.8895	1457322	Bionet1_000196	Cc1cccc(C)c1NC(=O)Nc2cccn(Cc3ccc(Cl)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F19	compound treatment	1.059	-0.00702	-0.09	1.293	-0.0102	-0.14	-0.1656	-0.9823	1907911	Bionet1_000197	COc1ccc(cc1)C(=O)O/N=C/c2c(nc3sccn23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F20	compound treatment	1.065	-0.00102	-0.01	1.309	0.00578	0.08	0.046	0.5746	1216393	Bionet1_000198	Cc1ccc(NC(=O)Nc2cccn(Cc3ccc(Cl)cc3)c2=O)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F21	compound treatment	1.051	-0.015	-0.2	1.312	0.00878	0.12	-0.0587	-0.2492	1907912	Bionet1_000199	Clc1ccc(NC(=O)C(=O)NN/C=C/2\OC(=O)c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	F22	compound treatment	0.995	-0.071	-0.96	1.288	-0.0152	-0.21	-0.8243	-0.8408	1191923	Bionet1_000200	CN1CCN(CC1)C(=O)Nc2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G03	compound treatment	1.095	0.029	0.39	1.244	-0.0592	-0.81	-0.2946	-0.3284	1907913	Bionet1_000201	FC(F)(F)c1cccc(N/C=C/c2onc(c2C#N)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G04	compound treatment	1.084	0.018	0.24	1.327	0.0238	0.32	0.4008	0.9898	1907914	Bionet1_000202	Nc1ncc(c(n1)c2ccc(Cl)cc2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G05	compound treatment	1.086	0.02	0.27	1.254	-0.0492	-0.67	-0.284	-0.3927	1907915	Bionet1_000203	Cc1ccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G06	compound treatment	1.112	0.046	0.62	1.355	0.0518	0.71	0.9379	0.9979	1907916	Bionet1_000204	CN(C)/C=C(/C(=O)c1ccc(Cl)cc1)\S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G07	compound treatment	1.043	-0.023	-0.31	1.319	0.0158	0.22	-0.0675	-0.1786	1907917	Bionet1_000205	Clc1ccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G08	compound treatment	1.046	-0.02	-0.27	1.268	-0.0352	-0.48	-0.5306	-0.9629	1907918	Bionet1_000206	Cc1ccc(cc1)S(=O)(=O)c2cnc(N)nc2c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G09	compound treatment	1.058	-0.00802	-0.11	1.358	0.0548	0.75	0.4517	0.5984	1907919	Bionet1_000207	COc1ccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G10	compound treatment	1.085	0.019	0.26	1.269	-0.0342	-0.47	-0.149	-0.2798	1351582	Bionet1_000208	Cc1ccc2oc3nc(C)c(cc3c(=O)c2c1)C(=O)NCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G11	compound treatment	1.075	0.00898	0.12	1.289	-0.0142	-0.19	-0.0515	-0.2252	1907920	Bionet1_000209	COc1ccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G12	compound treatment	1.093	0.027	0.36	1.325	0.0218	0.3	0.4673	0.9949	1161021	Bionet1_000210	Brc1ccc(cc1)c2ccnc3nc(nn23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G13	compound treatment	1.086	0.02	0.27	1.312	0.00878	0.12	0.2752	0.9332	1907921	Bionet1_000211	Clc1cc(Cl)cc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G14	compound treatment	1.089	0.023	0.31	1.326	0.0228	0.31	0.4388	1.0	1597676	Bionet1_000212	C1CN(CCO1)c2nc3nccc(c4ccc(cc4)c5ccccc5)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G15	compound treatment	1.114	0.048	0.65	1.286	-0.0172	-0.23	0.2916	0.4235	1907922	Bionet1_000213	Clc1cccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G16	compound treatment	1.079	0.013	0.18	1.309	0.00578	0.08	0.1795	0.935	1377034	Bionet1_000214	Clc1ccc(c(Cl)c1)c2ccnc3nc(nn23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G17	compound treatment	1.066	-2.19E-5	0.0	1.328	0.0248	0.34	0.2387	0.7065	1907923	Bionet1_000215	Clc1cccc(Cl)c1c2noc(/C=C/Nc3ccccc3)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G18	compound treatment	1.078	0.012	0.16	1.332	0.0288	0.39	0.3917	0.9231	1589535	Bionet1_000216	C1CN(CCO1)c2nc3nccc(c4ccc(Oc5ccccc5)cc4)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G19	compound treatment	1.072	0.00598	0.08	1.293	-0.0102	-0.14	-0.0415	-0.258	1907924	Bionet1_000217	Clc1ccc(N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G20	compound treatment	1.069	0.00298	0.04	1.31	0.00678	0.09	0.0938	0.9304	1505175	Bionet1_000218	Clc1ccc(NC(=O)N2CCN(CC2)c3cccc(Cl)n3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G21	compound treatment	1.099	0.033	0.44	1.369	0.0658	0.9	0.9488	0.9477	1907925	Bionet1_000219	Fc1ccc(N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	G22	compound treatment	1.087	0.021	0.28	1.37	0.0668	0.91	0.844	0.8851	1263635	Bionet1_000220	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cccc(Cl)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H03	compound treatment	1.052	-0.014	-0.19	1.264	-0.0392	-0.53	-0.512	-0.9024	1907926	Bionet1_000221	Clc1ccc(cc1)C(=O)C/C=N/OCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H04	compound treatment	1.0	-0.066	-0.89	1.269	-0.0342	-0.47	-0.9598	-0.9545	1563074	Bionet1_000222	Clc1ccc(Cn2cccc(NC(=O)OCC#C)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H05	compound treatment	1.086	0.02	0.27	1.343	0.0398	0.54	0.5741	0.9479	1907927	Bionet1_000223	Clc1ccc(CO/N=C/NC(=O)/C(=C/c2cccs2)/C#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H06	compound treatment	1.022	-0.044	-0.59	1.261	-0.0422	-0.58	-0.8271	-0.9999	1907928	Bionet1_000224	FC(F)(F)c1cccc(CNC(=O)c2cccn(Cc3ccccc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H07	compound treatment	1.109	0.043	0.58	1.287	-0.0162	-0.22	0.2536	0.4086	1907929	Bionet1_000225	COc1ccc(cc1)C(=O)C/C=N/OCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H08	compound treatment	1.055	-0.011	-0.15	1.29	-0.0132	-0.18	-0.2326	-0.9954	1724228	Bionet1_000226	Clc1ccc(Cn2cc(ccc2=O)C(=O)NCCN3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H09	compound treatment	1.097	0.031	0.42	1.301	-0.00222	-0.03	0.2741	0.6541	1907930	Bionet1_000227	Clc1ccc(CO/N=C/NC(=O)/C(=C\c2ccccc2)/C#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H10	compound treatment	1.096	0.03	0.4	1.289	-0.0142	-0.19	0.1488	0.3318	1907931	Bionet1_000228	FC(F)(F)COC(=O)Nc1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H11	compound treatment	1.06	-0.00602	-0.08	1.3	-0.00322	-0.04	-0.0885	-0.9584	1907932	Bionet1_000229	Clc1cccc(Cl)c1CO/N=C/NC(=O)/C(=C\c2ccccc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H12	compound treatment	1.048	-0.018	-0.24	1.325	0.0218	0.3	0.0381	0.0992	1342989	Bionet1_000230	Clc1ccc(Cn2cccc(NC(=O)Oc3cccnc3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H13	compound treatment	1.051	-0.015	-0.2	1.31	0.00678	0.09	-0.0779	-0.35	1907933	Bionet1_000231	Clc1ccc(CO/N=C/NC(=O)/C(=C\c2ccccc2)/C#N)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H14	compound treatment	1.031	-0.035	-0.47	1.337	0.0338	0.46	-0.0084	-0.0127	1907934	Bionet1_000232	[O-][N+](=O)c1cc(cn(Cc2ccc(Cl)c(Cl)c2)c1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H15	compound treatment	1.086	0.02	0.27	1.313	0.00978	0.13	0.2849	0.9473	1907935	Bionet1_000233	Clc1ccc(cc1)C(=O)C/C=N/OCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H16	compound treatment	1.014	-0.052	-0.7	1.315	0.0118	0.16	-0.3827	-0.5316	1469293	Bionet1_000234	Oc1ccc2cc(NC(=O)c3ccc(Cl)cc3Cl)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H17	compound treatment	1.046	-0.02	-0.27	1.294	-0.00922	-0.13	-0.2799	-0.9395	1907936	Bionet1_000235	O/N=C/c1c(SCc2cccc(c2)C(F)(F)F)nc3sccn13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H18	compound treatment	1.057	-0.00902	-0.12	1.283	-0.0202	-0.28	-0.2811	-0.9324	1641579	Bionet1_000236	COc1ccc2cc(NC(=O)c3ccc(Cl)cc3Cl)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H19	compound treatment	1.09	0.024	0.32	1.299	-0.00422	-0.06	0.188	0.5722	1907937	Bionet1_000237	Clc1ccc(Sc2nc(nc(c2C#N)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H20	compound treatment	1.037	-0.029	-0.39	1.276	-0.0272	-0.37	-0.5393	-0.9996	1713813	Bionet1_000238	Clc1ccc(Cn2cccc(C(=O)Nc3nccs3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H21	compound treatment	1.073	0.00698	0.09	1.31	0.00678	0.09	0.1319	1.0	1907938	Bionet1_000239	Clc1ccc(cc1)c2nc(nc(Sc3ccccc3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	H22	compound treatment	1.007	-0.059	-0.8	1.309	0.00578	0.08	-0.5073	-0.634	1679759	Bionet1_000240	Clc1ccc(Cn2cccc(C(=O)Nc3cccnc3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I03	compound treatment	1.069	0.00298	0.04	1.349	0.0458	0.62	0.4698	0.7511	1907939	Bionet1_000241	COc1ccccc1N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I04	compound treatment	1.053	-0.013	-0.18	1.316	0.0128	0.17	-0.001	-0.0041	1180025	Bionet1_000242	C1CN(CCN1C(c2ccccc2)c3ccccc3)c4cnc5ccccc5n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I05	compound treatment	1.084	0.018	0.24	1.312	0.00878	0.12	0.2561	0.947	1907940	Bionet1_000243	COc1ccc(N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I06	compound treatment	1.093	0.027	0.36	1.308	0.00478	0.07	0.3034	0.8206	1708400	Bionet1_000244	Nc1c(cnc2nc(nn12)N3CCN(CC3)c4ccccc4)c5ccc(F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I07	compound treatment	1.061	-0.00502	-0.07	1.263	-0.0402	-0.55	-0.4357	-0.7885	1907941	Bionet1_000245	Cc1ccc(N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I08	compound treatment	1.089	0.023	0.31	1.303	-2.23E-4	0.0	0.217	0.7002	1472356	Bionet1_000246	Cc1nc2oc3ccc(F)cc3c(=O)c2cc1C(=O)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I09	compound treatment	1.055	-0.011	-0.15	1.332	0.0288	0.39	0.1723	0.4107	1907942	Bionet1_000247	Fc1cccc(Cl)c1c2noc(/C=C/Nc3ccc(Cl)cc3)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I10	compound treatment	1.055	-0.011	-0.15	1.321	0.0178	0.24	0.0663	0.233	1558634	Bionet1_000248	Cc1nc2oc3ccc(F)cc3c(=O)c2cc1C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I11	compound treatment	1.108	0.042	0.57	1.319	0.0158	0.22	0.5526	0.9121	1907943	Bionet1_000249	COc1cccc(N/C=C/c2onc(c2C#N)c3c(F)cccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I12	compound treatment	1.019	-0.047	-0.63	1.321	0.0178	0.24	-0.2771	-0.4081	1233178	Bionet1_000250	Cc1nc2oc3ccc(F)cc3c(=O)c2cc1C(=O)NCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I13	compound treatment	1.089	0.023	0.31	1.326	0.0228	0.31	0.4388	1.0	1907944	Bionet1_000251	COC(=O)c1c(/C=C/Nc2ccccc2)onc1c3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I14	compound treatment	1.075	0.00898	0.12	1.311	0.00778	0.11	0.1606	0.9978	1907945	Bionet1_000252	FC(F)(F)c1cccc(CS(=O)(=O)c2cnc3ccccc3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I15	compound treatment	1.075	0.00898	0.12	1.326	0.0228	0.31	0.3053	0.9157	1907946	Bionet1_000253	CNC1=C(CC(=C(N1C)N2CCN(CC2)S(=O)(=O)C)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I16	compound treatment	1.093	0.027	0.36	1.339	0.0358	0.49	0.6023	0.9896	1119661	Bionet1_000254	CC(Oc1ccc(Cl)cc1)c2ccnn2S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I17	compound treatment	1.077	0.011	0.15	1.312	0.00878	0.12	0.1894	0.9944	1907947	Bionet1_000255	CN(C)S(=O)(=O)c1ccc(N/C=C/2\C(=O)NN=C2C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I18	compound treatment	1.081	0.015	0.2	1.227	-0.0762	-1.04	-0.5921	-0.5592	1651727	Bionet1_000256	Cc1nc2oc3ccc(Cl)cc3c(=O)c2cc1C(=O)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I19	compound treatment	1.058	-0.00802	-0.11	1.344	0.0408	0.56	0.3167	0.559	1907948	Bionet1_000257	CN(C)S(=O)(=O)c1ccc(N/C=C/2\C(=O)N(C)N=C2C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I20	compound treatment	1.102	0.036	0.49	1.408	0.105	1.43	1.3535	0.897	1218761	Bionet1_000258	Cc1nc2oc3ccc(Cl)cc3c(=O)c2cc1C(=O)NCc4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I21	compound treatment	1.069	0.00298	0.04	1.402	0.0988	1.35	0.9809	0.7279	1907949	Bionet1_000259	CN(C)S(=O)(=O)c1ccc(N/C=C/2\C(=O)NN=C2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	I22	compound treatment	1.089	0.023	0.31	1.372	0.0688	0.94	0.8824	0.8933	1347908	Bionet1_000260	Cc1nc2oc3ccc(Cl)cc3c(=O)c2cc1C(=O)Nc4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J03	compound treatment	1.082	0.016	0.22	1.328	0.0248	0.34	0.3913	0.9764	1907950	Bionet1_000261	COc1ccc(cc1)c2nc(nc(N3CCOCC3)c2C#N)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J04	compound treatment	1.055	-0.011	-0.15	1.294	-0.00922	-0.13	-0.1941	-0.9965	1371363	Bionet1_000262	Clc1ccc(Cn2cccc(C(=O)Nc3nncs3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J05	compound treatment	1.064	-0.00202	-0.03	1.31	0.00678	0.09	0.0461	0.478	1405736	Bionet1_000263	COc1ccc(cc1)c2nc(nc(N3CCN(C)CC3)c2C#N)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J06	compound treatment	1.038	-0.028	-0.38	1.249	-0.0542	-0.74	-0.7901	-0.9515	1641405	Bionet1_000264	Clc1ccc(Cn2cccc(C(=O)Nc3ccccn3)c2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J07	compound treatment	1.091	0.025	0.34	1.332	0.0288	0.39	0.5158	0.9971	1176722	Bionet1_000265	COc1ccc(cc1)c2nc(nc(N3CCOCC3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J08	compound treatment	1.063	-0.00302	-0.04	1.278	-0.0252	-0.34	-0.272	-0.7854	1738446	Bionet1_000266	CN(C)CCNC(=O)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J09	compound treatment	1.07	0.00398	0.05	1.281	-0.0222	-0.3	-0.1763	-0.573	1276454	Bionet1_000267	COc1ccc(cc1)c2nc(nc(N3CCN(C)CC3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J10	compound treatment	1.028	-0.038	-0.51	1.233	-0.0702	-0.96	-1.0398	-0.9572	1907951	Bionet1_000268	COc1ccc2cc(NC(=O)c3cccc(c3)C(F)(F)F)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J11	compound treatment	1.073	0.00698	0.09	1.31	0.00678	0.09	0.1319	1.0	1608299	Bionet1_000269	CCN(CC)c1nc(nc(c1C#N)c2ccc(OC)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J12	compound treatment	1.045	-0.021	-0.28	1.222	-0.0812	-1.11	-0.9837	-0.8604	1599052	Bionet1_000270	CN(C)CCNC(=O)c1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J13	compound treatment	1.083	0.017	0.23	1.28	-0.0232	-0.32	-0.062	-0.1585	1907952	Bionet1_000271	COc1ccc(cc1)c2nc(nc(Sc3ccccc3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J14	compound treatment	1.087	0.021	0.28	1.265	-0.0382	-0.52	-0.1684	-0.284	1286465	Bionet1_000272	Clc1cccc(Cn2cccc(C(=O)NCc3ccccc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J15	compound treatment	1.056	-0.01	-0.14	1.259	-0.0442	-0.6	-0.522	-0.8447	1907953	Bionet1_000273	Clc1ccc(cc1)C(=O)O/N=C/c2c(nc3sccn23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J16	compound treatment	1.06	-0.00602	-0.08	1.199	-0.104	-1.42	-1.0624	-0.7463	1432531	Bionet1_000274	CCN(CC)C(=O)c1cc(Cl)c(=O)n(Cc2ccc(Cl)c(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J17	compound treatment	1.085	0.019	0.26	1.303	-2.23E-4	0.0	0.1789	0.6987	1529897	Bionet1_000275	CCOC(=O)c1cc(NC(=O)c2ccc(Cl)cc2)c(=O)oc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J18	compound treatment	1.001	-0.065	-0.88	1.286	-0.0172	-0.23	-0.7863	-0.8659	1628795	Bionet1_000276	Clc1ccc(Cn2cc(cc(Cl)c2=O)C(=O)NCC=C)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J19	compound treatment	1.094	0.028	0.38	1.343	0.0398	0.54	0.6504	0.9843	1907954	Bionet1_000277	CN(C)/C=C/c1oc(=O)c(NC(=O)c2ccc(Cl)cc2)cc1C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J20	compound treatment	1.038	-0.028	-0.38	1.269	-0.0342	-0.47	-0.5973	-0.9945	1907955	Bionet1_000278	[O-][N+](=O)c1cc(cn(Cc2c(Cl)cccc2Cl)c1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J21	compound treatment	1.086	0.02	0.27	1.39	0.0868	1.18	1.0273	0.8465	1473981	Bionet1_000279	CCOC(=O)c1cc(NC(=O)c2ccc(OC)cc2)c(=O)oc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	J22	compound treatment	1.011	-0.055	-0.74	1.271	-0.0322	-0.44	-0.8356	-0.9687	1664412	Bionet1_000280	Clc1cccc(Cl)c1Cn2cc(cc(Cl)c2=O)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K03	compound treatment	1.085	0.019	0.26	1.296	-0.00722	-0.1	0.1114	0.4061	1907956	Bionet1_000281	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(cc2)C(=O)OC)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K04	compound treatment	1.07	0.00398	0.05	1.326	0.0228	0.31	0.2576	0.8172	1624222	Bionet1_000282	Cc1nc2oc3ccc(Cl)cc3c(=O)c2cc1C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K05	compound treatment	1.069	0.00298	0.04	1.307	0.00378	0.05	0.0648	0.9924	1907957	Bionet1_000283	CCOC/1=NN(C(=O)\C1=C/Nc2cc(Cl)cc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K06	compound treatment	1.062	-0.00402	-0.05	1.346	0.0428	0.58	0.3741	0.6386	1907958	Bionet1_000284	CO/N=C/c1c(Sc2cccc(c2)C(F)(F)F)nc3sccn13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K07	compound treatment	1.063	-0.00302	-0.04	1.302	-0.00122	-0.02	-0.0406	-0.9221	1907959	Bionet1_000285	CCOC/1=NN(C(=O)\C1=C/NCc2ccc(Cl)cc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K08	compound treatment	1.101	0.035	0.47	1.311	0.00778	0.11	0.4087	0.845	1907960	Bionet1_000286	Clc1nc2sccn2c1/C=N/OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K09	compound treatment	1.087	0.021	0.28	1.275	-0.0282	-0.38	-0.072	-0.1508	1907961	Bionet1_000287	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(C)c(C)c2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K10	compound treatment	1.091	0.025	0.34	1.331	0.0278	0.38	0.5061	0.9983	1907962	Bionet1_000288	COc1ccc(N/N=C(/C#N)\S(=O)(=O)c2nsc(C)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K11	compound treatment	1.085	0.019	0.26	1.339	0.0358	0.49	0.526	0.9547	1907963	Bionet1_000289	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K12	compound treatment	1.09	0.024	0.32	1.274	-0.0292	-0.4	-0.053	-0.1033	1907964	Bionet1_000290	Cc1snc(c1C#N)S(=O)(=O)/C(=N/Nc2cccc(c2)C(F)(F)F)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K13	compound treatment	1.064	-0.00202	-0.03	1.328	0.0248	0.34	0.2196	0.6479	1907965	Bionet1_000291	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(C)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K14	compound treatment	1.115	0.049	0.66	1.355	0.0518	0.71	0.9665	0.9995	1907966	Bionet1_000292	Cc1snc(c1C#N)S(=O)(=O)/C(=N/Nc2ccc(cc2)C(F)(F)F)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K15	compound treatment	1.071	0.00498	0.07	1.29	-0.0132	-0.18	-0.08	-0.4158	1907967	Bionet1_000293	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(OC)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K16	compound treatment	1.093	0.027	0.36	1.319	0.0158	0.22	0.4095	0.9685	1907968	Bionet1_000294	CN(C)C(=C(C#N)C#N)N1CCN(CC1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K17	compound treatment	1.05	-0.016	-0.22	1.343	0.0398	0.54	0.2307	0.3951	1907969	Bionet1_000295	CCOC/1=NN(C(=O)\C1=C/NN2CCOCC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K18	compound treatment	1.068	0.00198	0.03	1.33	0.0268	0.37	0.2771	0.7568	1907970	Bionet1_000296	Clc1nc2sccn2c1/C=N/OCc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K19	compound treatment	1.068	0.00198	0.03	1.349	0.0458	0.62	0.4603	0.7367	1907971	Bionet1_000297	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(F)cc2F)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K20	compound treatment	1.07	0.00398	0.05	1.359	0.0558	0.76	0.5758	0.7551	1907972	Bionet1_000298	Clc1nc2sccn2c1/C=N/OCc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K21	compound treatment	1.085	0.019	0.26	1.338	0.0348	0.47	0.5164	0.9581	1907973	Bionet1_000299	CCOC/1=NN(C(=O)\C1=C/NCc2cccnc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	K22	compound treatment	1.103	0.037	0.5	1.364	0.0608	0.83	0.9388	0.9705	1907974	Bionet1_000300	Cc1snc(c1C#N)S(=O)(=O)/C(=N\Nc2ccc(Cl)cc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L03	compound treatment	1.094	0.028	0.38	1.24	-0.0632	-0.86	-0.3427	-0.3642	1684368	Bionet1_000301	COc1ccc(cc1)C(=O)Nc2cc(C(=O)c3ccccc3)c(C)oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L04	compound treatment	1.048	-0.018	-0.24	1.264	-0.0392	-0.53	-0.5501	-0.9363	1631680	Bionet1_000302	CCN(CC)C(=O)c1cc(Cl)c(=O)n(Cc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L05	compound treatment	1.091	0.025	0.34	1.236	-0.0672	-0.92	-0.4099	-0.4197	1187135	Bionet1_000303	Cc1oc(=O)c(NC(=O)c2ccc(Cl)cc2)cc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L06	compound treatment	1.055	-0.011	-0.15	1.272	-0.0312	-0.43	-0.4062	-0.9007	1907975	Bionet1_000304	FC(F)(F)c1cccc(Cn2cc(cc(Cl)c2=O)C(=O)NCC=C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L07	compound treatment	1.078	0.012	0.16	1.237	-0.0662	-0.9	-0.5243	-0.5715	1907976	Bionet1_000305	COc1ccc(cc1)C(=O)Nc2cc(C(=O)C)c(/C=C/N(C)C)oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L08	compound treatment	1.024	-0.042	-0.57	1.232	-0.0712	-0.97	-1.0876	-0.9671	1907977	Bionet1_000306	COC(=O)c1ccc(Cn2cc(cc([N+](=O)[O-])c2=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L09	compound treatment	1.093	0.027	0.36	1.296	-0.00722	-0.1	0.1877	0.4978	1907978	Bionet1_000307	FC(F)(F)c1cccc(c1)C(=O)Nc2cc3C(=O)CCCc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L10	compound treatment	1.078	0.012	0.16	1.284	-0.0192	-0.26	-0.0711	-0.2309	1907979	Bionet1_000308	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L11	compound treatment	1.065	-0.00102	-0.01	1.264	-0.0392	-0.53	-0.3879	-0.7251	1907980	Bionet1_000309	COc1ccc(Sc2cc(nc(n2)c3ccccn3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L12	compound treatment	1.02	-0.046	-0.62	1.296	-0.00722	-0.1	-0.5087	-0.8092	1907981	Bionet1_000310	CC(C)(C)NC(=O)c1ccc(Cn2cc(ccc2=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L13	compound treatment	1.047	-0.019	-0.26	1.344	0.0408	0.56	0.2117	0.3457	1907982	Bionet1_000311	FC(F)(F)c1cc(Sc2ccc(Cl)cc2)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L14	compound treatment	1.052	-0.014	-0.19	1.243	-0.0602	-0.82	-0.7145	-0.8478	1907983	Bionet1_000312	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCc3ccncc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L15	compound treatment	1.032	-0.034	-0.46	1.25	-0.0532	-0.73	-0.8377	-0.9756	1907984	Bionet1_000313	FC(F)(F)c1cccc(Oc2cc(nc(n2)c3ccccn3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L16	compound treatment	1.036	-0.03	-0.41	1.271	-0.0322	-0.44	-0.5971	-0.9992	1907985	Bionet1_000314	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCC3CC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L17	compound treatment	1.095	0.029	0.39	1.304	7.77E-4	0.01	0.2839	0.726	1907986	Bionet1_000315	FC(F)(F)c1cc(Oc2ccc(Cl)cc2)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L18	compound treatment	0.987	-0.079	-1.07	1.272	-0.0312	-0.43	-1.0549	-0.9189	1907987	Bionet1_000316	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCc3cccnc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L19	compound treatment	1.088	0.022	0.3	1.289	-0.0142	-0.19	0.0725	0.2047	1907988	Bionet1_000317	COC(=O)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)c(=O)oc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L20	compound treatment	1.039	-0.027	-0.36	1.236	-0.0672	-0.92	-0.906	-0.9184	1907989	Bionet1_000318	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCc3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L21	compound treatment	1.071	0.00498	0.07	1.242	-0.0612	-0.83	-0.5428	-0.6481	1907990	Bionet1_000319	CN(C)/C=C/c1oc(=O)c(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	L22	compound treatment	1.018	-0.048	-0.65	1.265	-0.0382	-0.52	-0.8267	-0.9942	1907991	Bionet1_000320	Cc1cccc(NC(=O)c2ccc(Cn3cc(ccc3=O)C(F)(F)F)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M03	compound treatment	1.087	0.021	0.28	1.346	0.0428	0.58	0.6126	0.9448	1907992	Bionet1_000321	CCOC/1=NN(C(=O)\C1=C/NCc2cccs2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M04	compound treatment	1.081	0.015	0.2	1.319	0.0158	0.22	0.295	0.9995	1907993	Bionet1_000322	CO/N=C/c1ccc(Sc2cccc(c2)C(F)(F)F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M05	compound treatment	1.092	0.026	0.35	1.313	0.00978	0.13	0.3421	0.9123	1907994	Bionet1_000323	CCOC/1=NN(C(=O)\C1=C/NCc2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M06	compound treatment	1.116	0.05	0.67	1.29	-0.0132	-0.18	0.3493	0.5004	1907995	Bionet1_000324	CO/N=C/c1ccc(SCc2cccc(c2)C(F)(F)F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M07	compound treatment	1.073	0.00698	0.09	1.279	-0.0242	-0.33	-0.167	-0.4862	1907996	Bionet1_000325	CCOC/1=NN(C(=O)\C1=C/Nc2ccc(O)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M08	compound treatment	1.092	0.026	0.35	1.305	0.00178	0.02	0.265	0.7542	1907997	Bionet1_000326	O/N=C/c1ccc(SCc2cccc(c2)C(F)(F)F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M09	compound treatment	1.098	0.032	0.43	1.277	-0.0262	-0.36	0.0522	0.0932	1907998	Bionet1_000327	CCSC(SCC)C(=O)NNC(=S)Nc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M10	compound treatment	1.076	0.00998	0.13	1.303	-2.23E-4	0.0	0.093	0.691	1907999	Bionet1_000328	CC(C)Sc1ccc(/C=N/OCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M11	compound treatment	1.091	0.025	0.34	1.319	0.0158	0.22	0.3904	0.9765	1908000	Bionet1_000329	CCSC(SCC)C(=O)NNC(=S)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M12	compound treatment	1.078	0.012	0.16	1.418	0.115	1.57	1.221	0.776	1908001	Bionet1_000330	Clc1nc2sccn2c1/C=N/c3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M13	compound treatment	1.099	0.033	0.44	1.36	0.0568	0.77	0.8621	0.9654	1908002	Bionet1_000331	CN(C)c1nn(cc1c2ccc(Oc3ccccc3)cc2)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M14	compound treatment	1.089	0.023	0.31	1.326	0.0228	0.31	0.4388	1.0	1908003	Bionet1_000332	CS/C(=N/C=[N+](C)C)/Nc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M15	compound treatment	1.137	0.071	0.96	1.279	-0.0242	-0.33	0.4435	0.4379	1281020	Bionet1_000333	CN(C)c1nn(cc1c2ccc(Oc3ccccc3)cc2)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M16	compound treatment	1.011	-0.055	-0.74	1.279	-0.0242	-0.33	-0.7584	-0.9335	1908004	Bionet1_000334	CS/C(=N/C=[N+](C)C)/Nc1ccccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M17	compound treatment	1.056	-0.01	-0.14	1.318	0.0148	0.2	0.0469	0.1932	1908005	Bionet1_000335	COC(=O)c1ccc(N/C=C\2/CCN(C2=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M18	compound treatment	1.118	0.052	0.7	1.351	0.0478	0.65	0.9565	0.9993	1651846	Bionet1_000336	CN(C)S(=O)(=O)c1ccc(NCc2n[nH]c(=O)c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M19	compound treatment	1.089	0.023	0.31	1.3	-0.00322	-0.04	0.1881	0.6009	1908006	Bionet1_000337	CN(C)/C=C/c1snc(SCc2c(Cl)cccc2Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M20	compound treatment	1.083	0.017	0.23	1.351	0.0478	0.65	0.6226	0.9016	1908007	Bionet1_000338	Clc1ccc(cc1)N2CCN(Cc3n[nH]c(=O)c4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M21	compound treatment	1.093	0.027	0.36	1.364	0.0608	0.83	0.8434	0.9317	1908008	Bionet1_000339	CN(C)/C=C/c1snc(SCc2ccc(Cl)cc2Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	M22	compound treatment	1.104	0.038	0.51	1.338	0.0348	0.47	0.6976	0.9993	1908009	Bionet1_000340	Clc1ccc(CONCc2n[nH]c(=O)c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N03	compound treatment	1.037	-0.029	-0.39	1.25	-0.0532	-0.73	-0.79	-0.958	1908010	Bionet1_000341	CCOC(=O)C(C)Sc1cc(nc(n1)c2ccccn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N04	compound treatment	1.027	-0.039	-0.53	1.211	-0.0922	-1.26	-1.2615	-0.9253	1908011	Bionet1_000342	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)NCc3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N05	compound treatment	1.072	0.00598	0.08	1.247	-0.0562	-0.77	-0.4851	-0.6293	1908012	Bionet1_000343	COC(=O)c1ccccc1Oc2cc(nc(n2)c3ccccn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N06	compound treatment	1.057	-0.00902	-0.12	1.27	-0.0332	-0.45	-0.4064	-0.8664	1908013	Bionet1_000344	FC(F)(F)c1cc(c2ccc(nc2n1)N3CCOCC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N07	compound treatment	1.079	0.013	0.18	1.224	-0.0792	-1.08	-0.6401	-0.5849	1908014	Bionet1_000345	FC(F)(F)c1cc(Oc2ccccc2Cl)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N08	compound treatment	1.039	-0.027	-0.36	1.253	-0.0502	-0.68	-0.742	-0.9564	1908015	Bionet1_000346	Cc1cc(C)n(n1)c2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N09	compound treatment	1.118	0.052	0.7	1.306	0.00278	0.04	0.5226	0.7442	1908016	Bionet1_000347	FC(F)(F)c1cc(NCc2ccccc2C(F)(F)F)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N10	compound treatment	1.024	-0.042	-0.57	1.285	-0.0182	-0.25	-0.5766	-0.9315	1908017	Bionet1_000348	FC(F)(F)c1cc(c2ccc(Nc3ccccc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N11	compound treatment	1.046	-0.02	-0.27	1.286	-0.0172	-0.23	-0.3571	-0.9976	1908018	Bionet1_000349	FC(F)(F)c1cc(NCc2ccccc2Cl)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N12	compound treatment	1.039	-0.027	-0.36	1.223	-0.0802	-1.09	-1.0313	-0.8944	1908019	Bionet1_000350	COc1ccc(Nc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N13	compound treatment	1.05	-0.016	-0.22	1.253	-0.0502	-0.68	-0.6371	-0.8871	1908020	Bionet1_000351	Cn1nc(c(/C=N/OCc2c(Cl)cccc2Cl)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N14	compound treatment	1.055	-0.011	-0.15	1.267	-0.0362	-0.49	-0.4544	-0.8809	1908021	Bionet1_000352	FC(F)(F)c1cc(c2ccc(Nc3ccc(Cl)cc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N15	compound treatment	1.096	0.03	0.4	1.295	-0.00822	-0.11	0.2067	0.4925	1908022	Bionet1_000353	Cn1nc(c(/C=N/OCc2ccc(Cl)c(Cl)c2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N16	compound treatment	0.993	-0.073	-0.99	1.264	-0.0392	-0.53	-1.0748	-0.9588	1908023	Bionet1_000354	FC(F)(F)c1cc(c2ccc(Oc3ccc(Cl)cc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N17	compound treatment	1.122	0.056	0.76	1.322	0.0188	0.26	0.7151	0.8967	1908024	Bionet1_000355	Cn1nc(c(/C=N/OCc2ccc(cc2)[N+](=O)[O-])c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N18	compound treatment	1.06	-0.00602	-0.08	1.27	-0.0332	-0.45	-0.3778	-0.8208	1908025	Bionet1_000356	FC(F)(F)c1cc(c2ccc(Nc3ccc(C#N)cc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N19	compound treatment	1.047	-0.019	-0.26	1.259	-0.0442	-0.6	-0.6079	-0.9275	1908026	Bionet1_000357	Cn1nc(c(/C=N/OC(=O)c2ccc(Cl)cc2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N20	compound treatment	0.998	-0.068	-0.92	1.259	-0.0442	-0.6	-1.0753	-0.9793	1908027	Bionet1_000358	CC(=O)c1ccccc1Nc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N21	compound treatment	1.086	0.02	0.27	1.281	-0.0222	-0.3	-0.0237	-0.0584	1908028	Bionet1_000359	Cn1nc(c(/C=N/OC(=O)c2cccc(c2)C(F)(F)F)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	N22	compound treatment	0.978	-0.088	-1.19	1.231	-0.0722	-0.98	-1.5361	-0.9957	1908029	Bionet1_000360	FC(F)(F)c1cc(c2ccc(Sc3ccccc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O03	compound treatment	1.104	0.038	0.51	1.278	-0.0252	-0.34	0.1191	0.193	1908030	Bionet1_000361	CN(C)/C=C/c1snc(SCc2c(F)cccc2Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O04	compound treatment	1.093	0.027	0.36	1.33	0.0268	0.37	0.5156	1.0	1908031	Bionet1_000362	COC(=O)c1sccc1c2ccc(/C=N/OC(=O)c3ccccc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O05	compound treatment	1.086	0.02	0.27	1.265	-0.0382	-0.52	-0.178	-0.3033	1908032	Bionet1_000363	Cc1nc(CSc2nsc(/C=C/Nc3ccccc3)c2C#N)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O06	compound treatment	1.047	-0.019	-0.26	1.311	0.00778	0.11	-0.1065	-0.3834	1908033	Bionet1_000364	CCOC(=O)C(=Cc1ccc(o1)c2ccsc2C(=O)OC)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O07	compound treatment	1.088	0.022	0.3	1.247	-0.0562	-0.77	-0.3325	-0.4045	1908034	Bionet1_000365	Cc1cc(C)c(C(=O)N)c(NC(=O)Nc2cccc(c2)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O08	compound treatment	1.087	0.021	0.28	1.31	0.00678	0.09	0.2655	0.8917	1709704	Bionet1_000366	COC(=O)c1sccc1c2ccc(o2)C(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O09	compound treatment	1.138	0.072	0.97	1.34	0.0368	0.5	1.0412	0.9527	1908035	Bionet1_000367	Cc1cc(C)c(C(=O)N)c(NC(=O)Nc2ccc(OC(F)(F)F)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O10	compound treatment	1.049	-0.017	-0.23	1.315	0.0118	0.16	-0.0488	-0.1742	1908036	Bionet1_000368	COC(=O)c1sccc1c2ccc(COC(=O)NC3CCCCC3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O11	compound treatment	1.095	0.029	0.39	1.315	0.0118	0.16	0.39	0.9228	1742999	Bionet1_000369	Clc1ccc(cc1)n2nc(C(=O)NCc3ccccc3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O12	compound treatment	1.111	0.045	0.61	1.337	0.0338	0.46	0.7548	0.9908	1908037	Bionet1_000370	COC(=O)c1sccc1c2ccc(COC(=O)c3ccc(Cl)cc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O13	compound treatment	1.084	0.018	0.24	1.249	-0.0542	-0.74	-0.3513	-0.4515	1162954	Bionet1_000371	Clc1ccc(cc1)n2nc(C(=O)N3CCCC3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O14	compound treatment	1.049	-0.017	-0.23	1.314	0.0108	0.15	-0.0585	-0.2144	1908038	Bionet1_000372	COC(=O)c1sccc1c2ccc(COC(=O)Nc3ccccc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O15	compound treatment	1.105	0.039	0.53	1.272	-0.0312	-0.43	0.0708	0.1046	1908039	Bionet1_000373	Cn1nc(Cl)c(Cl)c1Oc2ccc(cc2)S(=O)(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O16	compound treatment	1.059	-0.00702	-0.09	1.286	-0.0172	-0.23	-0.2331	-0.9203	1908040	Bionet1_000374	COC(=O)c1sccc1c2ccc(COC(=O)c3ccc(OC)cc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O17	compound treatment	1.121	0.055	0.74	1.299	-0.00422	-0.06	0.4837	0.6503	1427131	Bionet1_000375	Fc1ccc(cc1)n2nc(C(=O)Nc3ccccc3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O18	compound treatment	1.053	-0.013	-0.18	1.389	0.0858	1.17	0.7029	0.5942	1570750	Bionet1_000376	COC(=O)c1sc(nc1N)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O19	compound treatment	1.1	0.034	0.46	1.249	-0.0542	-0.74	-0.1987	-0.2284	1293220	Bionet1_000377	Fc1ccc(cc1)n2nc(C(=O)Oc3ccccc3)c4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O20	compound treatment	1.066	-2.19E-5	0.0	1.325	0.0218	0.3	0.2098	0.7064	1201188	Bionet1_000378	O=C(c1cc(c(s1)N2CCOCC2)c3ccccn3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O21	compound treatment	1.099	0.033	0.44	1.33	0.0268	0.37	0.5728	0.9952	1356705	Bionet1_000379	Clc1ccc(NC(=O)c2nn(c3ccccc3)c(=O)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	O22	compound treatment	1.12	0.054	0.73	1.332	0.0288	0.39	0.7924	0.9579	1171077	Bionet1_000380	CN(C)c1sc(cc1c2ccc(Oc3ccccc3)cc2)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P03	compound treatment	1.075	0.00898	0.12	1.287	-0.0162	-0.22	-0.0708	-0.2806	1125455	Bionet1_000381	Cc1oc(=O)c(NC(=O)c2cccc(Cl)c2)cc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P04	compound treatment	1.081	0.015	0.2	1.234	-0.0692	-0.94	-0.5246	-0.5434	1908041	Bionet1_000382	FC(F)(F)c1cc(c2ccc(Oc3ccccc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P05	compound treatment	1.076	0.00998	0.13	1.27	-0.0332	-0.45	-0.2252	-0.4764	1420981	Bionet1_000383	CCOC(=O)c1cc(NC(=O)c2cccc(Cl)c2)c(=O)oc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P06	compound treatment	1.018	-0.048	-0.65	1.345	0.0418	0.57	-0.0553	-0.0641	1908042	Bionet1_000384	COCCCNc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P07	compound treatment	1.086	0.02	0.27	1.242	-0.0612	-0.83	-0.3998	-0.4557	1230065	Bionet1_000385	CCOC(=O)c1cc(NC(=O)c2ccc(C)cc2)c(=O)oc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P08	compound treatment	1.083	0.017	0.23	1.215	-0.0882	-1.2	-0.6887	-0.5624	1908043	Bionet1_000386	FC(F)(F)c1cc(c2ccc(SCc3ccccc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P09	compound treatment	0.961	-0.105	-1.42	1.151	-0.152	-2.08	-2.4696	-0.9827	1183648	Bionet1_000387	CN1CCN(CC1)C(=O)c2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P10	compound treatment	0.208	-0.858	-11.58	0.393	-0.91	-12.41	-16.9617	-0.9994	1908044	Bionet1_000388	COc1ccc(Oc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P11	compound treatment	1.071	0.00498	0.07	1.288	-0.0152	-0.21	-0.0993	-0.4551	1644688	Bionet1_000389	Clc1ccc(Cn2cc(ccc2=O)C(=O)Nc3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P12	compound treatment	1.04	-0.026	-0.35	1.174	-0.129	-1.76	-1.4942	-0.8316	1908045	Bionet1_000390	Fc1ccc(Oc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P13	compound treatment	1.073	0.00698	0.09	1.3	-0.00322	-0.04	0.0355	0.3416	1460766	Bionet1_000391	Clc1ccc(Cn2cc(ccc2=O)C(=O)NCc3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P14	compound treatment	1.019	-0.047	-0.63	1.249	-0.0542	-0.74	-0.9714	-0.9971	1908046	Bionet1_000392	Oc1ccc(Oc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P15	compound treatment	1.089	0.023	0.31	1.314	0.0108	0.15	0.3231	0.9419	1291088	Bionet1_000393	Fc1ccc(NC(=O)c2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P16	compound treatment	0.997	-0.069	-0.93	1.28	-0.0232	-0.32	-0.8823	-0.8971	1908047	Bionet1_000394	FC(F)(F)c1cc(c2ccc(nc2n1)N3CCNCC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P17	compound treatment	1.072	0.00598	0.08	1.266	-0.0372	-0.51	-0.3019	-0.5874	1124809	Bionet1_000395	Clc1ccc(Cn2cc(ccc2=O)C(=O)Nc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P18	compound treatment	1.015	-0.051	-0.69	1.287	-0.0162	-0.22	-0.6431	-0.8896	1908048	Bionet1_000396	NC(=O)C1CCN(CC1)c2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P19	compound treatment	1.11	0.044	0.59	1.269	-0.0342	-0.47	0.0895	0.1186	1147341	Bionet1_000397	Fc1ccc(NC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P20	compound treatment	1.009	-0.057	-0.77	1.281	-0.0222	-0.3	-0.7582	-0.9171	1908049	Bionet1_000398	FC(F)(F)c1cnc(Oc2ccc(cc2)n3cc4ccsc4c3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P21	compound treatment	1.031	-0.035	-0.47	1.32	0.0168	0.23	-0.1723	-0.3282	1728690	Bionet1_000399	CN(C(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1234	P22	compound treatment	1.084	0.018	0.24	1.287	-0.0162	-0.22	0.0151	0.0459	1908050	Bionet1_000400	O=C(Nc1ccccc1)Nn2c(nnc2c3ccccn3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A03	compound treatment	1.222	-0.00239	-0.03	1.325	-0.0195	-0.27	-0.2104	-0.7871	1910474	Bionet1_003921	Cn1nc(c2cc(sc12)C(=O)Nc3cccc(c3)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A04	compound treatment	1.264	0.0396	0.53	1.374	0.0295	0.4	0.6628	0.9903	1910475	Bionet1_003922	COc1ccc(/N=C/2\C(=O)N(Cc3ccccc3Cl)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A05	compound treatment	1.188	-0.0364	-0.49	1.365	0.0205	0.28	-0.149	-0.2637	1910476	Bionet1_003923	Cn1nc(c2cc(sc12)C(=O)Nc3ccc(Cl)cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A06	compound treatment	1.196	-0.0284	-0.38	1.353	0.00854	0.12	-0.1884	-0.4707	1237657	Bionet1_003924	COCc1cc(nc(n1)S(=O)Cc2ccc(Cl)cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A07	compound treatment	1.181	-0.0434	-0.59	1.331	-0.0135	-0.18	-0.5436	-0.8863	1910477	Bionet1_003925	Cc1cc(C)cc(/N=C\2/C(=O)N(Cc3ccccc3Cl)c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A08	compound treatment	1.226	0.00161	0.02	1.391	0.0465	0.63	0.4642	0.7309	1910478	Bionet1_003926	CC(C)(C)C1COc2ccccc2N1C(=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A09	compound treatment	1.207	-0.0174	-0.23	1.314	-0.0305	-0.42	-0.4595	-0.9634	1910479	Bionet1_003927	Fc1ccc(/N=C\2/C(=O)N(Cc3ccccc3Cl)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A10	compound treatment	1.261	0.0366	0.49	1.331	-0.0135	-0.18	0.2195	0.4166	1279535	Bionet1_003928	OCc1cnc(S(=O)Cc2ccc(Cl)cc2)n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A11	compound treatment	1.237	0.0126	0.17	1.307	-0.0375	-0.51	-0.2408	-0.4473	1910480	Bionet1_003929	Cn1nc(c2cc(CSc3c(Cl)cccc3Cl)sc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A12	compound treatment	1.278	0.0536	0.72	1.364	0.0195	0.27	0.6999	0.908	1910481	Bionet1_003930	FC(F)(F)c1cccc(CSCC(=O)c2cc(no2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A13	compound treatment	1.2	-0.0244	-0.33	1.364	0.0195	0.27	-0.0442	-0.1044	1910482	Bionet1_003931	Cn1nc(c2cc(COc3ccc(Cl)cc3Cl)sc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A14	compound treatment	1.237	0.0126	0.17	1.387	0.0425	0.58	0.5305	0.8776	1910483	Bionet1_003932	Nc1nc(SCc2ccc(Cl)cc2)c(C#N)c(n1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A15	compound treatment	1.203	-0.0214	-0.29	1.383	0.0385	0.53	0.1676	0.2796	1910484	Bionet1_003933	Clc1ccc(CN2C(=O)/C(=N/c3ccc(Cl)cc3)/c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A16	compound treatment	1.219	-0.00539	-0.07	1.391	0.0465	0.63	0.3974	0.6221	1910485	Bionet1_003934	COc1ccc(CSc2nc(N)nc(c3cccs3)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A17	compound treatment	1.257	0.0326	0.44	1.41	0.0655	0.89	0.9431	0.9467	1910486	Bionet1_003935	COc1ccc(/N=C\2/C(=O)N(Cc3ccc(Cl)cc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A18	compound treatment	1.28	0.0556	0.75	1.377	0.0325	0.44	0.8443	0.9686	1910487	Bionet1_003936	FC(F)(F)c1cccc(Cn2ccc(c(C#N)c2=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A19	compound treatment	1.221	-0.00339	-0.05	1.354	0.00954	0.13	0.0597	0.433	1910488	Bionet1_003937	Fc1ccc(/N=C\2/C(=O)N(Cc3c(Cl)cccc3Cl)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A20	compound treatment	1.256	0.0316	0.43	1.321	-0.0235	-0.32	0.0754	0.1414	1613404	Bionet1_003938	Cc1ccc(cc1)S(=O)(=O)c2c(C)cc(C)nc2Oc3cccc(C)c3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A21	compound treatment	1.257	0.0326	0.44	1.357	0.0125	0.17	0.4321	0.9153	1910489	Bionet1_003939	Cc1cccc(C)c1NC(=O)O/N=C(/COc2ccccc2[N+](=O)[O-])\C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	A22	compound treatment	1.234	0.00961	0.13	1.354	0.00954	0.13	0.1837	1.0	1296756	Bionet1_003940	OC1(CN2CCOCC2)CCN(CC1)C(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B03	compound treatment	1.25	0.0256	0.35	1.363	0.0185	0.25	0.4231	0.9882	1204177	Bionet1_003941	Cc1c(C)n(Cc2ccccc2)c(c1CNC(=O)c3cccs3)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B04	compound treatment	1.205	-0.0194	-0.26	1.345	5.42E-4	0.01	-0.1797	-0.6868	1910490	Bionet1_003942	FCCCOc1ccc(cc1)/C(=C/Nc2cccc(c2)C(F)(F)F)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B05	compound treatment	1.267	0.0426	0.57	1.342	-0.00246	-0.03	0.3828	0.6648	1910491	Bionet1_003943	Fc1ccc(CSc2nnc(o2)c3sccc3n4cccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B06	compound treatment	1.254	0.0296	0.4	1.342	-0.00246	-0.03	0.2588	0.6455	1910492	Bionet1_003944	Fc1ccc(N/C=C/C(=O)c2cccc(OCc3c(F)cccc3Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B07	compound treatment	1.237	0.0126	0.17	1.366	0.0215	0.29	0.3281	0.9663	1910493	Bionet1_003945	Clc1cccc(CSc2nnc(o2)c3sccc3n4cccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B08	compound treatment	1.243	0.0186	0.25	1.358	0.0135	0.18	0.3081	0.9886	1910494	Bionet1_003946	Cc1ccc(cc1)S(=O)(=O)n2ccc(n2)c3ccc(OCCCF)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B09	compound treatment	1.2	-0.0244	-0.33	1.352	0.00754	0.1	-0.1599	-0.4639	1150751	Bionet1_003947	Fc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(nn3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B10	compound treatment	1.225	6.14E-4	0.01	1.326	-0.0185	-0.25	-0.1721	-0.6834	1910495	Bionet1_003948	Cc1cccc(Oc2nc3cc(Cl)c(Cl)cc3nc2C(F)(F)F)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B11	compound treatment	1.219	-0.00539	-0.07	1.384	0.0395	0.54	0.3299	0.6064	1577897	Bionet1_003949	Cc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cc(C)c4cccc(C)c4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B12	compound treatment	1.184	-0.0404	-0.54	1.357	0.0125	0.17	-0.2643	-0.4629	1910496	Bionet1_003950	FC(F)(F)c1cccc(/C=N/NC(=O)CN2CCS(=O)(=O)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B13	compound treatment	1.224	-3.86E-4	-0.01	1.367	0.0225	0.31	0.2137	0.695	1468747	Bionet1_003951	Cc1cc(C)c(C#N)c(n1)N2CCN(CC2)S(=O)(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B14	compound treatment	1.218	-0.00639	-0.09	1.289	-0.0555	-0.76	-0.5957	-0.7826	1910497	Bionet1_003952	CC(C)(C)c1ccc(/C=N/NC(=O)CN2CCS(=O)(=O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B15	compound treatment	1.248	0.0236	0.32	1.323	-0.0215	-0.29	0.0184	0.0424	1426726	Bionet1_003953	Cc1cc(C)c(C#N)c(n1)N2CCN(CC2)S(=O)(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B16	compound treatment	1.231	0.00661	0.09	1.394	0.0495	0.68	0.5408	0.7936	1910498	Bionet1_003954	CN(C)/C=C/c1c(nnn1c2cc(cc(c2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B17	compound treatment	1.231	0.00661	0.09	1.331	-0.0135	-0.18	-0.0667	-0.3267	1640915	Bionet1_003955	Cc1ccc(NC(=O)N2CCC(CC2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B18	compound treatment	1.233	0.00861	0.12	1.32	-0.0245	-0.33	-0.1537	-0.4351	1910499	Bionet1_003956	[O-][N+](=O)c1cc(N/C=C/C(=O)c2ccc(OCCCF)cc2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B19	compound treatment	1.204	-0.0204	-0.28	1.372	0.0275	0.38	0.0711	0.1528	1711809	Bionet1_003957	Fc1ccc(NC(=O)N2CCC(CC2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B20	compound treatment	1.229	0.00461	0.06	1.338	-0.00646	-0.09	-0.0182	-0.1692	1910500	Bionet1_003958	FCCCOc1ccc(cc1)C(=O)/C=C/Nc2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B21	compound treatment	1.192	-0.0324	-0.44	1.404	0.0595	0.81	0.2652	0.2876	1166474	Bionet1_003959	Cc1cccc(NC(=O)N2CCC(CC2)c3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	B22	compound treatment	1.22	-0.00439	-0.06	1.36	0.0155	0.21	0.108	0.4909	1910501	Bionet1_003960	Clc1cccc(c1)C(=O)NNc2nc3ccccc3nc2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C03	compound treatment	1.249	0.0246	0.33	1.34	-0.00446	-0.06	0.1918	0.5682	1201562	Bionet1_003961	Cc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C04	compound treatment	1.278	0.0536	0.72	1.36	0.0155	0.21	0.6613	0.8774	1910502	Bionet1_003962	CCOC(=O)c1ccc(/N=C/c2ccccc2Oc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C05	compound treatment	1.248	0.0236	0.32	1.34	-0.00446	-0.06	0.1823	0.562	1424451	Bionet1_003963	Cc1ccc2OCC(N(c2c1)S(=O)(=O)c3ccc(Cl)cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C06	compound treatment	1.25	0.0256	0.35	1.354	0.00954	0.13	0.3364	0.9109	1910503	Bionet1_003964	COC(OC)c1ccnc(n1)c2ccc(OC(=O)c3cccs3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C07	compound treatment	1.246	0.0216	0.29	1.411	0.0665	0.91	0.8478	0.8895	1169169	Bionet1_003965	COc1ccc(cc1)S(=O)(=O)N2C(COc3ccc(C)cc23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C08	compound treatment	1.257	0.0326	0.44	1.387	0.0425	0.58	0.7213	0.9907	1910504	Bionet1_003966	COC(OC)c1ccnc(n1)c2ccc(OC(=O)c3ccc(F)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C09	compound treatment	1.234	0.00961	0.13	1.317	-0.0275	-0.37	-0.173	-0.4367	1910505	Bionet1_003967	Cc1ccc2OCC(N(C(=O)c3cccc(c3)C(F)(F)F)c2c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C10	compound treatment	1.191	-0.0334	-0.45	1.377	0.0325	0.44	-0.0047	-0.0074	1910506	Bionet1_003968	FCCCOc1ccc(/C=N/OCc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C11	compound treatment	1.227	0.00261	0.04	1.371	0.0265	0.36	0.2809	0.7724	1910507	Bionet1_003969	Clc1cccc(c1)C(=O)NCCOC(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C12	compound treatment	1.276	0.0516	0.7	1.36	0.0155	0.21	0.6422	0.8824	1910508	Bionet1_003970	COC(OC)c1ccnc(n1)c2ccc(OC(=O)c3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C13	compound treatment	1.294	0.0696	0.94	1.383	0.0385	0.53	1.0357	0.9624	1910509	Bionet1_003971	Brc1cccc(c1)C(=O)NCCOC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C14	compound treatment	1.265	0.0406	0.55	1.399	0.0545	0.74	0.9134	0.9887	1598935	Bionet1_003972	Clc1cccc(C(=O)c2c[nH]c(c2)C(=O)NCc3cccs3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C15	compound treatment	1.226	0.00161	0.02	1.329	-0.0155	-0.21	-0.1336	-0.6307	1910510	Bionet1_003973	Cn1nc(c(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C16	compound treatment	1.243	0.0186	0.25	1.383	0.0385	0.53	0.5492	0.9429	1910511	Bionet1_003974	CN(C)CCCNC(=O)c1cc(c[nH]1)C(=O)c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C17	compound treatment	1.189	-0.0354	-0.48	1.418	0.0735	1.0	0.3716	0.3345	1910512	Bionet1_003975	CCOC(=O)c1cnc(nc1Sc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C18	compound treatment	1.227	0.00261	0.04	1.409	0.0645	0.88	0.6473	0.7349	1217050	Bionet1_003976	Clc1cccc(Cl)c1C(=O)c2c[nH]c(c2)C(=O)NCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C19	compound treatment	1.21	-0.0144	-0.19	1.384	0.0395	0.54	0.2441	0.4259	1910513	Bionet1_003977	CCOC(=O)c1cnc(nc1Sc2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C20	compound treatment	1.227	0.00261	0.04	1.341	-0.00346	-0.05	-0.0084	-0.1427	1430862	Bionet1_003978	Clc1cccc(Cl)c1C(=O)c2c[nH]c(c2)C(=O)NC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C21	compound treatment	1.212	-0.0124	-0.17	1.371	0.0265	0.36	0.1378	0.3456	1910514	Bionet1_003979	CCOC(=O)c1cnc(nc1Sc2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	C22	compound treatment	1.266	0.0416	0.56	1.396	0.0515	0.7	0.894	0.9938	1242005	Bionet1_003980	Fc1ccc(CNC(=O)c2cc(c[nH]2)C(=O)c3cccc(Cl)c3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D03	compound treatment	1.223	-0.00139	-0.02	1.341	-0.00346	-0.05	-0.0466	-0.9179	1126842	Bionet1_003981	Clc1cccc(NC(=O)N2CCC(CC2)c3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D04	compound treatment	1.247	0.0226	0.31	1.36	0.0155	0.21	0.3656	0.9842	1910515	Bionet1_003982	FCCCOc1ccc(/C=C/C(=O)NCc2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D05	compound treatment	1.231	0.00661	0.09	1.4	0.0555	0.76	0.5987	0.785	1315490	Bionet1_003983	Clc1ccc(NC(=O)N2CCC(CC2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D06	compound treatment	1.195	-0.0294	-0.4	1.35	0.00554	0.08	-0.2269	-0.5622	1910516	Bionet1_003984	[O-][N+](=O)c1cc(NS(=O)(=O)c2cc(Cl)ccc2Cl)ccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D07	compound treatment	1.256	0.0316	0.43	1.327	-0.0175	-0.24	0.1332	0.2728	1351800	Bionet1_003985	Cc1cc(C)c(C#N)c(n1)N2CCCN(CC2)S(=O)(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D08	compound treatment	1.186	-0.0384	-0.52	1.346	0.00154	0.02	-0.3513	-0.6778	1910517	Bionet1_003986	COc1ccc(CNC(=O)/C=C/c2ccc(OCCCF)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D09	compound treatment	1.189	-0.0354	-0.48	1.393	0.0485	0.66	0.1305	0.1599	1910518	Bionet1_003987	Cc1cccc(CO/N=C/c2c(nc3ccc(Cl)cn23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D10	compound treatment	1.247	0.0226	0.31	1.342	-0.00246	-0.03	0.192	0.6257	1910519	Bionet1_003988	Cc1ccc(N/C=C/C(=O)c2cccc(OCc3c(F)cccc3Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D11	compound treatment	1.229	0.00461	0.06	1.349	0.00454	0.06	0.0878	1.0	1910520	Bionet1_003989	Fc1ccc(CO/N=C/c2c(nc3ccc(Cl)cn23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D12	compound treatment	1.231	0.00661	0.09	1.318	-0.0265	-0.36	-0.192	-0.5167	1389989	Bionet1_003990	Cc1cc(I)cn2cc(nc12)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D13	compound treatment	1.301	0.0766	1.03	1.324	-0.0205	-0.28	0.5336	0.4984	1910521	Bionet1_003991	Cc1ccn2c(/C=N/OCc3ccc(F)cc3)c(nc2c1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D14	compound treatment	1.24	0.0156	0.21	1.297	-0.0475	-0.65	-0.3087	-0.4535	1141909	Bionet1_003992	CC(C)CC(N1Cc2ccccc2C1=O)C(=O)Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D15	compound treatment	1.191	-0.0334	-0.45	1.354	0.00954	0.13	-0.2265	-0.4831	1910522	Bionet1_003993	Cc1ccn2c(/C=N/OCc3cccc(F)c3)c(nc2c1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D16	compound treatment	1.24	0.0156	0.21	1.334	-0.0105	-0.14	0.0481	0.1891	1512809	Bionet1_003994	OCC(Cc1ccccc1)NC(=O)c2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D17	compound treatment	1.269	0.0446	0.6	1.36	0.0155	0.21	0.5755	0.9018	1910523	Bionet1_003995	Sc1nnc(c2cccs2)n1/N=C/c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D18	compound treatment	1.245	0.0206	0.28	1.362	0.0175	0.24	0.3658	0.9972	1215520	Bionet1_003996	OCC(NC(=O)c1ccc(I)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D19	compound treatment	1.257	0.0326	0.44	1.417	0.0725	0.99	1.0106	0.9334	1910524	Bionet1_003997	Nn1c(SCc2c(Cl)cccc2Cl)nnc1c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D20	compound treatment	1.224	-3.86E-4	-0.01	1.334	-0.0105	-0.14	-0.1045	-0.7324	1910525	Bionet1_003998	FC(F)(F)c1cccc(c1)c2cn3cc(I)ccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D21	compound treatment	1.256	0.0316	0.43	1.362	0.0175	0.24	0.4707	0.9626	1910526	Bionet1_003999	COC(=O)c1sccc1n2cccc2C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	D22	compound treatment	1.196	-0.0284	-0.38	1.336	-0.00846	-0.12	-0.3523	-0.881	1910527	Bionet1_004000	COc1ccc(N/C=C/C(=O)c2sc(nc2C)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E03	compound treatment	1.204	-0.0204	-0.28	1.328	-0.0165	-0.22	-0.3532	-0.9949	1910528	Bionet1_004001	CCOC(=O)c1cnc(nc1Sc2cccc(C)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E04	compound treatment	1.23	0.00561	0.08	1.355	0.0105	0.14	0.1552	0.9552	1910529	Bionet1_004002	COC(OC)c1ccnc(n1)c2ccc(OC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E05	compound treatment	1.192	-0.0324	-0.44	1.33	-0.0145	-0.2	-0.4483	-0.9354	1910530	Bionet1_004003	CCOC(=O)c1cnc(nc1Sc2ccc(OC)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E06	compound treatment	1.204	-0.0204	-0.28	1.334	-0.0105	-0.14	-0.2953	-0.9532	1910531	Bionet1_004004	CCOC(=O)C/C(=N/NC(=O)/C(=N/Nc1ccccc1[N+](=O)[O-])/C#N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E07	compound treatment	1.188	-0.0364	-0.49	1.376	0.0315	0.43	-0.0429	-0.0658	1910532	Bionet1_004005	CCOC(=O)c1cnc(nc1Sc2cc(C)ccc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E08	compound treatment	1.245	0.0206	0.28	1.338	-0.00646	-0.09	0.1344	0.4607	1910533	Bionet1_004006	CCCc1c(C)nn(C(=O)/C(=N/Nc2ccccc2[N+](=O)[O-])/C#N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E09	compound treatment	1.242	0.0176	0.24	1.362	0.0175	0.24	0.3372	1.0	1180452	Bionet1_004007	CCOC(=O)c1cnc(nc1Oc2ccc(Cl)c(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E10	compound treatment	1.264	0.0396	0.53	1.382	0.0375	0.51	0.7399	0.9998	1910534	Bionet1_004008	CC/C(=N\NC(=O)\C(=N\Nc1ccccc1[N+](=O)[O-])\C#N)/CC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E11	compound treatment	1.218	-0.00639	-0.09	1.364	0.0195	0.27	0.1275	0.4553	1247003	Bionet1_004009	CCOC(=O)c1cnc(nc1Oc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E12	compound treatment	1.187	-0.0374	-0.5	1.363	0.0185	0.25	-0.1778	-0.3152	1910535	Bionet1_004010	Fc1cc(ccc1I)c2nccc(n2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E13	compound treatment	1.197	-0.0274	-0.37	1.361	0.0165	0.23	-0.1017	-0.235	1910536	Bionet1_004011	CCOC(=O)c1cnc(nc1Oc2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E14	compound treatment	1.209	-0.0154	-0.21	1.331	-0.0135	-0.18	-0.2765	-0.9981	1910537	Bionet1_004012	C/C(=N\NC(=O)\C(=N\Nc1ccccc1[N+](=O)[O-])\C#N)/CC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E15	compound treatment	1.26	0.0356	0.48	1.35	0.00554	0.08	0.3932	0.8084	1498796	Bionet1_004013	Clc1ccc(Sc2nc(ncc2C(=O)NCC=C)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E16	compound treatment	1.236	0.0116	0.16	1.307	-0.0375	-0.51	-0.2504	-0.4686	1910538	Bionet1_004014	[O-][N+](=O)c1ccc(Oc2ccc(c(F)c2)c3ccccc3)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E17	compound treatment	1.227	0.00261	0.04	1.417	0.0725	0.99	0.7244	0.7319	1910539	Bionet1_004015	CO/N=C(/CCS(=O)(=O)c1ccc(C)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E18	compound treatment	1.207	-0.0174	-0.23	1.424	0.0795	1.08	0.6011	0.5417	1910540	Bionet1_004016	Fc1ccc(N/C=C/C(=O)c2ccc(OCc3c(F)cccc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E19	compound treatment	1.273	0.0486	0.66	1.379	0.0345	0.47	0.7968	0.9868	1236485	Bionet1_004017	Cc1ccc(Sc2cc3ccccc3nc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E20	compound treatment	1.273	0.0486	0.66	1.377	0.0325	0.44	0.7775	0.9819	1910541	Bionet1_004018	Cc1ccc(N/C=C/C(=O)c2ccc(OCc3c(F)cccc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E21	compound treatment	1.273	0.0486	0.66	1.383	0.0385	0.53	0.8354	0.994	1910542	Bionet1_004019	Clc1ccc(Sc2cc3ccccc3nc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	E22	compound treatment	1.267	0.0426	0.57	1.364	0.0195	0.27	0.5949	0.9389	1910543	Bionet1_004020	Clc1ccc(COc2ccc(/C=C/C(=O)N3CCOCC3)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F03	compound treatment	1.216	-0.00839	-0.11	1.354	0.00954	0.13	0.012	0.0697	1910544	Bionet1_004021	COc1cnc(nc1Sc2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F04	compound treatment	1.218	-0.00639	-0.09	1.327	-0.0175	-0.24	-0.2292	-0.9055	1910545	Bionet1_004022	Cc1nc(sc1C(=O)/C=C/Nc2ccc(C)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F05	compound treatment	1.236	0.0116	0.16	1.356	0.0115	0.16	0.2221	1.0	1665399	Bionet1_004023	O=c1cc(N2CCN(CC2)S(=O)(=O)c3ccccc3)c(n[nH]1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F06	compound treatment	1.219	-0.00539	-0.07	1.32	-0.0245	-0.33	-0.2872	-0.8414	1910546	Bionet1_004024	Cc1nc(sc1C(=O)C2C(c3ccccc3)C2(C#N)C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F07	compound treatment	1.215	-0.00939	-0.13	1.322	-0.0225	-0.31	-0.3061	-0.9236	1512031	Bionet1_004025	O=C(N1CCOCC1)c2cc3cccnc3n2S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F08	compound treatment	1.205	-0.0194	-0.26	1.357	0.0125	0.17	-0.064	-0.2048	1910547	Bionet1_004026	Clc1ccc(CNC(=O)/C=C/c2cnc3ccccc3c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F09	compound treatment	1.221	-0.00339	-0.05	1.353	0.00854	0.12	0.0501	0.4002	1910548	Bionet1_004027	Clc1ccc(Sc2cc(Cl)c(nn2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F10	compound treatment	1.197	-0.0274	-0.37	1.302	-0.0425	-0.58	-0.6706	-0.9765	1910549	Bionet1_004028	Brc1ccc(cc1)C(=O)CSc2nccn2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F11	compound treatment	1.26	0.0356	0.48	1.345	5.42E-4	0.01	0.345	0.7179	1910550	Bionet1_004029	Clc1cc(Sc2ccc(Br)cc2)nnc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F12	compound treatment	1.217	-0.00739	-0.1	1.314	-0.0305	-0.42	-0.3641	-0.8525	1910551	Bionet1_004030	Clc1cc(OCc2ccccc2)ccc1C(=O)NNC(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F13	compound treatment	1.276	0.0516	0.7	1.353	0.00854	0.12	0.5747	0.8141	1910552	Bionet1_004031	Clc1ccc(Oc2cc(Cl)c(nn2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F14	compound treatment	1.21	-0.0144	-0.19	1.312	-0.0325	-0.44	-0.4502	-0.9315	1910553	Bionet1_004032	CCNC(=S)NNC(=O)c1ccc(OCc2ccccc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F15	compound treatment	1.251	0.0266	0.36	1.376	0.0315	0.43	0.558	0.996	1910554	Bionet1_004033	COc1cnc(nc1Sc2cccc(Cl)c2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F16	compound treatment	1.247	0.0226	0.31	1.331	-0.0135	-0.18	0.086	0.2414	1910555	Bionet1_004034	Clc1cc(OCc2ccccc2)ccc1C(=O)NNC(=S)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F17	compound treatment	1.268	0.0436	0.59	1.374	0.0295	0.4	0.7009	0.9829	1910556	Bionet1_004035	COc1cnc(nc1Sc2ccc(Cl)cc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F18	compound treatment	1.223	-0.00139	-0.02	1.293	-0.0515	-0.7	-0.5094	-0.7257	1642801	Bionet1_004036	Clc1ccccc1CNC(=O)c2ccc(OCc3ccccc3)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F19	compound treatment	1.24	0.0156	0.21	1.327	-0.0175	-0.24	-0.0194	-0.061	1910557	Bionet1_004037	CCN(CC)C(=O)C(=O)c1cccn1c2c(sc3ccccc23)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F20	compound treatment	1.252	0.0276	0.37	1.333	-0.0115	-0.16	0.1529	0.3786	1910558	Bionet1_004038	O=C1N(CCCSc2nccn2c3ccccc3)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F21	compound treatment	1.21	-0.0144	-0.19	1.358	0.0135	0.18	-0.0066	-0.0248	1910559	Bionet1_004039	CCCNC(=O)C(=O)c1cccn1c2c(sc3ccccc23)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	F22	compound treatment	1.166	-0.0584	-0.79	1.33	-0.0145	-0.2	-0.6964	-0.8576	1359490	Bionet1_004040	CCOC(=O)c1nc2ccc(I)cn2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G03	compound treatment	1.219	-0.00539	-0.07	1.348	0.00354	0.05	-0.0172	-0.1974	1462038	Bionet1_004041	Clc1ccc(cc1)C23N(CCN3C(=O)c4ccccc42)C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G04	compound treatment	1.253	0.0286	0.39	1.356	0.0115	0.16	0.3843	0.9217	1910560	Bionet1_004042	CC(Oc1ccc(c(F)c1)c2ccccc2)C(=O)/C=C/Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G05	compound treatment	1.24	0.0156	0.21	1.328	-0.0165	-0.22	-0.0097	-0.0316	1327272	Bionet1_004043	COc1ccc(Sc2cc3ccccc3nc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G06	compound treatment	1.266	0.0416	0.56	1.367	0.0225	0.31	0.6143	0.9598	1910561	Bionet1_004044	CCC(C)NC(=O)/C=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G07	compound treatment	1.208	-0.0164	-0.22	1.371	0.0265	0.36	0.0996	0.2349	1340843	Bionet1_004045	Brc1ccc(Sc2cc3ccccc3nc2c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G08	compound treatment	1.204	-0.0204	-0.28	1.361	0.0165	0.23	-0.035	-0.0983	1910562	Bionet1_004046	[O-][N+](=O)c1ccc(Oc2ccc(Br)cc2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G09	compound treatment	1.193	-0.0314	-0.42	1.383	0.0385	0.53	0.0722	0.107	1910563	Bionet1_004047	ClCC(=O)N1CCN2C(=O)c3ccccc3C12c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G10	compound treatment	1.234	0.00961	0.13	1.387	0.0425	0.58	0.5019	0.8444	1910564	Bionet1_004048	[O-][N+](=O)c1ccc(cc1)N2CCN(Cc3ccc(OCCCF)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G11	compound treatment	1.185	-0.0394	-0.53	1.343	-0.00146	-0.02	-0.3898	-0.733	1910565	Bionet1_004049	Brc1ccc(cc1)c2ccc(NC(=O)c3ccccc3)c(=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G12	compound treatment	1.274	0.0496	0.67	1.364	0.0195	0.27	0.6617	0.9185	1910566	Bionet1_004050	FCCCOc1ccc(/C=C/C(=O)N2CCN(Cc3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G13	compound treatment	1.228	0.00361	0.05	1.357	0.0125	0.17	0.1554	0.8739	1910567	Bionet1_004051	Brc1ccc(cc1)c2ccc(NC(=O)c3cccs3)c(=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G14	compound treatment	1.228	0.00361	0.05	1.345	5.42E-4	0.01	0.0397	0.8051	1910568	Bionet1_004052	Cc1ccc(N2CCN(CC2)C(=O)/C=C/c3ccc(OCCCF)cc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G15	compound treatment	1.234	0.00961	0.13	1.345	5.42E-4	0.01	0.0969	0.7462	1694638	Bionet1_004053	Fc1ccc(cc1)n2ncc(NCc3ccccc3)c(Br)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G16	compound treatment	1.248	0.0236	0.32	1.349	0.00454	0.06	0.2691	0.8291	1910569	Bionet1_004054	FCCCOc1ccc(/C=C/C(=O)NCc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G17	compound treatment	1.233	0.00861	0.12	1.369	0.0245	0.33	0.3188	0.8999	1331363	Bionet1_004055	Fc1ccc(cc1)n2ncc(Cl)c(Oc3ccc(Cl)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G18	compound treatment	1.217	-0.00739	-0.1	1.34	-0.00446	-0.06	-0.1134	-0.9719	1910570	Bionet1_004056	COc1ccccc1/N=C/c2cc(Br)cc(Br)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G19	compound treatment	1.188	-0.0364	-0.49	1.327	-0.0175	-0.24	-0.5154	-0.9448	1305425	Bionet1_004057	Cn1nc(c(CN2CCN(CC2)c3ccccc3)c1Cl)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G20	compound treatment	1.222	-0.00239	-0.03	1.364	0.0195	0.27	0.1657	0.6172	1910571	Bionet1_004058	FC(F)(Cl)c1nnc2ccc(Sc3nc4ccccc4s3)nn12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G21	compound treatment	1.269	0.0446	0.6	1.453	0.109	1.48	1.4722	0.9214	1327484	Bionet1_004059	COc1ccc(Oc2c(Br)cnn(c3ccc(C)cc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	G22	compound treatment	1.244	0.0196	0.26	1.412	0.0675	0.92	0.8384	0.8749	1910572	Bionet1_004060	COC(=O)c1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H03	compound treatment	1.195	-0.0294	-0.4	1.332	-0.0125	-0.17	-0.4004	-0.9285	1910573	Bionet1_004061	COC(=O)c1sc2ccccc2c1n3cccc3C(=O)C(=O)NC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H04	compound treatment	1.154	-0.0704	-0.95	1.332	-0.0125	-0.17	-0.7916	-0.8206	1910574	Bionet1_004062	COc1ccc(N/C=C/C(=O)c2sc(nc2C)c3cccnc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H05	compound treatment	1.242	0.0176	0.24	1.383	0.0385	0.53	0.5397	0.9356	1910575	Bionet1_004063	FC(F)(F)c1cccc(Oc2ncc(cn2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H06	compound treatment	1.194	-0.0304	-0.41	1.328	-0.0165	-0.22	-0.4485	-0.9598	1910576	Bionet1_004064	Cc1nc(sc1C(=O)/C=C/Nc2ccc(Cl)cc2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H07	compound treatment	1.236	0.0116	0.16	1.338	-0.00646	-0.09	0.0485	0.27	1910577	Bionet1_004065	Clc1ccc(cc1)c2cnc(Oc3cc(Cl)ccc3Cl)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H08	compound treatment	1.218	-0.00639	-0.09	1.292	-0.0525	-0.72	-0.5667	-0.7866	1302957	Bionet1_004066	CC1(C)CC(=O)C2(C(c3ccc(Cl)cc3Cl)C2(C#N)C#N)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H09	compound treatment	1.222	-0.00239	-0.03	1.351	0.00654	0.09	0.0403	0.4252	1910578	Bionet1_004067	COc1cnc(nc1Sc2ccccc2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H10	compound treatment	1.222	-0.00239	-0.03	1.338	-0.00646	-0.09	-0.085	-0.9069	1910579	Bionet1_004068	CN(C)/C=C/C(=C/C(=O)C(F)(F)F)/Nc1ccccc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H11	compound treatment	1.199	-0.0254	-0.34	1.363	0.0185	0.25	-0.0634	-0.1489	1910580	Bionet1_004069	Cc1cccc(CO/N=C/c2c(nc3cc(C)ccn23)c4ccc(Cl)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H12	compound treatment	1.217	-0.00739	-0.1	1.343	-0.00146	-0.02	-0.0845	-0.8318	1910581	Bionet1_004070	COC(=O)c1cc(Cl)ccc1N/C(=C/C(=O)C(F)(F)F)/C=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H13	compound treatment	1.193	-0.0314	-0.42	1.371	0.0265	0.36	-0.0435	-0.078	1910582	Bionet1_004071	Cc1cccc(CO/N=C/c2c(nc3c(C)cccn23)c4ccc(Cl)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H14	compound treatment	1.206	-0.0184	-0.25	1.355	0.0105	0.14	-0.0737	-0.2572	1910583	Bionet1_004072	FC(F)(F)c1cccc(Oc2ccc(cc2)C3=C(CCC(=O)N3)C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H15	compound treatment	1.232	0.00761	0.1	1.379	0.0345	0.47	0.4057	0.8415	1910584	Bionet1_004073	Cc1cccn2c(/C=N/OCc3cccc(F)c3)c(nc12)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H16	compound treatment	1.2	-0.0244	-0.33	1.336	-0.00846	-0.12	-0.3142	-0.9012	1910585	Bionet1_004074	Oc1nc2cc(Cl)c(Cl)cc2nc1c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H17	compound treatment	1.195	-0.0294	-0.4	1.376	0.0315	0.43	0.0238	0.0407	1910586	Bionet1_004075	Cc1cccn2c(/C=N/OCc3ccc(F)cc3)c(nc12)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H18	compound treatment	1.245	0.0206	0.28	1.352	0.00754	0.1	0.2694	0.9085	1910587	Bionet1_004076	CN(C)/C=C/C(=O)C(Cc1ccc(Cl)cc1)Cc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H19	compound treatment	1.299	0.0746	1.01	1.352	0.00754	0.1	0.7845	0.7753	1910588	Bionet1_004077	COC(=O)c1nn(c(Cl)c1/C=N/OCc2cccc(F)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H20	compound treatment	1.205	-0.0194	-0.26	1.304	-0.0405	-0.55	-0.575	-0.9418	1910589	Bionet1_004078	OC(CN(Cc1ccc(Cl)cc1)C(=O)Nc2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H21	compound treatment	1.256	0.0316	0.43	1.379	0.0345	0.47	0.6347	0.9988	1910590	Bionet1_004079	COC(=O)c1nn(c(Cl)c1/C=N/OCc2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	H22	compound treatment	1.182	-0.0424	-0.57	1.362	0.0175	0.24	-0.2352	-0.3794	1910591	Bionet1_004080	COc1ccc(cc1)C(=O)c2nnn(c2C)c3ccc(OC(F)(F)F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I03	compound treatment	1.234	0.00961	0.13	1.351	0.00654	0.09	0.1548	0.9833	1193122	Bionet1_004081	Cc1ccc(Sc2c(NCC=C)cnn(c3ccc(C)cc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I04	compound treatment	1.22	-0.00439	-0.06	1.339	-0.00546	-0.07	-0.0945	-0.9935	1666051	Bionet1_004082	COC(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I05	compound treatment	1.234	0.00961	0.13	1.33	-0.0145	-0.2	-0.0477	-0.2021	1910592	Bionet1_004083	COc1ccc(NC(=O)c2cc3c(nn(C)c3s2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I06	compound treatment	1.242	0.0176	0.24	1.304	-0.0405	-0.55	-0.2221	-0.3697	1910593	Bionet1_004084	FC(F)(F)c1ccc(Sc2ccc3nnc(n3n2)C(F)(F)Cl)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I07	compound treatment	1.188	-0.0364	-0.49	1.335	-0.00946	-0.13	-0.4383	-0.8636	1207473	Bionet1_004085	Cc1ccc(Sc2c(cnn(c3ccc(C)cc3)c2=O)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I08	compound treatment	1.267	0.0426	0.57	1.381	0.0365	0.5	0.7589	0.9975	1910594	Bionet1_004086	Oc1c(Br)cc(Br)cc1/C=N/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I09	compound treatment	1.191	-0.0334	-0.45	1.339	-0.00546	-0.07	-0.3711	-0.8129	1571009	Bionet1_004087	Cc1cc(oc(=O)c1NC(=O)c2ccccc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I10	compound treatment	1.222	-0.00239	-0.03	1.378	0.0335	0.46	0.3007	0.6557	1910595	Bionet1_004088	Oc1c(Br)cc(Br)cc1/C=N/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I11	compound treatment	1.245	0.0206	0.28	1.355	0.0105	0.14	0.2983	0.9529	1665602	Bionet1_004089	Cc1ccc(cc1)C(=O)Nc2c(C)cc(oc2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I12	compound treatment	1.202	-0.0224	-0.3	1.377	0.0325	0.44	0.1002	0.1868	1129145	Bionet1_004090	Oc1c(Br)cc(Br)cc1CNc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I13	compound treatment	1.234	0.00961	0.13	1.339	-0.00546	-0.07	0.0391	0.2614	1910596	Bionet1_004091	Cn1nc(c2ccccc2)c3cc(sc13)c4nnc(SCC=C)n4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I14	compound treatment	1.221	-0.00339	-0.05	1.333	-0.0115	-0.16	-0.1428	-0.8771	1466882	Bionet1_004092	Oc1c(Br)cc(Br)cc1CNc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I15	compound treatment	1.227	0.00261	0.04	1.361	0.0165	0.23	0.1844	0.8079	1910597	Bionet1_004093	FC(F)(F)c1cccc(Cn2ccc(c(C#N)c2=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I16	compound treatment	1.274	0.0496	0.67	1.373	0.0285	0.39	0.7485	0.9667	1532611	Bionet1_004094	O=C(COc1ccc(cc1)c2nccc(n2)c3cccs3)NC4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I17	compound treatment	1.236	0.0116	0.16	1.335	-0.00946	-0.13	0.0196	0.0966	1700098	Bionet1_004095	O=C(NCc1ccc(cc1)C(=O)NC2CCCCC2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I18	compound treatment	1.269	0.0446	0.6	1.292	-0.0525	-0.72	-0.0802	-0.0858	1910598	Bionet1_004096	FCCCOc1ccc(cc1)/C(=C/Nc2ccc(OC(F)(F)F)cc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I19	compound treatment	1.196	-0.0284	-0.38	1.41	0.0655	0.89	0.3612	0.3715	1536021	Bionet1_004097	Clc1ccc(NC(=O)c2ccc(CNC(=O)OCc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I20	compound treatment	1.259	0.0346	0.47	1.42	0.0755	1.03	1.0586	0.936	1910599	Bionet1_004098	Cc1ccc(/C=N/Nc2nc3ccccc3nc2Cc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I21	compound treatment	1.237	0.0126	0.17	1.431	0.0865	1.18	0.9548	0.8008	1675083	Bionet1_004099	OC(c1cccs1)c2cc3cccnc3n2S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	I22	compound treatment	1.244	0.0196	0.26	1.345	5.42E-4	0.01	0.1923	0.7266	1910600	Bionet1_004100	COc1ccc(O)c(/C=N/Nc2nc3ccccc3nc2Cc4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J03	compound treatment	1.236	0.0116	0.16	1.358	0.0135	0.18	0.2414	0.9967	1910601	Bionet1_004101	C/C(=N\OC(=O)Nc1ccccc1)/c2sc(nc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J04	compound treatment	1.21	-0.0144	-0.19	1.312	-0.0325	-0.44	-0.4502	-0.9315	1910602	Bionet1_004102	CC(C(=O)c1cn(nn1)c2ccc(OC(F)(F)F)cc2)n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J05	compound treatment	1.199	-0.0254	-0.34	1.341	-0.00346	-0.05	-0.2755	-0.7969	1910603	Bionet1_004103	CC(C)NC(=O)O/N=C(\C)/c1sc(nc1C)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J06	compound treatment	1.21	-0.0144	-0.19	1.292	-0.0525	-0.72	-0.643	-0.8676	1262418	Bionet1_004104	CCCc1ccc(c(F)c1)c2ccc(cc2)c3[nH]ncc3c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J07	compound treatment	1.229	0.00461	0.06	1.337	-0.00746	-0.1	-0.0279	-0.2339	1389812	Bionet1_004105	Clc1cccc(Cn2nc(c3ccccc3)c(cc2=O)N4CCCCC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J08	compound treatment	1.214	-0.0104	-0.14	1.323	-0.0215	-0.29	-0.306	-0.9431	1584495	Bionet1_004106	C=CCNC(=O)CN1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J09	compound treatment	1.234	0.00961	0.13	1.318	-0.0265	-0.36	-0.1634	-0.4262	1910604	Bionet1_004107	O=C(NNC(=O)c1ccccc1)C(=O)c2c([nH]c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J10	compound treatment	1.215	-0.00939	-0.13	1.308	-0.0365	-0.5	-0.4411	-0.8598	1658850	Bionet1_004108	Cc1nc2ccccn2c1C(=O)CSc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J11	compound treatment	1.221	-0.00339	-0.05	1.338	-0.00646	-0.09	-0.0946	-0.9533	1447737	Bionet1_004109	CCOC(=O)CON1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J12	compound treatment	1.212	-0.0124	-0.17	1.274	-0.0705	-0.96	-0.7975	-0.8178	1910605	Bionet1_004110	Cc1nc2ccccn2c1C(=O)CSc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J13	compound treatment	1.238	0.0136	0.18	1.364	0.0195	0.27	0.3183	0.9835	1910606	Bionet1_004111	Cc1ccc(CSc2nc(Cl)c3sc4ccccc4c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J14	compound treatment	1.235	0.0106	0.14	1.315	-0.0295	-0.4	-0.1828	-0.4286	1910607	Bionet1_004112	Cc1ccc(/C=N/NC(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J15	compound treatment	1.198	-0.0264	-0.36	1.341	-0.00346	-0.05	-0.285	-0.7938	1910608	Bionet1_004113	CSc1nc(Sc2ccc(Cl)cc2)c3sc4ccccc4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J16	compound treatment	1.213	-0.0114	-0.15	1.296	-0.0485	-0.66	-0.5759	-0.8488	1910609	Bionet1_004114	CC/C=N/NC(=O)C1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J17	compound treatment	1.26	0.0356	0.48	1.356	0.0115	0.16	0.451	0.8921	1910610	Bionet1_004115	C=CCSc1nc(Sc2ccccc2)c3sc4ccccc4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J18	compound treatment	1.172	-0.0524	-0.71	1.335	-0.00946	-0.13	-0.5909	-0.8226	1910611	Bionet1_004116	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N/N=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J19	compound treatment	1.271	0.0466	0.63	1.352	0.00754	0.1	0.5174	0.812	1910612	Bionet1_004117	C=CCSc1nc(Oc2ccccc2)c3sc4ccccc4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J20	compound treatment	1.201	-0.0234	-0.32	1.313	-0.0315	-0.43	-0.5264	-0.9886	1301549	Bionet1_004118	COCc1cc(nc(SCc2ccc(Cl)cc2)n1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J21	compound treatment	1.256	0.0316	0.43	1.437	0.0925	1.26	1.1939	0.8963	1910613	Bionet1_004119	Cc1ccccc1Oc2nc(SCC=C)nc3c4ccccc4sc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	J22	compound treatment	1.212	-0.0124	-0.17	1.309	-0.0355	-0.48	-0.46	-0.8993	1910614	Bionet1_004120	FC(F)(F)c1ccc(C(=O)N2CCCC2)c(=O)n1Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K03	compound treatment	1.223	-0.00139	-0.02	1.321	-0.0235	-0.32	-0.2394	-0.7472	1910615	Bionet1_004121	Cc1ccc(cc1)C(=O)NNC(=O)c2cc3cc(ccc3s2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K04	compound treatment	1.246	0.0216	0.29	1.334	-0.0105	-0.14	0.1053	0.3246	1910616	Bionet1_004122	FCCCOc1ccc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K05	compound treatment	1.244	0.0196	0.26	1.354	0.00954	0.13	0.2791	0.9466	1910617	Bionet1_004123	COC(=O)c1sccc1n2cccc2C(=O)C(=O)N3CC(C)OC(C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K06	compound treatment	1.23	0.00561	0.08	1.288	-0.0565	-0.77	-0.4908	-0.6345	1509151	Bionet1_004124	CN1C(=O)C(CC(=O)c2ccc(Br)cc2)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K07	compound treatment	1.187	-0.0374	-0.5	1.367	0.0225	0.31	-0.1393	-0.2358	1910618	Bionet1_004125	COC(=O)c1sccc1n2cccc2C(=O)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K08	compound treatment	1.249	0.0246	0.33	1.34	-0.00446	-0.06	0.1918	0.5682	1910619	Bionet1_004126	Cc1ccc(Oc2nc3cc(Cl)c(Cl)cc3nc2C(F)(F)F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K09	compound treatment	1.239	0.0146	0.2	1.312	-0.0325	-0.44	-0.1736	-0.3582	1910620	Bionet1_004127	Brc1ccc(NC(=O)c2snnc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K10	compound treatment	1.223	-0.00139	-0.02	1.346	0.00154	0.02	0.0017	0.0588	1910621	Bionet1_004128	Oc1c(Br)cc(Br)cc1/C=N/Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K11	compound treatment	1.244	0.0196	0.26	1.362	0.0175	0.24	0.3563	0.9987	1910622	Bionet1_004129	Clc1cc(Cl)cc(NC(=O)c2snnc2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K12	compound treatment	1.24	0.0156	0.21	1.305	-0.0395	-0.54	-0.2315	-0.4007	1910623	Bionet1_004130	COc1cc(NC(=O)Cc2ncc(cc2Cl)C(F)(F)F)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K13	compound treatment	1.173	-0.0514	-0.69	1.324	-0.0205	-0.28	-0.6874	-0.92	1910624	Bionet1_004131	COc1ccc(/C=C/C(=O)c2sc(nc2C)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K14	compound treatment	1.25	0.0256	0.35	1.365	0.0205	0.28	0.4424	0.9946	1910625	Bionet1_004132	CCCCCC1CCC(CC1)c2ccc(/N=C/c3ccc4OCOc4c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K15	compound treatment	1.246	0.0216	0.29	1.373	0.0285	0.39	0.4814	0.9899	1910626	Bionet1_004133	CSc1cc(c(s1)C(=O)Nc2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K16	compound treatment	1.184	-0.0404	-0.54	1.355	0.0105	0.14	-0.2836	-0.5033	1167061	Bionet1_004134	CC(C)N(C(C)C)C(=O)CC1ON(C)C(=O)N1c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K17	compound treatment	1.241	0.0166	0.22	1.356	0.0115	0.16	0.2698	0.985	1910627	Bionet1_004135	CSc1cc(c(s1)C(=O)Nc2ccc(F)cc2F)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K18	compound treatment	1.254	0.0296	0.4	1.346	0.00154	0.02	0.2974	0.7433	1910628	Bionet1_004136	FC(F)(F)c1cc(nc(c1C#N)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K19	compound treatment	1.219	-0.00539	-0.07	1.367	0.0225	0.31	0.166	0.5255	1910629	Bionet1_004137	COc1ccc(NC(=O)c2sc(SC)cc2c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K20	compound treatment	1.234	0.00961	0.13	1.406	0.0615	0.84	0.6851	0.8068	1910630	Bionet1_004138	Cc1cccc(n1)n2cnc(c2)C(=O)NNC(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K21	compound treatment	1.236	0.0116	0.16	1.38	0.0355	0.48	0.4535	0.8903	1910631	Bionet1_004139	C/C(=N\OC(=O)c1ccc(Cl)cc1)/c2sc(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	K22	compound treatment	1.26	0.0356	0.48	1.394	0.0495	0.68	0.8174	0.9861	1558123	Bionet1_004140	Clc1ccc(SCC2CNc3nc4ccccc4c(=O)n23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L03	compound treatment	1.254	0.0296	0.4	1.335	-0.00946	-0.13	0.1913	0.4557	1910632	Bionet1_004141	FC(F)(F)c1cc(=O)n(nc1C(=O)c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L04	compound treatment	1.218	-0.00639	-0.09	1.306	-0.0385	-0.52	-0.4317	-0.8124	1910633	Bionet1_004142	COc1cccc(OC)c1C(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L05	compound treatment	1.218	-0.00639	-0.09	1.306	-0.0385	-0.52	-0.4317	-0.8124	1910634	Bionet1_004143	FC(F)(F)c1cc(=O)n(nc1C(=O)c2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L06	compound treatment	1.221	-0.00339	-0.05	1.294	-0.0505	-0.69	-0.5188	-0.7524	1910635	Bionet1_004144	FC(F)(F)c1cccc(c1)C(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L07	compound treatment	1.2	-0.0244	-0.33	1.314	-0.0305	-0.42	-0.5263	-0.9933	1910636	Bionet1_004145	Fc1ccc(cc1)C(=O)NCc2nnc(SCC=C)n2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L08	compound treatment	1.188	-0.0364	-0.49	1.272	-0.0725	-0.99	-1.0458	-0.9479	1323434	Bionet1_004146	Cc1c(C)n(Cc2ccccc2)c(c1CNC(=O)c3ccc(C)cc3)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L09	compound treatment	1.244	0.0196	0.26	1.315	-0.0295	-0.4	-0.0969	-0.2015	1281362	Bionet1_004147	COc1ccc(Oc2c(cnn(c3ccc(C)cc3)c2=O)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L10	compound treatment	1.224	-3.86E-4	-0.01	1.293	-0.0515	-0.7	-0.4999	-0.7123	1220573	Bionet1_004148	CCNC(=O)NCc1c(C)c(C)n(Cc2ccccc2)c1n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L11	compound treatment	1.212	-0.0124	-0.17	1.362	0.0175	0.24	0.051	0.1748	1614859	Bionet1_004149	COC(=O)c1ccccc1Sc2nccc(c2C#N)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L12	compound treatment	1.197	-0.0274	-0.37	1.328	-0.0165	-0.22	-0.4199	-0.9715	1910637	Bionet1_004150	COc1ccc(CSc2nnc(o2)c3sccc3n4cccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L13	compound treatment	1.158	-0.0664	-0.9	1.387	0.0425	0.58	-0.2231	-0.209	1910638	Bionet1_004151	FC(F)(F)c1cccc(c1)c2ccnc(Sc3cccc(Cl)c3)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L14	compound treatment	1.234	0.00961	0.13	1.293	-0.0515	-0.7	-0.4045	-0.5668	1910639	Bionet1_004152	Clc1ccc(CSc2nnc(o2)c3sccc3n4cccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L15	compound treatment	1.162	-0.0624	-0.84	1.35	0.00554	0.08	-0.5417	-0.641	1910640	Bionet1_004153	CN(C)CCCNC(=O)/C=C/c1ccc(OCc2c(F)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L16	compound treatment	1.205	-0.0194	-0.26	1.311	-0.0335	-0.46	-0.5075	-0.9651	1649372	Bionet1_004154	Cc1c(C)n(Cc2ccccc2)c(c1CNC(=O)c3cccc(C)c3)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L17	compound treatment	1.235	0.0106	0.14	1.326	-0.0185	-0.25	-0.0767	-0.2649	1910641	Bionet1_004155	COC(OC)c1ccnc(n1)c2ccc(I)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L18	compound treatment	1.154	-0.0704	-0.95	1.318	-0.0265	-0.36	-0.9265	-0.9122	1321471	Bionet1_004156	CCn1c(SCC=C)nnc1c2nn(ccc2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L19	compound treatment	1.273	0.0486	0.66	1.359	0.0145	0.2	0.604	0.8815	1910642	Bionet1_004157	COC(=O)/C(=C/c1ccnc(n1)c2ccc(OC(=O)c3cccs3)cc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L20	compound treatment	1.219	-0.00539	-0.07	1.292	-0.0525	-0.72	-0.5572	-0.7749	1447893	Bionet1_004158	CCn1c(SC=C=C)nnc1c2nn(ccc2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L21	compound treatment	1.212	-0.0124	-0.17	1.363	0.0185	0.25	0.0606	0.2001	1910643	Bionet1_004159	Cc1ccc(CNC(=O)/C=C/c2ccc(OCc3cccc(Cl)c3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	L22	compound treatment	1.218	-0.00639	-0.09	1.31	-0.0345	-0.47	-0.3932	-0.823	1702159	Bionet1_004160	Cc1cccc2c(C)cc(nc12)N3CCN(CC3)S(=O)(=O)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M03	compound treatment	1.246	0.0216	0.29	1.366	0.0215	0.29	0.4139	1.0	1910644	Bionet1_004161	C/C(=N\OC(=O)Nc1ccccc1)/c2sc(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M04	compound treatment	1.225	6.14E-4	0.01	1.356	0.0115	0.16	0.1172	0.7433	1175101	Bionet1_004162	Brc1ccc(SCC2CNc3nc4ccccc4c(=O)n23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M05	compound treatment	1.219	-0.00539	-0.07	1.337	-0.00746	-0.1	-0.1233	-0.9864	1910645	Bionet1_004163	COC(=O)c1sc2ccccc2c1n3cccc3C(=O)C(=O)N4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M06	compound treatment	1.276	0.0516	0.7	1.306	-0.0385	-0.52	0.1215	0.1394	1910646	Bionet1_004164	Cc1ccc(cc1)S(=O)(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M07	compound treatment	1.22	-0.00439	-0.06	1.314	-0.0305	-0.42	-0.3355	-0.7998	1280576	Bionet1_004165	Fc1ccc(cc1)C(=O)N2CCN(CC2)c3cc(=O)[nH]nc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M08	compound treatment	1.284	0.0596	0.8	1.343	-0.00146	-0.02	0.5546	0.6894	1910647	Bionet1_004166	Clc1ccc(cc1)S(=O)(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M09	compound treatment	1.262	0.0376	0.51	1.317	-0.0275	-0.37	0.0941	0.1491	1740589	Bionet1_004167	O=C(N1CCN(CC1)c2cc(=O)[nH]nc2c3ccccc3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M10	compound treatment	1.214	-0.0104	-0.14	1.38	0.0355	0.48	0.2436	0.4829	1910648	Bionet1_004168	Fc1ccc(cc1)S(=O)(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M11	compound treatment	1.247	0.0226	0.31	1.317	-0.0275	-0.37	-0.049	-0.1015	1168227	Bionet1_004169	Cc1ccc(cc1)C(=O)N2CCN(CC2)c3cc(=O)[nH]nc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M12	compound treatment	1.225	6.14E-4	0.01	1.354	0.00954	0.13	0.0979	0.7506	1910649	Bionet1_004170	COc1ccc(cc1)S(=O)(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M13	compound treatment	1.257	0.0326	0.44	1.367	0.0225	0.31	0.5285	0.9846	1292933	Bionet1_004171	Fc1ccccc1N2CCN(CC2)C(=O)c3snnc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M14	compound treatment	1.232	0.00761	0.1	1.349	0.00454	0.06	0.1164	0.9707	1910650	Bionet1_004172	Fc1ccccc1S(=O)(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M15	compound treatment	1.285	0.0606	0.82	1.319	-0.0255	-0.35	0.3327	0.3746	1910651	Bionet1_004173	CC(C)NC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M16	compound treatment	1.172	-0.0524	-0.71	1.342	-0.00246	-0.03	-0.5234	-0.7398	1910652	Bionet1_004174	Clc1ccc(NC(=O)NNC(=O)c2sccc2n3cccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M17	compound treatment	1.157	-0.0674	-0.91	1.323	-0.0215	-0.29	-0.8497	-0.8898	1910653	Bionet1_004175	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NC2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M18	compound treatment	1.271	0.0466	0.63	1.379	0.0345	0.47	0.7777	0.9899	1910654	Bionet1_004176	Clc1cccc(NC(=O)NNC(=O)c2sccc2n3cccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M19	compound treatment	1.232	0.00761	0.1	1.317	-0.0275	-0.37	-0.1921	-0.4948	1910655	Bionet1_004177	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M20	compound treatment	1.237	0.0126	0.17	1.379	0.0345	0.47	0.4534	0.9053	1910656	Bionet1_004178	Cc1cccc(C)c1NC(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M21	compound treatment	1.224	-3.86E-4	-0.01	1.389	0.0445	0.61	0.4258	0.701	1910657	Bionet1_004179	CCCNC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	M22	compound treatment	1.253	0.0286	0.39	1.377	0.0325	0.44	0.5867	0.9976	1910658	Bionet1_004180	FC(F)(F)c1cccc(NC(=O)NNC(=O)c2sccc2n3cccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N03	compound treatment	1.185	-0.0394	-0.53	1.293	-0.0515	-0.7	-0.8719	-0.9906	1910659	Bionet1_004181	Clc1cccc(COc2ccc(/C=C/C(=O)NCc3cccs3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N04	compound treatment	1.173	-0.0514	-0.69	1.252	-0.0925	-1.26	-1.3817	-0.9603	1230704	Bionet1_004182	Cc1cccc2c(C)cc(nc12)N3CCN(CC3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N05	compound treatment	1.255	0.0306	0.41	1.308	-0.0365	-0.5	-0.0595	-0.0921	1910660	Bionet1_004183	COc1ccc(NC(=O)/C=C/c2ccc(OCc3cccc(Cl)c3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N06	compound treatment	1.186	-0.0384	-0.52	1.297	-0.0475	-0.65	-0.8238	-0.9939	1357420	Bionet1_004184	Cc1cccc2c(C)cc(nc12)N3CCN(CC3)S(=O)(=O)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N07	compound treatment	1.206	-0.0184	-0.25	1.305	-0.0395	-0.54	-0.5559	-0.9382	1910661	Bionet1_004185	Clc1cccc(COc2ccc(/C=C/C(=O)NC3CCCC3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N08	compound treatment	1.156	-0.0684	-0.92	1.285	-0.0595	-0.81	-1.2257	-0.9979	1628224	Bionet1_004186	Cc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)c3nc(C)cc(C)c3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N09	compound treatment	1.248	0.0236	0.32	1.371	0.0265	0.36	0.4812	0.998	1910662	Bionet1_004187	Clc1cccc(COc2ccc(/C=C/C(=O)N3CCOCC3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N10	compound treatment	1.171	-0.0534	-0.72	1.325	-0.0195	-0.27	-0.6969	-0.908	1910663	Bionet1_004188	COC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)CCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N11	compound treatment	1.174	-0.0504	-0.68	1.325	-0.0195	-0.27	-0.6683	-0.9158	1910664	Bionet1_004189	OC/1/C(=C/c2ccccc2)/CN(Cc3ccccc3)C\C1=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N12	compound treatment	1.213	-0.0114	-0.15	1.285	-0.0595	-0.81	-0.6819	-0.8264	1716810	Bionet1_004190	Clc1ccc(CNC(=O)c2ccc(cc2)N3CCCC3=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N13	compound treatment	1.168	-0.0564	-0.76	1.32	-0.0245	-0.33	-0.7737	-0.9315	1910665	Bionet1_004191	Clc1ccc(CNC(=O)/C=C/c2ccc(OCc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N14	compound treatment	1.215	-0.00939	-0.13	1.318	-0.0265	-0.36	-0.3446	-0.9014	1607137	Bionet1_004192	Clc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)N4CCCC4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N15	compound treatment	1.242	0.0176	0.24	1.338	-0.00646	-0.09	0.1058	0.4173	1910666	Bionet1_004193	COc1ccc(NC(=O)/C=C/c2ccc(OCc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N16	compound treatment	1.139	-0.0854	-1.15	1.309	-0.0355	-0.48	-1.1564	-0.9257	1910667	Bionet1_004194	FC(F)(F)c1nc2cc(Cl)c(Cl)cc2nc1Oc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N17	compound treatment	1.271	0.0466	0.63	1.347	0.00254	0.03	0.4692	0.745	1910668	Bionet1_004195	CC(Oc1ccc(c(F)c1)c2ccccc2)C(=O)/C=C/Nc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N18	compound treatment	1.192	-0.0324	-0.44	1.33	-0.0145	-0.2	-0.4483	-0.9354	1910669	Bionet1_004196	Clc1ccc(CC(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N19	compound treatment	1.185	-0.0394	-0.53	1.323	-0.0215	-0.29	-0.5826	-0.9605	1910670	Bionet1_004197	[O-][N+](=O)c1ccc(Sc2c(Cl)cccc2Cl)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N20	compound treatment	1.167	-0.0574	-0.77	1.31	-0.0345	-0.47	-0.8797	-0.9714	1910671	Bionet1_004198	Cc1cccc(C)c1Oc2nc3cc(Cl)c(Cl)cc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N21	compound treatment	1.281	0.0566	0.76	1.35	0.00554	0.08	0.5935	0.7733	1910672	Bionet1_004199	CCC(C)NC(=O)/C=C/c1ccc(OCc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	N22	compound treatment	1.169	-0.0554	-0.75	1.296	-0.0485	-0.66	-0.9956	-0.9981	1548784	Bionet1_004200	Oc1c(Br)cc(Br)cc1CNCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O03	compound treatment	1.225	6.14E-4	0.01	1.351	0.00654	0.09	0.0689	0.7695	1910673	Bionet1_004201	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NNC(=O)C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O04	compound treatment	1.209	-0.0154	-0.21	1.324	-0.0205	-0.28	-0.344	-0.9894	1910674	Bionet1_004202	Cc1ccc(cc1)S(=O)(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O05	compound treatment	1.242	0.0176	0.24	1.304	-0.0405	-0.55	-0.2221	-0.3697	1124798	Bionet1_004203	OC1(CSc2ccccc2)CCN(CC1)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O06	compound treatment	1.213	-0.0114	-0.15	1.35	0.00554	0.08	-0.0552	-0.3223	1910675	Bionet1_004204	Clc1ccc(C(=O)NNC(=O)c2ccccc2n3cccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O07	compound treatment	1.215	-0.00939	-0.13	1.271	-0.0735	-1.0	-0.7978	-0.7902	1183970	Bionet1_004205	OC1(CSc2ccc(Cl)cc2)CCN(CC1)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O08	compound treatment	1.215	-0.00939	-0.13	1.324	-0.0205	-0.28	-0.2868	-0.9361	1910676	Bionet1_004206	Clc1ccc(cc1Cl)C(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O09	compound treatment	1.293	0.0686	0.93	1.419	0.0745	1.02	1.3733	0.9989	1591346	Bionet1_004207	Cc1cc(C)cc(Oc2nc(cc(C)c2S(=O)(=O)C)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O10	compound treatment	1.184	-0.0404	-0.54	1.308	-0.0365	-0.5	-0.7368	-0.999	1910677	Bionet1_004208	COc1ccc(cc1)S(=O)(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O11	compound treatment	1.187	-0.0374	-0.5	1.332	-0.0125	-0.17	-0.4768	-0.8958	1376188	Bionet1_004209	Cc1cccc(Oc2nc(cc(C)c2S(=O)(=O)C)c3ccccc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O12	compound treatment	1.244	0.0196	0.26	1.373	0.0285	0.39	0.4623	0.9823	1910678	Bionet1_004210	Fc1ccccc1S(=O)(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O13	compound treatment	1.215	-0.00939	-0.13	1.356	0.0115	0.16	0.0218	0.1077	1542456	Bionet1_004211	CCN(CC)CC1(O)CCN(CC1)C(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O14	compound treatment	1.215	-0.00939	-0.13	1.344	-4.58E-4	-0.01	-0.0939	-0.7411	1910679	Bionet1_004212	COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O15	compound treatment	1.237	0.0126	0.17	1.332	-0.0125	-0.17	2.0E-4	9.0E-4	1910680	Bionet1_004213	Cn1cc(C(=O)N2CCN(CC2)c3ccccc3F)c(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O16	compound treatment	1.223	-0.00139	-0.02	1.335	-0.00946	-0.13	-0.1044	-0.8012	1910681	Bionet1_004214	Clc1ccc(/C=N\NC(=O)c2sccc2n3cccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O17	compound treatment	1.265	0.0406	0.55	1.336	-0.00846	-0.12	0.3059	0.5463	1910682	Bionet1_004215	Cn1cc(NC(=O)OCc2ccc(Cl)cc2Cl)c(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O18	compound treatment	1.235	0.0106	0.14	1.39	0.0455	0.62	0.5404	0.8479	1910683	Bionet1_004216	Clc1ccc(/C=N\NC(=O)c2ccccc2n3cccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O19	compound treatment	1.284	0.0596	0.8	1.339	-0.00546	-0.07	0.5161	0.6389	1910684	Bionet1_004217	CC(OC(=O)Nc1ccc(Cl)c(Cl)c1)c2sc3ncnn3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O20	compound treatment	1.245	0.0206	0.28	1.393	0.0485	0.66	0.6647	0.9258	1910685	Bionet1_004218	Brc1cccc(/C=N\NC(=O)c2ccccc2n3cccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O21	compound treatment	1.242	0.0176	0.24	1.379	0.0345	0.47	0.5011	0.9498	1234447	Bionet1_004219	CCS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	O22	compound treatment	1.272	0.0476	0.64	1.383	0.0385	0.53	0.8259	0.995	1910686	Bionet1_004220	C/C(=N\NC(=O)c1sccc1n2cccc2)/c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P03	compound treatment	1.183	-0.0414	-0.56	1.352	0.00754	0.1	-0.3221	-0.5673	1910687	Bionet1_004221	CCOC(=O)Cc1cccc[n+]1Cc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P04	compound treatment	1.207	-0.0174	-0.23	1.274	-0.0705	-0.96	-0.8452	-0.8546	1910688	Bionet1_004222	CCCCCC1CCC(CC1)c2ccc(NC(=O)c3cccs3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P05	compound treatment	1.206	-0.0184	-0.25	1.311	-0.0335	-0.46	-0.498	-0.959	1910689	Bionet1_004223	Cc1cc(N/C=C/C(=O)c2ccc(OCCCF)cc2)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P06	compound treatment	1.164	-0.0604	-0.81	1.242	-0.102	-1.4	-1.564	-0.967	1910690	Bionet1_004224	CCCCCC1CCC(CC1)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P07	compound treatment	1.198	-0.0264	-0.36	1.295	-0.0495	-0.67	-0.7286	-0.9554	1910691	Bionet1_004225	CCOC(=O)Cc1cccc[n+]1Cc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P08	compound treatment	1.198	-0.0264	-0.36	1.264	-0.0805	-1.1	-1.0275	-0.8908	1910692	Bionet1_004226	CCCCCC1CCC(CC1)c2ccc(NC(=O)Cc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P09	compound treatment	1.1	-0.124	-1.68	1.217	-0.127	-1.74	-2.4156	-0.9998	1910693	Bionet1_004227	Cc1cccc(c1)C(=O)NNc2nc3ccccc3nc2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P10	compound treatment	0.116	-1.11	-14.95	0.396	-0.948	-12.93	-19.7187	-0.9974	1910694	Bionet1_004228	CCCCCC1CCC(CC1)c2ccc3ncc(C(=O)OCC)c(O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P11	compound treatment	1.168	-0.0564	-0.76	1.285	-0.0595	-0.81	-1.1112	-0.9995	1555455	Bionet1_004229	Cc1ccccc1C(=O)Nc2ncc(I)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P12	compound treatment	1.216	-0.00839	-0.11	1.261	-0.0835	-1.14	-0.8847	-0.7736	1910695	Bionet1_004230	[O-][N+](=O)c1ccc(C/2CCCC\C2=N/OC(=O)Nc3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P13	compound treatment	1.194	-0.0304	-0.41	1.326	-0.0185	-0.25	-0.4678	-0.9726	1690338	Bionet1_004231	Cc1cc(I)cnc1NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P14	compound treatment	1.165	-0.0594	-0.8	1.272	-0.0725	-0.99	-1.2652	-0.9946	1292765	Bionet1_004232	Clc1ccc(CNC(=O)c2ccc(OCc3ccccc3)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P15	compound treatment	1.223	-0.00139	-0.02	1.323	-0.0215	-0.29	-0.2201	-0.7507	1349102	Bionet1_004233	COC(=O)c1cc(Br)c(NC(=O)c2ccco2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P16	compound treatment	1.156	-0.0684	-0.92	1.31	-0.0345	-0.47	-0.9846	-0.951	1910696	Bionet1_004234	CCNC(=O)O/N=C/1\CCCCC1c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P17	compound treatment	1.188	-0.0364	-0.49	1.289	-0.0555	-0.76	-0.8818	-0.9781	1910697	Bionet1_004235	FCCCOc1ccc(cc1)/C(=C/Nc2ccc(Oc3ccccc3)cc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P18	compound treatment	1.166	-0.0584	-0.79	1.336	-0.00846	-0.12	-0.6385	-0.8021	1910698	Bionet1_004236	COc1cc(Br)cc(/C=N/Cc2cccc(c2)C(F)(F)F)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P19	compound treatment	1.257	0.0326	0.44	1.332	-0.0125	-0.17	0.191	0.405	1910699	Bionet1_004237	FCCCOc1ccc(cc1)/C(=C/Nc2cc(Cl)cc(Cl)c2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P20	compound treatment	1.166	-0.0584	-0.79	1.328	-0.0165	-0.22	-0.7157	-0.8738	1910700	Bionet1_004238	Cc1ccc(cc1)S(=O)(=O)N2C=CC3C2CCC(Br)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P21	compound treatment	1.164	-0.0604	-0.81	1.41	0.0655	0.89	0.0559	0.0463	1910701	Bionet1_004239	COc1cc(N/C=C(\C#N)/c2ccc(OCCCF)cc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1235	P22	compound treatment	1.272	0.0476	0.64	1.299	-0.0455	-0.62	0.0159	0.0178	1910702	Bionet1_004240	Clc1ccc(C2=Nn3c(nnc3SC2)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A01	compound treatment	1.096	-5.84E-4	-0.01	1.243	0.0363	0.49	0.344	0.6957	1727701	CBDivE_001281	Clc1ccc(cc1)C(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A02	compound treatment	1.127	0.0304	0.41	1.24	0.0333	0.45	0.6108	0.9988	1172968	CBDivE_001282	Brc1ccc(NC(NC(=O)c2ccccc2)C(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A03	compound treatment	1.136	0.0394	0.53	1.268	0.0612	0.84	0.9666	0.9762	1913201	CBDivE_001283	OC(=O)c1ccccc1C(=O)Nc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A04	compound treatment	1.169	0.0724	0.98	1.254	0.0473	0.64	1.1464	0.9796	1913202	CBDivE_001284	O=C(NC(Sc1ccccc1)C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A05	compound treatment	1.158	0.0614	0.83	1.23	0.0233	0.32	0.81	0.9131	1913203	CBDivE_001285	OC(=O)c1cc(cc([N+](=O)[O-])c1N2CCCC2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A06	compound treatment	1.137	0.0404	0.55	1.265	0.0582	0.79	0.9472	0.9831	1913204	CBDivE_001286	OC(=O)/C=C/c1ccc(o1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A07	compound treatment	1.12	0.0234	0.32	1.275	0.0682	0.93	0.8815	0.8969	1913205	CBDivE_001287	OC(=O)c1ccc(/N=C/c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A08	compound treatment	1.065	-0.0316	-0.43	1.273	0.0662	0.9	0.3375	0.3379	1913206	CBDivE_001288	OC(=O)c1ccc(/N=C/c2ccc(O)cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A09	compound treatment	1.083	-0.0136	-0.18	1.243	0.0363	0.49	0.22	0.4172	1111875	CBDivE_001289	Brc1ccc(cc1)C(=O)COC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A10	compound treatment	1.141	0.0444	0.6	1.187	-0.0197	-0.27	0.2333	0.3551	1913207	CBDivE_001290	Oc1ccc(/C=N/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A11	compound treatment	1.082	-0.0146	-0.2	1.253	0.0462	0.63	0.3068	0.4644	1318626	CBDivE_001291	OC(=O)CCC(=O)Nc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A12	compound treatment	1.146	0.0494	0.67	1.231	0.0243	0.33	0.7052	0.9477	1913208	CBDivE_001292	Oc1ccc(/C=N/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A13	compound treatment	1.072	-0.0246	-0.33	1.212	0.00525	0.07	-0.1839	-0.542	1398190	CBDivE_001293	CCOC(=O)c1ccc(NC(=O)CCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A14	compound treatment	1.143	0.0464	0.63	1.202	-0.00475	-0.06	0.397	0.6306	1913209	CBDivE_001294	COc1ccc(/N=C/c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A15	compound treatment	1.089	-0.00758	-0.1	1.137	-0.0698	-0.95	-0.7449	-0.7787	1011962	CBDivE_001295	OC(=O)CCC(=O)Nc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A16	compound treatment	1.101	0.00442	0.06	1.251	0.0442	0.6	0.4688	0.7732	1913210	CBDivE_001296	COc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A17	compound treatment	1.081	-0.0156	-0.21	1.264	0.0573	0.78	0.4034	0.4989	1913211	CBDivE_001297	OC(=O)/C=C\C(=O)Nc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A18	compound treatment	1.12	0.0234	0.32	1.209	0.00225	0.03	0.2451	0.7722	1913212	CBDivE_001298	COc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A19	compound treatment	1.106	0.00942	0.13	1.239	0.0323	0.44	0.4008	0.8756	1913213	CBDivE_001299	OC(=O)/C=C\C(=O)Nc1ccc(Br)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	A20	compound treatment	1.112	0.0154	0.21	1.225	0.0183	0.25	0.323	0.996	1913214	CBDivE_001300	OCCc1ccc(/N=C/c2ccc(O)cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B01	compound treatment	1.066	-0.0306	-0.41	1.176	-0.0308	-0.42	-0.5883	-1.0	1625427	CBDivE_001301	CN1C2C=CC(C3C2C(=O)N(Cc4ccccc4)C3=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B02	compound treatment	1.126	0.0294	0.4	1.257	0.0502	0.69	0.7651	0.9663	1269401	CBDivE_001302	COc1ccccc1C(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B03	compound treatment	1.144	0.0474	0.64	1.233	0.0263	0.36	0.7054	0.9624	1913215	CBDivE_001303	[O-][N+](=O)c1cccc(c1)C(=O)c2ccc3C(=O)OC(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B04	compound treatment	1.162	0.0654	0.88	1.238	0.0313	0.43	0.9253	0.9442	1913216	CBDivE_001304	OC(=O)c1ccccc1NC(=O)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B05	compound treatment	1.107	0.0104	0.14	1.255	0.0482	0.66	0.5646	0.8392	1084629	CBDivE_001305	OC(=O)c1ccc(cc1)C(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B06	compound treatment	1.178	0.0814	1.1	1.212	0.00525	0.07	0.8273	0.7516	1774445	CBDivE_001306	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B07	compound treatment	1.168	0.0714	0.96	1.176	-0.0308	-0.42	0.3848	0.3662	1073911	CBDivE_001307	OC(=O)c1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B08	compound treatment	1.126	0.0294	0.4	1.217	0.0103	0.14	0.3794	0.9019	1913217	CBDivE_001308	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Nc2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B09	compound treatment	1.126	0.0294	0.4	1.24	0.0333	0.45	0.6012	0.9978	1913218	CBDivE_001309	O=C1OC(=O)c2cc(Oc3cccc(Oc4ccc5C(=O)OC(=O)c5c4)c3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B10	compound treatment	1.091	-0.00558	-0.08	1.237	0.0303	0.41	0.2384	0.5686	1913219	CBDivE_001310	C/C(=N\OCO\N=C(\C)/c1ccc(cc1)[N+](=O)[O-])/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B11	compound treatment	1.092	-0.00458	-0.06	1.194	-0.0127	-0.17	-0.1667	-0.9032	1333910	CBDivE_001311	Nc1ccc(Oc2ccc(cc2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B12	compound treatment	1.132	0.0354	0.48	1.169	-0.0377	-0.51	-0.0262	-0.0372	1729986	CBDivE_001312	Cc1ccccc1NC(=O)COc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B13	compound treatment	1.092	-0.00458	-0.06	1.244	0.0372	0.51	0.3154	0.6165	1774924	CBDivE_001313	OC(=O)c1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B14	compound treatment	1.095	-0.00158	-0.02	1.198	-0.00875	-0.12	-0.0995	-0.8207	1913220	CBDivE_001314	Cc1ccccc1OCC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B15	compound treatment	1.134	0.0374	0.5	1.258	0.0512	0.7	0.8511	0.9872	1913221	CBDivE_001315	Cc1ccc(Oc2cccc(c2)[N+](=O)[O-])cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B16	compound treatment	1.15	0.0534	0.72	1.218	0.0113	0.15	0.618	0.8388	1913222	CBDivE_001316	Cc1ccccc1OCC(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B17	compound treatment	1.105	0.00842	0.11	1.279	0.0722	0.99	0.7769	0.7834	1913223	CBDivE_001317	CC(C)(c1ccc(Oc2ccc3C(=O)OC(=O)c3c2)cc1)c4ccc(Oc5ccc6C(=O)OC(=O)c6c5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B18	compound treatment	1.172	0.0754	1.02	1.164	-0.0428	-0.58	0.3072	0.262	1152000	CBDivE_001318	Cc1ccccc1OCC(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B19	compound treatment	1.139	0.0424	0.57	1.27	0.0633	0.86	1.0145	0.9801	1913224	CBDivE_001319	O=C1OC(=O)c2cc(Oc3ccc(cc3)S(=O)(=O)c4ccc(Oc5ccc6C(=O)OC(=O)c6c5)cc4)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	B20	compound treatment	1.081	-0.0156	-0.21	1.215	0.00825	0.11	-0.0691	-0.2898	1558037	CBDivE_001320	Cc1ccccc1OCC(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C01	compound treatment	1.076	-0.0206	-0.28	1.27	0.0633	0.86	0.4135	0.4564	1913225	CBDivE_001321	OC(=O)/C=C\C(=O)Nc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C02	compound treatment	1.098	0.00142	0.02	1.268	0.0612	0.84	0.6041	0.7231	1913226	CBDivE_001322	OCCc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C03	compound treatment	1.077	-0.0196	-0.26	1.17	-0.0368	-0.5	-0.5412	-0.9553	1347120	CBDivE_001323	OC(=O)CCC(=O)Nc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C04	compound treatment	1.156	0.0594	0.8	1.245	0.0383	0.52	0.9356	0.9783	1913227	CBDivE_001324	Oc1ccccc1/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C05	compound treatment	1.102	0.00542	0.07	1.241	0.0343	0.47	0.3819	0.8079	1316843	CBDivE_001325	CC(NC(=O)c1ccc(cc1)C(=O)NC(C)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C06	compound treatment	1.157	0.0604	0.82	1.24	0.0333	0.45	0.8969	0.9617	1913228	CBDivE_001326	Oc1ccc(/C=N/c2ccccc2O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C07	compound treatment	1.106	0.00942	0.13	1.159	-0.0478	-0.65	-0.3706	-0.5586	1913229	CBDivE_001327	COc1ccc(/C=C/C(=O)OCC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C08	compound treatment	1.121	0.0244	0.33	1.206	-7.5E-4	-0.01	0.2257	0.6848	1913230	CBDivE_001328	Oc1ccc2ccccc2c1/C=N/c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C09	compound treatment	1.122	0.0254	0.34	1.199	-0.00775	-0.11	0.1677	0.4675	1081835	CBDivE_001329	NC(=O)COc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C10	compound treatment	1.103	0.00642	0.09	1.227	0.0203	0.28	0.2565	0.8862	1913231	CBDivE_001330	OC(=O)CCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C11	compound treatment	1.05	-0.0466	-0.63	1.21	0.00325	0.04	-0.413	-0.6556	1049682	CBDivE_001331	Oc1ccc(N=Nc2ccccn2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C12	compound treatment	1.144	0.0474	0.64	1.201	-0.00575	-0.08	0.3969	0.6158	1913232	CBDivE_001332	OC(=O)CN1C(=O)/C(=C\Nc2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C13	compound treatment	1.157	0.0604	0.82	1.189	-0.0177	-0.24	0.4052	0.4765	1913233	CBDivE_001333	c1nc(oc1c2ccccc2)c3ccc(cc3)c4cnc(o4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C14	compound treatment	1.1	0.00342	0.05	1.225	0.0183	0.25	0.2086	0.824	1230247	CBDivE_001334	Nc1cc(ccc1Nc2ccccc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C15	compound treatment	1.088	-0.00858	-0.12	1.277	0.0702	0.96	0.5955	0.6171	1913234	CBDivE_001335	[O-][N+](=O)c1ccc(cc1)N2N=C(/C(=C\c3ccc(Br)cc3)/C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C16	compound treatment	1.081	-0.0156	-0.21	1.252	0.0452	0.62	0.2877	0.4413	3003634	CBDivE_001336	CCN1/C(=C/c2sc3ccc(O)cc3[n+]2CC)/C=Cc4ccccc14.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C17	compound treatment	1.093	-0.00358	-0.05	1.172	-0.0348	-0.47	-0.3693	-0.7752	1913236	CBDivE_001337	[O-][N+](=O)c1ccc(cc1)N2N=C(/C(=C\c3ccccc3F)/C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C18	compound treatment	1.114	0.0174	0.23	1.186	-0.0208	-0.28	-0.0339	-0.0923	1913237	CBDivE_001338	CCO/C(=C/c1sc2ccccc2[n+]1CCCS(=O)(=O)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C19	compound treatment	1.111	0.0144	0.19	1.22	0.0133	0.18	0.2653	0.9993	1913238	CBDivE_001339	COc1ccc(/C=C\2/C(=O)N(N=C2c3ccccc3)c4ccc(cc4)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	C20	compound treatment	1.123	0.0264	0.36	1.162	-0.0448	-0.61	-0.1795	-0.254	3105836	CBDivE_001340	CCn1c(/C=C/C=C/2\SCCN2C)[n+](CC)c3cc(Cl)ccc13.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D01	compound treatment	1.106	0.00942	0.13	1.204	-0.00275	-0.04	0.0633	0.478	1715893	CBDivE_001341	Cc1ccccc1OCC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D02	compound treatment	1.127	0.0304	0.41	1.222	0.0153	0.21	0.4372	0.9504	1579970	CBDivE_001342	Cc1ccccc1OCC(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D03	compound treatment	1.101	0.00442	0.06	1.207	2.5E-4	0.0	0.0445	0.7464	1125894	CBDivE_001343	Nc1cccc(c1)C(=O)Oc2cccc(OC(=O)c3cccc(N)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D04	compound treatment	1.142	0.0454	0.61	1.169	-0.0377	-0.51	0.0692	0.0865	1913240	CBDivE_001344	[O-][N+](=O)c1cccc(c1)C(=O)Nc2nc[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D05	compound treatment	1.145	0.0484	0.65	1.264	0.0573	0.78	1.0139	0.9961	1913241	CBDivE_001345	[O-][N+](=O)c1ccc(Oc2ccc3c(=O)c(=O)c4cccc2c43)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D06	compound treatment	1.142	0.0454	0.61	1.236	0.0293	0.4	0.7153	0.9784	1913242	CBDivE_001346	OC(=O)c1ccc(NCN2C(=O)c3ccc(Br)cc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D07	compound treatment	1.074	-0.0226	-0.3	1.229	0.0223	0.3	-9.0E-4	-0.0021	1619611	CBDivE_001347	Cc1cc(OC(=O)c2ccc(N)cc2)cc(OC(=O)c3ccc(N)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D08	compound treatment	1.111	0.0144	0.19	1.242	0.0352	0.48	0.4774	0.9207	1913243	CBDivE_001348	OC(=O)c1cccc(NCN2C(=O)c3ccc(Br)cc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D09	compound treatment	1.114	0.0174	0.23	1.136	-0.0708	-0.96	-0.5161	-0.5197	1332763	CBDivE_001349	Cc1cc(OC(=O)c2cccc(N)c2)cc(OC(=O)c3cccc(N)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D10	compound treatment	1.098	0.00142	0.02	1.178	-0.0288	-0.39	-0.2637	-0.6719	1228614	CBDivE_001350	Oc1ccc(NCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D11	compound treatment	1.086	-0.0106	-0.14	1.209	0.00225	0.03	-0.0793	-0.5428	1913244	CBDivE_001351	Nc1ccc(cc1)C(=O)Oc2ccccc2c3ccccc3OC(=O)c4ccc(N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D12	compound treatment	1.068	-0.0286	-0.39	1.211	0.00425	0.06	-0.2317	-0.5942	1288008	CBDivE_001352	O=C1N(CNc2ccc(OCc3ccccc3)cc2)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D13	compound treatment	1.088	-0.00858	-0.12	1.216	0.00925	0.13	0.0073	0.0426	1575815	CBDivE_001353	Nc1cccc(c1)C(=O)Oc2ccc(cc2)c3ccc(OC(=O)c4cccc(N)c4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D14	compound treatment	1.112	0.0154	0.21	1.17	-0.0368	-0.5	-0.2073	-0.3821	1653424	CBDivE_001354	O=C1N(CNc2ccc(Oc3ccccc3)cc2)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D15	compound treatment	1.11	0.0134	0.18	1.217	0.0103	0.14	0.2268	0.9918	1480672	CBDivE_001355	CC(C)(c1ccc(OC(=O)c2ccc(N)cc2)cc1)c3ccc(OC(=O)c4ccc(N)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D16	compound treatment	1.086	-0.0106	-0.14	1.21	0.00325	0.04	-0.0696	-0.4657	1575616	CBDivE_001356	OC(=O)c1ccccc1NCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D17	compound treatment	1.056	-0.0406	-0.55	1.205	-0.00175	-0.02	-0.404	-0.7372	1913245	CBDivE_001357	[O-][N+](=O)c1ccccc1N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D18	compound treatment	1.161	0.0644	0.87	1.229	0.0223	0.3	0.829	0.9007	1913246	CBDivE_001358	O=C1N(CNc2ccc3ccccc3c2)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D19	compound treatment	1.115	0.0184	0.25	1.205	-0.00175	-0.02	0.1588	0.6363	1913247	CBDivE_001359	Nc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccc(N)cc5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	D20	compound treatment	1.045	-0.0516	-0.7	1.234	0.0273	0.37	-0.2293	-0.2907	1913248	CBDivE_001360	COc1ccc(NCN2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E01	compound treatment	1.078	-0.0186	-0.25	1.222	0.0153	0.21	-0.0302	-0.0928	1913249	CBDivE_001361	CN(C)c1ccc(/C=C\2/C(=O)N(N=C2c3ccccc3)c4ccc(Br)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E02	compound treatment	1.173	0.0764	1.03	1.201	-0.00575	-0.08	0.6735	0.6514	3105877	CBDivE_001362	C/C(=C\c1sc2ccccc2[n+]1CCO)/C=C/3\Sc4ccccc4N3CCO.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E03	compound treatment	1.063	-0.0336	-0.45	1.215	0.00825	0.11	-0.2408	-0.5159	1913251	CBDivE_001363	CN(C)c1ccc(/C=C\2/C(=O)N(N=C2c3ccccc3)c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E04	compound treatment	1.105	0.00842	0.11	1.202	-0.00475	-0.06	0.0345	0.2638	1913252	CBDivE_001364	OC(=O)CN1C(=O)S/C(=C\C=C/2\SCCN2CCCS(=O)(=O)O)/C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E05	compound treatment	1.008	-0.0886	-1.2	1.205	-0.00175	-0.02	-0.8619	-0.7211	1913253	CBDivE_001365	Cc1cc(=O)n(c(=O)[nH]1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E06	compound treatment	1.118	0.0214	0.29	1.267	0.0602	0.82	0.7852	0.9016	1913254	CBDivE_001366	OC(=O)CN1C(=O)/C(=C\c2cccc(O)c2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E07	compound treatment	1.094	-0.00258	-0.03	1.243	0.0363	0.49	0.3249	0.6556	1913255	CBDivE_001367	COc1ccc(OC)c(c1)C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E08	compound treatment	1.099	0.00242	0.03	1.278	0.0712	0.97	0.7101	0.7304	1913256	CBDivE_001368	OC(=O)CN1C(=O)/C(=C\c2cccc(c2)[N+](=O)[O-])/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E09	compound treatment	1.15	0.0534	0.72	1.209	0.00225	0.03	0.5312	0.7365	1913257	CBDivE_001369	OC(=O)CSC/1CCCC\C1=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E10	compound treatment	1.082	-0.0146	-0.2	1.21	0.00325	0.04	-0.1078	-0.5344	1913258	CBDivE_001370	OC(=O)CN1C(=O)/C(=C\c2ccc(cc2)[N+](=O)[O-])/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E11	compound treatment	1.097	4.16E-4	0.01	1.136	-0.0708	-0.96	-0.6782	-0.703	1913259	CBDivE_001371	C[C@H](NC(=O)CCl)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E12	compound treatment	1.102	0.00542	0.07	1.153	-0.0537	-0.73	-0.4666	-0.6335	1913260	CBDivE_001372	CCN1/C(=C\2/SC(=S)N(CC(=O)O)C2=O)/C=Cc3cc(OC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E13	compound treatment	1.057	-0.0396	-0.53	1.206	-7.5E-4	-0.01	-0.3848	-0.7205	3003680	CBDivE_001373	CC1(C)Cc2nc3ccccc3c(NCc4ccccc4)c2C=C1.OC(=O)c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E14	compound treatment	1.056	-0.0406	-0.55	1.218	0.0113	0.15	-0.2787	-0.4901	1913261	CBDivE_001374	OS(=O)(=O)CCCN1/C(=C\2/SC(=S)N(C2=O)c3ccccc3)/Sc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E15	compound treatment	1.02	-0.0766	-1.03	1.222	0.0153	0.21	-0.5835	-0.5537	1645058	CBDivE_001375	CN1CCC2=C(C1)C(=O)NC3(CCCCC3)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E16	compound treatment	1.141	0.0444	0.6	1.248	0.0413	0.56	0.8214	0.9995	1913262	CBDivE_001376	CCN1/C(=C\2/SC(=S)N(CC(=O)O)C2=O)/C=Cc3cc(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E17	compound treatment	1.132	0.0354	0.48	1.205	-0.00175	-0.02	0.321	0.671	1913263	CBDivE_001377	CCC1(CC)C(=N)N(C)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E18	compound treatment	1.153	0.0564	0.76	1.227	0.0203	0.28	0.7334	0.9059	1913264	CBDivE_001378	CCN1/C(=C\2/SC(=S)N(CC(=O)O)C2=O)/C=Cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E19	compound treatment	1.05	-0.0466	-0.63	1.166	-0.0408	-0.56	-0.8373	-0.9981	1913265	CBDivE_001379	CCCCN1C(=N)C(CC)(CC)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	E20	compound treatment	1.128	0.0314	0.42	1.238	0.0313	0.43	0.601	1.0	1913266	CBDivE_001380	OC(=O)CN1C(=O)/C(=C\2/Sc3ccccc3N2CCCS(=O)(=O)O)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F01	compound treatment	1.043	-0.0536	-0.72	1.225	0.0183	0.25	-0.3352	-0.4384	1390935	CBDivE_001381	OC(=O)c1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F02	compound treatment	1.154	0.0574	0.77	1.23	0.0233	0.32	0.7719	0.9223	1774441	CBDivE_001382	[O-][N+](=O)c1ccc2C(=O)N(CNc3ccc(OCc4ccccc4)cc3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F03	compound treatment	1.111	0.0144	0.19	1.22	0.0133	0.18	0.2653	0.9993	1913267	CBDivE_001383	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F04	compound treatment	1.151	0.0544	0.73	1.162	-0.0448	-0.61	0.0876	0.0918	1774382	CBDivE_001384	OC(=O)c1cccc(NCN2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F05	compound treatment	1.104	0.00742	0.1	1.155	-0.0517	-0.71	-0.4283	-0.6009	1326171	CBDivE_001385	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F06	compound treatment	1.124	0.0274	0.37	1.185	-0.0217	-0.3	0.0518	0.1093	1913268	CBDivE_001386	Brc1ccc2C(=O)N(CNc3ccc4c(c3)oc5ccccc54)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F07	compound treatment	1.06	-0.0366	-0.49	1.199	-0.00775	-0.11	-0.4237	-0.8395	1774415	CBDivE_001387	CN1C(=O)c2ccc(cc2C1=O)N3C(=O)c4ccc(cc4C3=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F08	compound treatment	1.143	0.0464	0.63	1.231	0.0243	0.33	0.6766	0.9555	1253218	CBDivE_001388	COc1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F09	compound treatment	1.145	0.0484	0.65	1.238	0.0313	0.43	0.7632	0.9786	1248808	CBDivE_001389	OC(=O)c1ccc(Oc2ccc(cc2)C(=O)c3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F10	compound treatment	1.117	0.0204	0.28	1.185	-0.0217	-0.3	-0.015	-0.037	1913269	CBDivE_001390	Cc1ccc(C)n1c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F11	compound treatment	1.133	0.0364	0.49	1.236	0.0293	0.4	0.6294	0.9947	1130767	CBDivE_001391	OC(=O)c1ccc(Oc2ccc(cc2)C(=O)c3ccccc3)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F12	compound treatment	1.046	-0.0506	-0.68	1.181	-0.0257	-0.35	-0.7308	-0.9523	1774711	CBDivE_001392	Cc1ccc(C)n1c2ccc(Oc3ccc(cc3)n4c(C)ccc4C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F13	compound treatment	1.13	0.0334	0.45	1.135	-0.0717	-0.98	-0.3731	-0.3463	1489599	CBDivE_001393	O=C(Oc1ccccc1)c2ccc(Oc3ccc(cc3)C(=O)Oc4ccccc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F14	compound treatment	1.074	-0.0226	-0.3	1.173	-0.0337	-0.46	-0.5409	-0.9799	1774386	CBDivE_001394	Cc1ccc(C)n1c2ccc(Oc3cccc(Oc4ccc(cc4)n5c(C)ccc5C)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F15	compound treatment	1.068	-0.0286	-0.39	1.153	-0.0537	-0.73	-0.791	-0.955	1343270	CBDivE_001395	OC(=O)c1ccc(C(=O)c2ccc(Oc3ccc(C(=O)O)c(c3)C(=O)O)cc2)c(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F16	compound treatment	1.122	0.0254	0.34	1.169	-0.0377	-0.51	-0.1216	-0.1965	1913270	CBDivE_001396	C[C@H]1CCC/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/[C@H]1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F17	compound treatment	1.067	-0.0296	-0.4	1.187	-0.0197	-0.27	-0.4727	-0.9817	1457262	CBDivE_001397	Cc1ccc(cc1C)C(=O)c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F18	compound treatment	1.1	0.00342	0.05	1.169	-0.0377	-0.51	-0.3314	-0.6412	1075921	CBDivE_001398	COc1ccc(NC(=O)c2cccc(c2)C(=O)Nc3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F19	compound treatment	1.079	-0.0176	-0.24	1.214	0.00725	0.1	-0.0978	-0.3807	1913271	CBDivE_001399	Clc1ccc(cc1Cl)N2C(=O)C3C(N4C5C(C(N4C3C2=O)c6ccccc6)C(=O)N(C5=O)c7ccc(Cl)c(Cl)c7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	F20	compound treatment	1.1	0.00342	0.05	1.165	-0.0418	-0.57	-0.37	-0.6478	1913272	CBDivE_001400	CN(C)c1nc(NC(=O)Nc2cccc3ccccc23)nc(/C=C/c4ccco4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G01	compound treatment	1.073	-0.0236	-0.32	1.211	0.00425	0.06	-0.184	-0.5689	1913265	CBDivE_001401	CCCCN1C(=N)C(CC)(CC)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G02	compound treatment	1.127	0.0304	0.41	1.213	0.00625	0.09	0.3504	0.8361	1913273	CBDivE_001402	CCN1/C(=C\C=C\2/SC(=S)N(C2=O)c3ccccc3)/SC(=C1c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G03	compound treatment	1.028	-0.0686	-0.93	1.146	-0.0608	-0.83	-1.24	-0.9985	1913274	CBDivE_001403	CCC(C)C1(CC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G04	compound treatment	1.15	0.0534	0.72	1.209	0.00225	0.03	0.5312	0.7365	1913275	CBDivE_001404	O=C/1N(Cc2ccccc2)C(=S)S\C1=C\Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G05	compound treatment	1.096	-5.84E-4	-0.01	1.215	0.00825	0.11	0.074	0.6559	1913276	CBDivE_001405	CCCCC1(CC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G06	compound treatment	1.073	-0.0236	-0.32	1.197	-0.00975	-0.13	-0.319	-0.9251	1913277	CBDivE_001406	O=C/1N(Cc2ccccc2)C(=S)S\C1=C\C=C\C=C\Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G07	compound treatment	1.137	0.0404	0.55	1.173	-0.0337	-0.46	0.0601	0.0842	1913278	CBDivE_001407	CCCC(C)C1(CC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G08	compound treatment	1.096	-5.84E-4	-0.01	1.211	0.00425	0.06	0.0354	0.6053	1913279	CBDivE_001408	CC(=O)N(/C=C/C=C/C=C\1/SC(=S)N(C1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G09	compound treatment	1.089	-0.00758	-0.1	1.193	-0.0137	-0.19	-0.2049	-0.9594	1913280	CBDivE_001409	CCCC1(CCC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G10	compound treatment	1.07	-0.0266	-0.36	1.233	0.0263	0.36	-5.0E-4	-0.001	1913281	CBDivE_001410	CN(N=c1c(=O)c2ccccc2c1=O)C(=N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G11	compound treatment	1.128	0.0314	0.42	1.197	-0.00975	-0.13	0.2057	0.463	1913282	CBDivE_001411	CCCCC1(CCCC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G12	compound treatment	1.097	4.16E-4	0.01	1.257	0.0502	0.69	0.4885	0.7129	1913283	CBDivE_001412	Clc1cccc(c1)N(Cc2ccc(Cl)cc2Cl)C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G13	compound treatment	1.129	0.0324	0.44	1.136	-0.0708	-0.96	-0.373	-0.3521	1913284	CBDivE_001413	CCC1(CC)C(=O)NC(=NCc2ccccc2)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G14	compound treatment	1.085	-0.0116	-0.16	1.197	-0.00975	-0.13	-0.2045	-0.9968	1913285	CBDivE_001414	Clc1ccc(cc1)C(=O)N(Cc2ccc(Cl)cc2Cl)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G15	compound treatment	1.057	-0.0396	-0.53	1.242	0.0352	0.48	-0.0377	-0.0525	1114595	CBDivE_001415	CCC1(CC)C(=O)NC(=S)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G16	compound treatment	1.147	0.0504	0.68	1.238	0.0313	0.43	0.7823	0.9746	1913286	CBDivE_001416	Cc1nonc1N=c2c(=O)c3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G17	compound treatment	1.114	0.0174	0.23	1.168	-0.0388	-0.53	-0.2075	-0.3588	1030417	CBDivE_001417	CCC1(CC)C(=N)NC(=S)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G18	compound treatment	1.084	-0.0126	-0.17	1.25	0.0432	0.59	0.297	0.4839	1913287	CBDivE_001418	C/C(=N\NC(=O)COc1ccc2ccccc2c1)/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G19	compound treatment	1.088	-0.00858	-0.12	1.22	0.0133	0.18	0.0459	0.2137	1913288	CBDivE_001419	FC(F)(F)C(=O)c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	G20	compound treatment	1.132	0.0354	0.48	1.235	0.0283	0.39	0.6102	0.9943	1913289	CBDivE_001420	CC(C)c1ccc(cc1)/C(=N/NC(=O)COc2ccc3ccccc3c2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H01	compound treatment	1.036	-0.0606	-0.82	1.201	-0.00575	-0.08	-0.6334	-0.7714	1048033	CBDivE_001421	OC(=O)c1cccc(NC(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H02	compound treatment	1.076	-0.0206	-0.28	1.195	-0.0117	-0.16	-0.3097	-0.9659	1913290	CBDivE_001422	CC1(C)CC(CC(C)(C)N1)/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H03	compound treatment	1.072	-0.0246	-0.33	1.196	-0.0107	-0.15	-0.3382	-0.9326	1052670	CBDivE_001423	CN(c1ccccc1N(C)S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H04	compound treatment	1.14	0.0434	0.59	1.192	-0.0147	-0.2	0.2719	0.4391	1913291	CBDivE_001424	O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H05	compound treatment	1.098	0.00142	0.02	1.193	-0.0137	-0.19	-0.1191	-0.6318	1913292	CBDivE_001425	COc1ccc(cc1)C(=C(C)C)OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H06	compound treatment	1.005	-0.0916	-1.24	1.17	-0.0368	-0.5	-1.228	-0.921	1913293	CBDivE_001426	CC(C)(C)c1cc(/C=N/C2CC(C)(C)NC(C)(C)C2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H07	compound treatment	1.064	-0.0326	-0.44	1.16	-0.0468	-0.64	-0.7616	-0.9835	1409129	CBDivE_001427	Cc1ccc(cc1)C(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H08	compound treatment	1.098	0.00142	0.02	1.206	-7.5E-4	-0.01	0.0063	0.2895	1913294	CBDivE_001428	Oc1cc(O)nc(/N=C/2\C(=O)Nc3ccccc23)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H09	compound treatment	1.113	0.0164	0.22	1.119	-0.0877	-1.2	-0.6895	-0.5666	1014454	CBDivE_001429	O=c1oc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H10	compound treatment	1.114	0.0174	0.23	1.212	0.00525	0.07	0.2168	0.8825	1054138	CBDivE_001430	Nc1ccc(Cc2ccc(N)cc2[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H11	compound treatment	1.028	-0.0686	-0.93	1.123	-0.0838	-1.14	-1.4618	-0.9945	1913295	CBDivE_001431	Nc1ccc(cc1)C(=O)/C=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H12	compound treatment	1.107	0.0104	0.14	1.162	-0.0448	-0.61	-0.3321	-0.5304	1913296	CBDivE_001432	S(c1nc2ccccc2s1)c3nc(Sc4nc5ccccc5s4)nc(Sc6nc7ccccc7s6)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H13	compound treatment	1.102	0.00542	0.07	1.203	-0.00375	-0.05	0.0155	0.1738	1913297	CBDivE_001433	[O-][N+](=O)c1ccc(Oc2ccc(cc2)C3(c4ccccc4-c5ccccc53)c6ccc(Oc7ccc(cc7)[N+](=O)[O-])cc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H14	compound treatment	1.093	-0.00358	-0.05	1.184	-0.0227	-0.31	-0.2536	-0.8076	1913298	CBDivE_001434	CC(C)(C)c1cc(/C=N/N=C/c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H15	compound treatment	1.105	0.00842	0.11	1.178	-0.0288	-0.39	-0.1969	-0.4825	1913299	CBDivE_001435	COc1ccccc1OC(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H16	compound treatment	1.084	-0.0126	-0.17	1.19	-0.0168	-0.23	-0.2816	-0.9893	1183356	CBDivE_001436	COC(=O)C(c1ccccc1)C2(O)CC(C)N(C)CC2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H17	compound treatment	1.074	-0.0226	-0.3	1.196	-0.0107	-0.15	-0.3191	-0.9438	1913300	CBDivE_001437	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Oc2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H18	compound treatment	1.101	0.00442	0.06	1.072	-0.135	-1.84	-1.2572	-0.6838	1913301	CBDivE_001438	CCOC(=O)c1c(C)nc2c3ccccc3oc(=N)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H19	compound treatment	1.084	-0.0126	-0.17	1.179	-0.0277	-0.38	-0.3876	-0.9346	1913302	CBDivE_001439	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Oc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	H20	compound treatment	1.088	-0.00858	-0.12	1.2	-0.00675	-0.09	-0.147	-0.9935	1324852	CBDivE_001440	CC1CC(O)(Cc2ccc(C)cc2)C(C)CN1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I01	compound treatment	1.096	-5.84E-4	-0.01	1.231	0.0243	0.33	0.2283	0.6901	3105917	CBDivE_001441	Nc1c2CCCc2nc3CCCc31.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I02	compound treatment	1.133	0.0364	0.49	1.222	0.0153	0.21	0.4944	0.9268	1913303	CBDivE_001442	C/C(=N\NC(=O)COc1ccc2ccccc2c1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I03	compound treatment	1.108	0.0114	0.15	1.212	0.00525	0.07	0.1595	0.9393	3003681	CBDivE_001443	Nc1c2CCCc2nc3CCCCc13.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I04	compound treatment	1.108	0.0114	0.15	1.198	-0.00875	-0.12	0.0245	0.1259	1913304	CBDivE_001444	Cc1ccc(/C=C\2/SC(=N)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I05	compound treatment	1.033	-0.0636	-0.86	1.17	-0.0368	-0.5	-0.9609	-0.9672	3105920	CBDivE_001445	Nc1c2CCCc2nc3ccccc13.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I06	compound treatment	1.037	-0.0596	-0.8	1.221	0.0143	0.19	-0.431	-0.5212	1913305	CBDivE_001446	OCC(=O)N/N=C/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I07	compound treatment	1.123	0.0264	0.36	1.157	-0.0498	-0.68	-0.2277	-0.2972	3105921	CBDivE_001447	Nc1c2CCCCc2nc3ccccc13.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I08	compound treatment	1.097	4.16E-4	0.01	1.184	-0.0227	-0.31	-0.2154	-0.6942	1913306	CBDivE_001448	CN(C)c1ccc(/C=N/NC(=O)CO)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I09	compound treatment	1.055	-0.0416	-0.56	1.192	-0.0147	-0.2	-0.5389	-0.9043	3105922	CBDivE_001449	Nc1c2CCCCCc2nc3ccccc13.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I10	compound treatment	1.088	-0.00858	-0.12	1.153	-0.0537	-0.73	-0.6002	-0.8088	1913307	CBDivE_001450	OCC(=O)N/N=C/c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I11	compound treatment	1.091	-0.00558	-0.08	1.22	0.0133	0.18	0.0745	0.3805	3105944	CBDivE_001451	CCc1nc2ccccc2c(N)c1C.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I12	compound treatment	1.102	0.00542	0.07	1.193	-0.0137	-0.19	-0.0809	-0.4021	1913308	CBDivE_001452	Brc1ccc(/C=N/NC(=O)CNC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I13	compound treatment	1.101	0.00442	0.06	1.238	0.0313	0.43	0.3434	0.7982	3105945	CBDivE_001453	CC(C)(C)c1cc(CCC(=O)O)cc(c1O)C(C)(C)C.Nc1c2CCCc2nc3CCCc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I14	compound treatment	1.076	-0.0206	-0.28	1.189	-0.0177	-0.24	-0.3675	-0.9977	1913309	CBDivE_001454	Oc1c(Br)cc(Br)cc1/C=N/NC(=O)CNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I15	compound treatment	1.094	-0.00258	-0.03	1.144	-0.0628	-0.86	-0.6297	-0.7353	3105946	CBDivE_001455	CC(C)(C)c1cc(CCC(=O)O)cc(c1O)C(C)(C)C.Nc1c2CCCc2nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I16	compound treatment	1.09	-0.00658	-0.09	1.189	-0.0177	-0.24	-0.234	-0.9074	1913310	CBDivE_001456	Fc1ccccc1/C=N/NC(=O)CNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I17	compound treatment	1.045	-0.0516	-0.7	1.236	0.0293	0.4	-0.21	-0.2619	3105947	CBDivE_001457	Nc1c2CCCc2nc3CCCc31.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I18	compound treatment	1.11	0.0134	0.18	1.252	0.0452	0.62	0.5643	0.8775	1913311	CBDivE_001458	CN(C)c1ccc(/C=N/NC(=O)CNC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I19	compound treatment	1.097	4.16E-4	0.01	1.185	-0.0217	-0.3	-0.2058	-0.6936	3105948	CBDivE_001459	Nc1c2CCCc2nc3CCCCc13.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	I20	compound treatment	1.121	0.0244	0.33	1.211	0.00425	0.06	0.2739	0.8189	1913312	CBDivE_001460	OCC(=O)N/N=C/c1ccc(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J01	compound treatment	1.077	-0.0196	-0.26	1.225	0.0183	0.25	-0.0108	-0.0299	1913313	CBDivE_001461	Cc1ccc(OC(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J02	compound treatment	1.102	0.00542	0.07	1.191	-0.0157	-0.21	-0.1002	-0.4417	1594222	CBDivE_001462	CCC(=O)OC1(Cc2ccc(CC)cc2)CC(C)N(C)CC1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J03	compound treatment	1.077	-0.0196	-0.26	1.168	-0.0388	-0.53	-0.5605	-0.9487	1489837	CBDivE_001463	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Oc2ccc(C=O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J04	compound treatment	1.061	-0.0356	-0.48	1.218	0.0113	0.15	-0.231	-0.4583	1464973	CBDivE_001464	OC(=O)c1cc(c2ccccc2)c(cn1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J05	compound treatment	1.055	-0.0416	-0.56	1.187	-0.0197	-0.27	-0.5871	-0.9435	1008886	CBDivE_001465	CC(C)(C)c1ccc(OC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J06	compound treatment	1.144	0.0474	0.64	1.188	-0.0187	-0.26	0.2715	0.3941	1267778	CBDivE_001466	COc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J07	compound treatment	1.105	0.00842	0.11	1.221	0.0143	0.19	0.2177	0.9672	1872865	CBDivE_001467	[O-][N+](=O)c1cccc(c1)C(=O)Oc2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J08	compound treatment	1.207	0.11	1.49	1.35	0.143	1.95	2.4346	0.991	1913314	CBDivE_001468	Fc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J09	compound treatment	1.098	0.00142	0.02	1.181	-0.0257	-0.35	-0.2348	-0.6677	1913315	CBDivE_001469	O=Cc1ccc(OC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J10	compound treatment	1.061	-0.0356	-0.48	1.198	-0.00875	-0.12	-0.4238	-0.8568	1777569	CBDivE_001470	[O-][N+](=O)c1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J11	compound treatment	1.064	-0.0326	-0.44	1.199	-0.00775	-0.11	-0.3856	-0.8528	1913316	CBDivE_001471	CC(C)(C)c1ccc(OC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J12	compound treatment	1.192	0.0954	1.29	1.219	0.0123	0.17	1.0283	0.7922	1301683	CBDivE_001472	Cc1ccc(CCSc2ccc(F)cc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J13	compound treatment	1.1	0.00342	0.05	1.151	-0.0558	-0.76	-0.505	-0.663	1315243	CBDivE_001473	O=C(Oc1ccc(cc1)C2CCCCC2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J14	compound treatment	1.108	0.0114	0.15	1.153	-0.0537	-0.73	-0.4094	-0.5466	1913317	CBDivE_001474	OCCOc1ccc(cc1OCCO)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J15	compound treatment	1.023	-0.0736	-0.99	1.193	-0.0137	-0.19	-0.8345	-0.8261	1054931	CBDivE_001475	O=C(Oc1ccc(cc1)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J16	compound treatment	1.098	0.00142	0.02	1.179	-0.0277	-0.38	-0.2541	-0.6706	1913318	CBDivE_001476	O=C1N(CCNCCN2C(=O)c3ccccc3C2=O)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J17	compound treatment	1.092	-0.00458	-0.06	1.179	-0.0277	-0.38	-0.3113	-0.8119	1120472	CBDivE_001477	Cc1ccccc1OCC(=O)Oc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J18	compound treatment	1.099	0.00242	0.03	1.155	-0.0517	-0.71	-0.476	-0.6737	1913319	CBDivE_001478	NCCOc1ccccc1OCCN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J19	compound treatment	1.079	-0.0176	-0.24	1.196	-0.0107	-0.15	-0.2714	-0.9732	1913320	CBDivE_001479	O=C(Oc1ccccc1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	J20	compound treatment	1.073	-0.0236	-0.32	1.203	-0.00375	-0.05	-0.2611	-0.8104	1913321	CBDivE_001480	C1CCN=C(NC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K01	compound treatment	1.032	-0.0646	-0.87	1.242	0.0352	0.48	-0.2762	-0.2776	3105949	CBDivE_001481	CCc1nc2ccccc2c(N)c1C.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K02	compound treatment	1.148	0.0514	0.69	1.213	0.00625	0.09	0.5507	0.7881	1913322	CBDivE_001482	OCC(=O)N/N=C/c1cc(Br)cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K03	compound treatment	1.066	-0.0306	-0.41	1.172	-0.0348	-0.47	-0.6268	-0.9976	3105950	CBDivE_001483	CCCc1nc2ccccc2c(N)c1CC.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K04	compound treatment	1.094	-0.00258	-0.03	1.203	-0.00375	-0.05	-0.0608	-0.9826	1913323	CBDivE_001484	C(=N/c1ccc2nc(oc2c1)c3ccccc3)\c4c5ccccc5cc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K05	compound treatment	1.075	-0.0216	-0.29	1.191	-0.0157	-0.21	-0.3578	-0.9888	3105951	CBDivE_001485	Nc1c2CCCc2nc3CCCc31.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K06	compound treatment	1.099	0.00242	0.03	1.229	0.0223	0.3	0.2376	0.7786	1913324	CBDivE_001486	O/N=C(\Nc1ccccc1)/C(=N/O)/Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K07	compound treatment	1.136	0.0394	0.53	1.156	-0.0508	-0.69	-0.1134	-0.1299	3105952	CBDivE_001487	Nc1c2CCCc2nc3CCCCc13.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K08	compound treatment	1.086	-0.0106	-0.14	1.177	-0.0297	-0.41	-0.3878	-0.9018	1913325	CBDivE_001488	COc1cccc(/C=N/c2ccc(cc2)N3CCOCC3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K09	compound treatment	1.099	0.00242	0.03	1.273	0.0662	0.9	0.6619	0.7321	3105953	CBDivE_001489	Nc1c2CCCc2nc3ccccc13.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K10	compound treatment	1.116	0.0194	0.26	1.163	-0.0437	-0.6	-0.2366	-0.3632	1913326	CBDivE_001490	COc1ccc(NCN2C(=O)/C(=C\c3ccc(cc3)[N+](=O)[O-])/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K11	compound treatment	1.071	-0.0256	-0.35	1.205	-0.00175	-0.02	-0.2609	-0.7542	3105954	CBDivE_001491	CCc1nc2ccccc2c(N)c1C.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K12	compound treatment	1.104	0.00742	0.1	1.182	-0.0248	-0.34	-0.1679	-0.477	1913327	CBDivE_001492	FC(F)(F)C(=O)Nc1nnc([nH]1)c2nnc(NC(=O)C(F)(F)F)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K13	compound treatment	1.13	0.0334	0.45	1.175	-0.0317	-0.43	0.0126	0.0202	1913328	CBDivE_001493	[O-][N+](=O)c1ccc(/C=C/C(=O)NCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K14	compound treatment	1.096	-5.84E-4	-0.01	1.225	0.0183	0.25	0.1704	0.6844	1913329	CBDivE_001494	COc1cccc(/C=N/c2ccc3nc(oc3c2)c4ccc(Br)cc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K15	compound treatment	1.13	0.0334	0.45	1.251	0.0442	0.6	0.7454	0.9897	1913330	CBDivE_001495	OS(=O)(=O)CCCN1/C(=C\C=N\c2ccccc2)/Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K16	compound treatment	1.074	-0.0226	-0.3	1.177	-0.0297	-0.41	-0.5023	-0.99	1913331	CBDivE_001496	Oc1ccc(/C=N/c2ccc3nc(oc3c2)c4cccc(I)c4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K17	compound treatment	1.106	0.00942	0.13	1.204	-0.00275	-0.04	0.0633	0.478	1913332	CBDivE_001497	OS(=O)(=O)CCCN/1CCS\C1=C\C=N\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K18	compound treatment	1.101	0.00442	0.06	1.237	0.0303	0.41	0.3338	0.8009	1913333	CBDivE_001498	Oc1ccc(/C=N/c2ccc3nc(oc3c2)c4cccc(I)c4)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K19	compound treatment	1.042	-0.0546	-0.74	1.239	0.0323	0.44	-0.2097	-0.2445	3105959	CBDivE_001499	CCN1/C(=C\C=N\c2ccccc2)/SC(=C1c3ccccc3)c4ccccc4.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	K20	compound treatment	1.086	-0.0106	-0.14	1.252	0.0452	0.62	0.3354	0.5295	1913335	CBDivE_001500	COc1cccc(/C=N/c2ccc(NC(=O)C)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L01	compound treatment	1.073	-0.0236	-0.32	1.278	0.0712	0.97	0.462	0.4519	1913336	CBDivE_001501	CC(C)(C)c1ccc(OC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L02	compound treatment	1.132	0.0354	0.48	1.224	0.0173	0.24	0.5042	0.9467	1913337	CBDivE_001502	Cc1ccc(cc1)S(=O)(=O)N2CCOCCOCCN(CCOCCOCC2)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L03	compound treatment	1.103	0.00642	0.09	1.209	0.00225	0.03	0.0829	0.9027	1913338	CBDivE_001503	O=Cc1ccc(OC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L04	compound treatment	1.1	0.00342	0.05	1.185	-0.0217	-0.3	-0.1771	-0.5902	1913339	CBDivE_001504	C(N1CCOCCOCCN(Cc2ccccc2)CCOCCOCC1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L05	compound treatment	1.102	0.00542	0.07	1.19	-0.0168	-0.23	-0.1098	-0.4581	1913340	CBDivE_001505	[O-][N+](=O)c1ccc(OC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L06	compound treatment	1.119	0.0224	0.3	1.18	-0.0268	-0.36	-0.0441	-0.0931	1913341	CBDivE_001506	Nc1ccc(OCCO)c(OCCO)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L07	compound treatment	1.112	0.0154	0.21	1.238	0.0313	0.43	0.4484	0.9456	1913342	CBDivE_001507	COc1ccccc1OC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L08	compound treatment	1.131	0.0344	0.46	1.137	-0.0698	-0.95	-0.3443	-0.3253	1913343	CBDivE_001508	O=C(OCc1ccccc1)N2CCOCCOCCN(CCOCCOCC2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L09	compound treatment	1.045	-0.0516	-0.7	1.231	0.0243	0.33	-0.2583	-0.3352	1913344	CBDivE_001509	Nc1nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L10	compound treatment	1.055	-0.0416	-0.56	1.21	0.00325	0.04	-0.3653	-0.6492	1913345	CBDivE_001510	CC(C)(C)OC(=O)N1CCOCCOCCNCCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L11	compound treatment	1.114	0.0174	0.23	1.242	0.0352	0.48	0.506	0.9458	1913346	CBDivE_001511	OC(=O)CSc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L12	compound treatment	1.057	-0.0396	-0.53	1.223	0.0163	0.22	-0.2209	-0.3821	1913347	CBDivE_001512	OCCOc1ccc(Br)cc1OCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L13	compound treatment	1.096	-5.84E-4	-0.01	1.228	0.0213	0.29	0.1993	0.6876	1913348	CBDivE_001513	[N-]=[N+]=NS(=O)(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)N=[N+]=[N-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L14	compound treatment	1.026	-0.0706	-0.95	1.206	-7.5E-4	-0.01	-0.6806	-0.7147	1090851	CBDivE_001514	C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L15	compound treatment	1.115	0.0184	0.25	1.175	-0.0317	-0.43	-0.1305	-0.2614	1913349	CBDivE_001515	[N-]=[N+]=Nc1ccc(Sc2ccc(Oc3ccc(Sc4ccc(N=[N+]=[N-])cc4)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L16	compound treatment	1.015	-0.0816	-1.1	1.193	-0.0137	-0.19	-0.9108	-0.8158	3105995	CBDivE_001516	Nc1ccc(cc1)C(=O)O.C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L17	compound treatment	1.13	0.0334	0.45	1.215	0.00825	0.11	0.3983	0.8573	1913350	CBDivE_001517	[O-][N+](=O)c1ccc(cc1)c2nnc(o2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L18	compound treatment	1.081	-0.0156	-0.21	1.226	0.0193	0.26	0.037	0.1099	3105996	CBDivE_001518	Nc1ccccc1[N+](=O)[O-].C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L19	compound treatment	1.096	-5.84E-4	-0.01	1.178	-0.0288	-0.39	-0.2828	-0.7212	1913351	CBDivE_001519	[N-]=[N+]=Nc1ccc(cc1)S(=O)(=O)c2cccc(N=[N+]=[N-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	L20	compound treatment	1.095	-0.00158	-0.02	1.189	-0.0177	-0.24	-0.1863	-0.7666	3105997	CBDivE_001520	Nc1ccc(cc1)[N+](=O)[O-].C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M01	compound treatment	1.061	-0.0356	-0.48	1.271	0.0642	0.88	0.2801	0.2803	1913352	CBDivE_001521	C(=N/c1ccc2ncccc2c1)\c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M02	compound treatment	1.124	0.0274	0.37	1.218	0.0113	0.15	0.37	0.9241	1913353	CBDivE_001522	CC(=O)Nc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M03	compound treatment	1.055	-0.0416	-0.56	1.207	2.5E-4	0.0	-0.3943	-0.7028	1913354	CBDivE_001523	NC(=N)N/N=C/c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M04	compound treatment	1.117	0.0204	0.28	1.199	-0.00775	-0.11	0.12	0.4069	1913355	CBDivE_001524	Cc1nc(O)c(C(c2cc(ccc2O)[N+](=O)[O-])c3c(O)nc(C)nc3O)c(O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M05	compound treatment	1.083	-0.0136	-0.18	1.273	0.0662	0.9	0.5092	0.5524	1913356	CBDivE_001525	CC1=NN(C(=O)C1N=Nc2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M06	compound treatment	1.104	0.00742	0.1	1.196	-0.0107	-0.15	-0.0329	-0.1855	1913357	CBDivE_001526	Clc1cccc(c1)N(Cc2ccc(Cl)cc2Cl)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M07	compound treatment	1.043	-0.0536	-0.72	1.242	0.0352	0.48	-0.1713	-0.1973	1913358	CBDivE_001527	CC1=NN(C(=O)C1N=Nc2ccc(O)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M08	compound treatment	1.097	4.16E-4	0.01	1.222	0.0153	0.21	0.151	0.7259	1913359	CBDivE_001528	[O-][N+](=O)c1ccc-2c(Cc3cc(ccc32)C4CC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M09	compound treatment	1.076	-0.0206	-0.28	1.198	-0.00875	-0.12	-0.2807	-0.9288	1913360	CBDivE_001529	COc1cccc(N=NC2C(=NN(C2=O)c3ccccc3)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M10	compound treatment	1.104	0.00742	0.1	1.158	-0.0488	-0.66	-0.3993	-0.594	1005158	CBDivE_001530	O=C(Nc1ccccc1)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M11	compound treatment	1.093	-0.00358	-0.05	1.238	0.0313	0.43	0.2671	0.6229	1043944	CBDivE_001531	OCCN(CCO)CCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M12	compound treatment	1.113	0.0164	0.22	1.165	-0.0418	-0.57	-0.246	-0.4027	1774507	CBDivE_001532	OC(=O)c1cc(ccc1C(=O)Nc2cccc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M13	compound treatment	1.08	-0.0166	-0.22	1.213	0.00625	0.09	-0.0979	-0.4091	1913361	CBDivE_001533	COc1ccc(CCNCC(=O)c2c[nH]c3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M14	compound treatment	1.086	-0.0106	-0.14	1.208	0.00125	0.02	-0.0889	-0.6183	1774502	CBDivE_001534	Cc1ccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M15	compound treatment	1.128	0.0314	0.42	1.25	0.0432	0.59	0.7167	0.9869	1913362	CBDivE_001535	O=C(CSCC(=O)c1c[nH]c2ccccc12)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M16	compound treatment	1.104	0.00742	0.1	1.268	0.0612	0.84	0.6613	0.7862	1913363	CBDivE_001536	Cc1cccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M17	compound treatment	1.104	0.00742	0.1	1.232	0.0253	0.34	0.3142	0.8763	1913364	CBDivE_001537	Cc1[nH]c2ccccc2c1C(=O)C3NCCS3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M18	compound treatment	1.098	0.00142	0.02	1.222	0.0153	0.21	0.1606	0.7688	1913365	CBDivE_001538	OC(=O)c1cc(ccc1C(=O)Nc2ccc(O)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M19	compound treatment	1.055	-0.0416	-0.56	1.226	0.0193	0.26	-0.2111	-0.3408	1913366	CBDivE_001539	Cc1[nH]c2ccccc2c1C(=O)CN3CCSC3C(=O)c4c(C)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	M20	compound treatment	1.114	0.0174	0.23	1.196	-0.0107	-0.15	0.0625	0.2256	1774506	CBDivE_001540	OC(=O)c1cccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N01	compound treatment	1.1	0.00342	0.05	1.202	-0.00475	-0.06	-0.0132	-0.1663	1913367	CBDivE_001541	FC(F)(F)COc1nc(nc(n1)N2CCOCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N02	compound treatment	1.107	0.0104	0.14	1.192	-0.0147	-0.2	-0.0429	-0.1747	3003909	CBDivE_001542	Cc1ccc(cc1)S(=O)(=O)N.C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N03	compound treatment	1.055	-0.0416	-0.56	1.194	-0.0127	-0.17	-0.5196	-0.8847	1913368	CBDivE_001543	[N-]=[N+]=Nc1ccc(Oc2ccc(cc2)C(=O)c3ccc(Oc4ccc(N=[N+]=[N-])cc4)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N04	compound treatment	1.077	-0.0196	-0.26	1.153	-0.0537	-0.73	-0.7051	-0.905	1913369	CBDivE_001544	O=C(CCN1C(=O)c2ccccc2C1=O)N3CCOCCOCCOCCOCCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N05	compound treatment	1.063	-0.0336	-0.45	1.209	0.00225	0.03	-0.2987	-0.6577	1443022	CBDivE_001545	CC(C)(c1ccc(OC(=O)c2ccccc2)cc1)c3ccc(OC(=O)c4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N06	compound treatment	1.066	-0.0306	-0.41	1.195	-0.0117	-0.16	-0.4051	-0.9151	1913370	CBDivE_001546	O=C(CCN1C(=O)c2ccccc2C1=O)N3CCOCCOCCN(CCOCCOCC3)C(=O)CCN4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N07	compound treatment	1.045	-0.0516	-0.7	1.166	-0.0408	-0.56	-0.885	-0.9938	1913371	CBDivE_001547	CC(C)(c1ccc(OC(=O)c2cccc(c2)[N+](=O)[O-])cc1)c3ccc(OC(=O)c4cccc(c4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N08	compound treatment	1.062	-0.0346	-0.47	1.124	-0.0827	-1.13	-1.1278	-0.9236	1401777	CBDivE_001548	C1COCCNCCOCCOCCOCCN1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N09	compound treatment	1.098	0.00142	0.02	1.166	-0.0408	-0.56	-0.3794	-0.6824	1575164	CBDivE_001549	O=C(Sc1ccc(Oc2ccc(SC(=O)c3ccco3)cc2)cc1)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N10	compound treatment	1.086	-0.0106	-0.14	1.191	-0.0157	-0.21	-0.2528	-0.9803	1913372	CBDivE_001550	NC(=O)CN1CCOCCOCCN(CC(=O)N)CCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N11	compound treatment	1.101	0.00442	0.06	1.206	-7.5E-4	-0.01	0.0349	0.5773	1913373	CBDivE_001551	O=C(Sc1ccc(Sc2ccc(SC(=O)c3ccccc3)cc2)cc1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N12	compound treatment	1.033	-0.0636	-0.86	1.192	-0.0147	-0.2	-0.7488	-0.8499	1913374	CBDivE_001552	O=C(CN1CCOCCOCCN(CC(=O)Nc2ccccc2)CCOCCOCC1)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N13	compound treatment	1.047	-0.0496	-0.67	1.179	-0.0277	-0.38	-0.7406	-0.9636	1913375	CBDivE_001553	O=C(Sc1ccc(Sc2ccc(SC(=O)c3ccco3)cc2)cc1)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N14	compound treatment	1.122	0.0254	0.34	1.193	-0.0137	-0.19	0.1099	0.2811	1913376	CBDivE_001554	Cc1ccc(cc1)S(=O)(=O)N2CCOCCOCCOCCN(CCOCC2)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N15	compound treatment	1.04	-0.0566	-0.76	1.229	0.0223	0.3	-0.3252	-0.3959	1059944	CBDivE_001555	Oc1ccc(cc1)C(=O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N16	compound treatment	1.108	0.0114	0.15	1.181	-0.0257	-0.35	-0.1394	-0.3636	1913377	CBDivE_001556	CC(C)(C)C1(C)O[C@H]([C@@H](O1)C(=O)N)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N17	compound treatment	1.07	-0.0266	-0.36	1.194	-0.0127	-0.17	-0.3765	-0.9447	1913378	CBDivE_001557	Cc1ccc(cc1)C(=O)NNC(=O)c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N18	compound treatment	1.042	-0.0546	-0.74	1.229	0.0223	0.3	-0.3062	-0.3844	1913379	CBDivE_001558	CN(C)C(=O)[C@H](O)[C@@H](O)C(=O)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N19	compound treatment	1.097	4.16E-4	0.01	1.211	0.00425	0.06	0.0449	0.7719	1913380	CBDivE_001559	[O-][N+](=O)c1cccc(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	N20	compound treatment	1.091	-0.00558	-0.08	1.169	-0.0377	-0.51	-0.4173	-0.802	1913381	CBDivE_001560	Cc1ccc(cc1)S(=O)(=O)OC[C@@H]2OC(C)(C)O[C@H]2COS(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O01	compound treatment	1.02	-0.0766	-1.03	1.226	0.0193	0.26	-0.5449	-0.5112	1913382	CBDivE_001561	CC(O)(C#CCO)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O02	compound treatment	1.072	-0.0246	-0.33	1.27	0.0633	0.86	0.3754	0.4062	1774503	CBDivE_001562	OC(=O)c1ccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O03	compound treatment	0.954	-0.143	-1.92	1.2	-0.00675	-0.09	-1.4252	-0.7401	1583639	CBDivE_001563	CC(C)(O)C#CC(C)(O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O04	compound treatment	1.142	0.0454	0.61	1.222	0.0153	0.21	0.5803	0.8969	1136727	CBDivE_001564	CC1(C2C(C3c4ccccc41)C(=O)N(C2=O)c5ccc(Cl)cc5)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O05	compound treatment	1.078	-0.0186	-0.25	1.24	0.0333	0.45	0.1433	0.2766	1913383	CBDivE_001565	CC(O)(C#CC(C)(O)c1ccc2ccccc2c1)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O06	compound treatment	1.144	0.0474	0.64	1.234	0.0273	0.37	0.7151	0.9666	1913384	CBDivE_001566	OC(=O)c1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O07	compound treatment	1.118	0.0214	0.29	1.186	-0.0208	-0.28	0.0042	0.0104	1913385	CBDivE_001567	O=C1N(CC2CO2)C(=O)c3cccc4cccc1c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O08	compound treatment	1.094	-0.00258	-0.03	1.25	0.0432	0.59	0.3924	0.6641	1913386	CBDivE_001568	COc1ccc(/C=C/C2=NN(C(C2)c3ccc(OC)cc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O09	compound treatment	1.083	-0.0136	-0.18	1.285	0.0782	1.07	0.6249	0.5772	1913387	CBDivE_001569	[O-][N+](=O)c1ccc2c(NC(=O)C2(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O10	compound treatment	1.117	0.0204	0.28	1.253	0.0462	0.63	0.6407	0.931	1774513	CBDivE_001570	OC(=O)c1cccc(c1)N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O11	compound treatment	1.104	0.00742	0.1	1.201	-0.00575	-0.08	0.0153	0.1203	1913388	CBDivE_001571	[O-][N+](=O)c1ccc(C#Cc2ccc3cc4ccccc4cc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O12	compound treatment	1.133	0.0364	0.49	1.231	0.0243	0.33	0.5812	0.9814	1913389	CBDivE_001572	O=C1CS/C(=N\c2ccccc2)/N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O13	compound treatment	1.001	-0.0956	-1.29	1.197	-0.00975	-0.13	-1.0058	-0.7759	1913390	CBDivE_001573	NCCSc1c2ccccc2c(SCCN)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O14	compound treatment	1.142	0.0454	0.61	1.221	0.0143	0.19	0.5706	0.8878	1913391	CBDivE_001574	CC(=O)Nc1ccc(cc1)N2C(=O)c3ccc(N)cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O15	compound treatment	1.11	0.0134	0.18	1.207	2.5E-4	0.0	0.1304	0.7203	1913392	CBDivE_001575	Clc1ccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O16	compound treatment	1.119	0.0224	0.3	1.203	-0.00375	-0.05	0.1777	0.5793	1648014	CBDivE_001576	S=c1n(CN2CCCCC2)c3ccccc3n1CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O17	compound treatment	1.143	0.0464	0.63	1.24	0.0333	0.45	0.7634	0.9874	1913393	CBDivE_001577	ClC(Cl)(Cl)C(NC(=O)c1ccco1)NC(=S)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O18	compound treatment	1.083	-0.0136	-0.18	1.24	0.0333	0.45	0.191	0.3906	1913394	CBDivE_001578	Clc1ccc(cc1Cl)N2N=C(CC2c3ccc(Br)cc3)/C=C/c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O19	compound treatment	1.088	-0.00858	-0.12	1.189	-0.0177	-0.24	-0.253	-0.943	1529101	CBDivE_001579	Clc1ccc(NC(NC(=O)c2ccccc2)C(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	O20	compound treatment	1.096	-5.84E-4	-0.01	1.236	0.0293	0.4	0.2765	0.693	1774923	CBDivE_001580	OC(=O)c1ccc(cc1C(=O)O)C(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P01	compound treatment	1.072	-0.0246	-0.33	1.153	-0.0537	-0.73	-0.7528	-0.9357	1913395	CBDivE_001581	O=C(Nc1ccc2ccccc2c1)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P02	compound treatment	1.102	0.00542	0.07	1.232	0.0253	0.34	0.2951	0.8385	1913396	CBDivE_001582	NC(=N)Nc1nc2ccccc2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P03	compound treatment	1.013	-0.0836	-1.13	1.189	-0.0177	-0.24	-0.9685	-0.8398	1913397	CBDivE_001583	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)C(=O)Nc3cccc(c3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P04	compound treatment	1.113	0.0164	0.22	1.128	-0.0788	-1.07	-0.6027	-0.5497	1913398	CBDivE_001584	Ic1ccc2nc[nH]c(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P05	compound treatment	1.02	-0.0766	-1.03	1.158	-0.0488	-0.66	-1.2006	-0.9773	1913399	CBDivE_001585	O=C(Oc1ccc(cc1)C2(c3ccccc3-c4ccccc42)c5ccc(OC(=O)c6ccccc6)cc5)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P06	compound treatment	1.049	-0.0476	-0.64	1.177	-0.0297	-0.41	-0.7408	-0.9755	1913400	CBDivE_001586	Cc1nc2ccc(I)cc2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P07	compound treatment	1.02	-0.0766	-1.03	1.115	-0.0917	-1.25	-1.6153	-0.9955	1913401	CBDivE_001587	O=C(Oc1ccc(cc1)C2(OC(=O)c3ccccc32)c4ccc(OC(=O)c5ccccc5)cc4)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P08	compound treatment	1.166	0.0694	0.94	1.203	-0.00375	-0.05	0.626	0.6675	1913402	CBDivE_001588	Oc1ccc(/C=N/Nc2nnn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P09	compound treatment	1.074	-0.0226	-0.3	1.229	0.0223	0.3	-9.0E-4	-0.0021	1913403	CBDivE_001589	CN(C)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P10	compound treatment	1.033	-0.0636	-0.86	1.147	-0.0597	-0.81	-1.1827	-0.9997	1913404	CBDivE_001590	Nc1nnnn1/N=C/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P11	compound treatment	0.991	-0.106	-1.42	1.135	-0.0717	-0.98	-1.699	-0.9832	1913405	CBDivE_001591	[O-][N+](=O)c1cc(ccc1Cl)c2nc3ccccc3nc2c4ccc(Cl)c(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P12	compound treatment	1.127	0.0304	0.41	1.183	-0.0237	-0.32	0.0611	0.117	1913406	CBDivE_001592	Oc1ccc(/C=N/Nc2nnn[nH]2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P13	compound treatment	1.049	-0.0476	-0.64	1.188	-0.0187	-0.26	-0.6347	-0.9186	1009056	CBDivE_001593	c1ccc2nc3c4ccccc4c5ccccc5c3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P14	compound treatment	1.107	0.0104	0.14	1.173	-0.0337	-0.46	-0.2261	-0.4698	1913407	CBDivE_001594	Fc1ccccc1/C=N/Nc2nnn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P15	compound treatment	1.261	0.164	2.22	1.334	0.127	1.74	2.7954	0.9926	1913408	CBDivE_001595	CC/1CCCC\C1=N\Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P16	compound treatment	1.087	-0.00958	-0.13	1.203	-0.00375	-0.05	-0.1276	-0.9176	1913409	CBDivE_001596	Nc1nnnn1/N=C/c2ccc(O)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P17	compound treatment	1.142	0.0454	0.61	1.251	0.0442	0.6	0.8599	1.0	1315790	CBDivE_001597	Cc1ccc(cc1)C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P18	compound treatment	1.043	-0.0536	-0.72	1.181	-0.0257	-0.35	-0.7595	-0.945	1913410	CBDivE_001598	Oc1ccc(/C=N/Nc2nnn[nH]2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P19	compound treatment	1.066	-0.0306	-0.41	1.154	-0.0528	-0.72	-0.8004	-0.9652	1867038	CBDivE_001599	Oc1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.1258	P20	compound treatment	1.079	-0.0176	-0.24	1.227	0.0203	0.28	0.0275	0.0756	1913411	CBDivE_001600	Nc1nnnn1/N=C/c2ccc(O)c(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A01	compound treatment	1.098	-0.0299	-0.4	1.219	0.0541	0.74	0.2363	0.2808	1914921	CBDivE_003841	S=C(Nc1ccccc1)Nc2cccc3c(NC(=S)Nc4ccccc4)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A02	compound treatment	1.067	-0.0609	-0.82	1.233	0.0681	0.93	0.0756	0.0609	1052229	CBDivE_003842	CCOC(=O)C1N2CCC(CC2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A03	compound treatment	1.118	-0.00995	-0.13	1.222	0.0571	0.78	0.456	0.5768	1914922	CBDivE_003843	Cc1cc(ccc1/N=C\c2ccccc2[N+](=O)[O-])c3ccc(/N=C\c4ccccc4[N+](=O)[O-])c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A04	compound treatment	1.145	0.0171	0.23	1.214	0.0491	0.67	0.6365	0.8984	1914923	CBDivE_003844	CN(C(=O)COc1ccccc1)c2ccc(cc2)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A05	compound treatment	0.94	-0.188	-2.54	1.2	0.0351	0.48	-1.4541	-0.5635	1003597	CBDivE_003845	Oc1cc2oc3cc(=O)c(O)cc3c(c4ccccc4)c2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A06	compound treatment	1.152	0.0241	0.32	1.175	0.0101	0.14	0.3272	0.9276	1914924	CBDivE_003846	COc1ccc(N/C=C(\[N+](=O)[O-])/c2cc(O)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A07	compound treatment	1.131	0.00305	0.04	1.192	0.0271	0.37	0.2908	0.781	1914925	CBDivE_003847	Cc1ccc2n3CCN(N=O)C4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A08	compound treatment	1.176	0.0481	0.65	1.181	0.0161	0.22	0.614	0.8968	1058931	CBDivE_003848	CC(=O)N1C(=O)C2(Nc3ccccc3N2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A09	compound treatment	1.087	-0.0409	-0.55	1.148	-0.0169	-0.23	-0.5532	-0.9246	1914926	CBDivE_003849	OC(=O)c1nc(Cl)c(Cl)c(N=Nc2c(Cl)c(Cl)nc(C(=O)O)c2Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A10	compound treatment	1.15	0.0221	0.3	1.202	0.0371	0.51	0.5684	0.9679	3105756	CBDivE_003850	CCCCc1nc2ccccc2c(N)c1CCC.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A11	compound treatment	1.125	-0.00295	-0.04	1.174	0.00913	0.12	0.06	0.4586	1141613	CBDivE_003851	O=C(Nc1nccs1)OCC2c3ccccc3-c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A12	compound treatment	1.19	0.0621	0.84	1.247	0.0821	1.12	1.3839	0.9897	1914927	CBDivE_003852	CCOC(=O)c1c(C)c(C)sc1NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A13	compound treatment	1.153	0.0251	0.34	1.205	0.0401	0.55	0.626	0.9732	1914928	CBDivE_003853	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)cc2)N(C(=O)N1CC(=O)N/N=C\C=C/c3ccc(o3)[N+](=O)[O-])c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A14	compound treatment	1.16	0.0321	0.43	1.126	-0.0389	-0.53	-0.069	-0.1009	1240764	CBDivE_003854	Oc1ccccc1C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A15	compound treatment	1.058	-0.0699	-0.94	1.207	0.0421	0.57	-0.261	-0.2362	1914929	CBDivE_003855	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4cc(Br)ccc4O)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A16	compound treatment	1.213	0.0851	1.15	1.169	0.00413	0.06	0.8512	0.741	1569678	CBDivE_003856	CC1(C)C(C(c2ccccc2)S1(=O)=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A17	compound treatment	0.933	-0.195	-2.63	1.193	0.0281	0.38	-1.5884	-0.5976	1914930	CBDivE_003857	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccccc3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A18	compound treatment	1.175	0.0471	0.63	1.181	0.0161	0.22	0.6044	0.8997	1241220	CBDivE_003858	COc1cc2CCNC(c3cccc(O)c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A19	compound treatment	0.768	-0.36	-4.86	1.223	0.0581	0.79	-2.8731	-0.5839	1774290	CBDivE_003859	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2sc3CCCCc3c2C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	A20	compound treatment	1.129	0.00105	0.01	1.207	0.0421	0.57	0.4163	0.7244	1914931	CBDivE_003860	CC(=O)c1ccc(NC(=O)Cn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B01	compound treatment	1.155	0.0271	0.36	1.2	0.0351	0.48	0.5969	0.991	1785251	CBDivE_003861	COc1ccc2[nH]cc(CCNC(=O)c3ccc(cc3)[N+](=O)[O-])c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B02	compound treatment	1.157	0.0291	0.39	1.136	-0.0289	-0.39	-0.0012	-0.0021	1914932	CBDivE_003862	COc1ccc(/C=N/c2ccc(O)c(c2)C(=O)O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B03	compound treatment	1.121	-0.00695	-0.09	1.136	-0.0289	-0.39	-0.3446	-0.8517	1914933	CBDivE_003863	CCc1cc(/C=N/C2CCCCC2)c(O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B04	compound treatment	1.197	0.0691	0.93	1.232	0.0671	0.92	1.3061	1.0	1914934	CBDivE_003864	[O-][N+](=O)c1ccc(cc1)C(=O)CC(NC(=O)Nc2ccc(Cl)c(Cl)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B05	compound treatment	1.143	0.0151	0.2	1.172	0.00713	0.1	0.2124	0.9432	1914935	CBDivE_003865	CC(=O)C[n+]1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B06	compound treatment	1.144	0.0161	0.22	1.146	-0.0189	-0.26	-0.0288	-0.0856	1914936	CBDivE_003866	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B07	compound treatment	1.085	-0.0429	-0.58	1.2	0.0351	0.48	-0.0709	-0.0943	1589237	CBDivE_003867	CCOC(=O)c1c(N)sc2c(OC)c(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B08	compound treatment	1.213	0.0851	1.15	1.147	-0.0179	-0.24	0.6391	0.5448	1914937	CBDivE_003868	CCN(CCO)c1ccc(N=Nc2nc3ccc(OC)cc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B09	compound treatment	1.082	-0.0459	-0.62	1.152	-0.0129	-0.18	-0.5624	-0.873	1914938	CBDivE_003869	Cc1cccc(c1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B10	compound treatment	1.151	0.0231	0.31	1.19	0.0251	0.34	0.4623	0.9988	1360855	CBDivE_003870	Cc1ccc2n(CCN3C(=O)c4ccccc4C3=O)c5C(=O)CCCc5c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B11	compound treatment	1.051	-0.0769	-1.04	1.123	-0.0419	-0.57	-1.1377	-0.9603	1914939	CBDivE_003871	CC(=O)OCc1c(C)cc(C)c(/C=N/NC(=O)N)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B12	compound treatment	1.161	0.0331	0.45	1.13	-0.0349	-0.48	-0.0209	-0.032	1114912	CBDivE_003872	NNC(=O)CNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B13	compound treatment	1.146	0.0181	0.24	1.167	0.00213	0.03	0.1928	0.786	1097975	CBDivE_003873	COc1ccc(cc1)C(=O)CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B14	compound treatment	1.071	-0.0569	-0.77	1.209	0.0441	0.6	-0.1177	-0.1206	1914940	CBDivE_003874	CCc1ccc(/C=C(/NC(=O)c2ccccc2)\C(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B15	compound treatment	1.167	0.0391	0.53	1.192	0.0271	0.37	0.6342	0.9851	1545939	CBDivE_003875	COc1ccc2cc(C(=O)O)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B16	compound treatment	1.162	0.0341	0.46	1.125	-0.0399	-0.54	-0.0596	-0.0837	1258399	CBDivE_003876	CC(=O)OC1CSCC1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B17	compound treatment	1.141	0.0131	0.18	1.128	-0.0369	-0.5	-0.231	-0.4336	1619738	CBDivE_003877	Cc1cc(C)c(c(C)c1)n2cccc2CNC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B18	compound treatment	1.144	0.0161	0.22	1.149	-0.0159	-0.22	2.0E-4	5.0E-4	1478451	CBDivE_003878	Cc1cc(C(=O)O)c(CCCN)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B19	compound treatment	1.175	0.0471	0.63	1.21	0.0451	0.62	0.8841	0.9999	1914941	CBDivE_003879	Clc1ccc(N=NNc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	B20	compound treatment	1.154	0.0261	0.35	1.147	-0.0179	-0.24	0.0763	0.1783	3105762	CBDivE_003880	CC1=NCCn2cccc12.OC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C01	compound treatment	1.059	-0.0689	-0.93	1.181	0.0161	0.22	-0.5021	-0.5253	1914943	CBDivE_003881	CC(C)c1cc(c(C)cc1O)C2(OC(=O)c3ccccc32)c4cc(C(C)C)c(OC(=O)c5cccc(C)c5)cc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C02	compound treatment	1.164	0.0361	0.49	1.219	0.0541	0.74	0.8659	0.9795	1709021	CBDivE_003882	COc1cccc2oc(c(Br)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C03	compound treatment	1.119	-0.00895	-0.12	1.14	-0.0249	-0.34	-0.3251	-0.9033	1914944	CBDivE_003883	OC(C1CC2CCN1CC2C=C)c3cc[n+](Cc4ccccc4)c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C04	compound treatment	1.154	0.0261	0.35	1.171	0.00613	0.08	0.3077	0.8516	1914945	CBDivE_003884	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(C)(C)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C05	compound treatment	1.109	-0.0189	-0.26	1.17	0.00513	0.07	-0.1312	-0.4952	1914946	CBDivE_003885	Oc1c(Cl)cc(Cl)cc1/C=N\c2ccc(Cc3ccc(/N=C\c4cc(Cl)cc(Cl)c4O)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C06	compound treatment	1.152	0.0241	0.32	1.199	0.0341	0.47	0.5586	0.9844	1334185	CBDivE_003886	O=C(CN1CCCC1=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C07	compound treatment	1.113	-0.0149	-0.2	1.119	-0.0459	-0.63	-0.5848	-0.89	1527682	CBDivE_003887	CCN(CC)CCN1CCn2c3C1CCCc3c4cc(C)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C08	compound treatment	1.135	0.00705	0.1	1.206	0.0411	0.56	0.4639	0.8154	1536508	CBDivE_003888	CC(=O)NCc1cccc(CNC(=O)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C09	compound treatment	1.125	-0.00295	-0.04	1.128	-0.0369	-0.5	-0.3836	-0.7606	1914947	CBDivE_003889	COc1cccc(/C=C/C2=NN(C(C2)c3cccc(OC)c3OC)c4cccc(Cl)c4)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C10	compound treatment	1.128	5.33E-5	0.0	1.144	-0.0209	-0.28	-0.2007	-0.7053	3007298	CBDivE_003890	CCCc1nc2ccccc2c(N)c1CC.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C11	compound treatment	1.131	0.00305	0.04	1.159	-0.00587	-0.08	-0.0274	-0.3049	1914948	CBDivE_003891	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C12	compound treatment	1.17	0.0421	0.57	1.233	0.0681	0.93	1.0581	0.972	1774288	CBDivE_003892	CCOC(=O)c1c(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C13	compound treatment	1.088	-0.0399	-0.54	1.15	-0.0149	-0.2	-0.5244	-0.9108	1914949	CBDivE_003893	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)cc2)N(C(=O)N1CC(=O)N/N=C/3\CCCc4c3no[n+]4[O-])c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C14	compound treatment	1.133	0.00505	0.07	1.181	0.0161	0.22	0.2038	0.8847	1474112	CBDivE_003894	Cc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C15	compound treatment	1.139	0.0111	0.15	1.165	1.34E-4	0.0	0.1067	0.7157	1914950	CBDivE_003895	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4ccccc4O)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C16	compound treatment	1.191	0.0631	0.85	1.173	0.00813	0.11	0.6799	0.7926	1914951	CBDivE_003896	Fc1ccccc1/C=C\2/S/C(=N/c3ccccc3)/NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C17	compound treatment	1.136	0.00805	0.11	1.153	-0.0119	-0.16	-0.0376	-0.1929	1914952	CBDivE_003897	OCCOCCNC(=S)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C18	compound treatment	1.064	-0.0639	-0.86	1.175	0.0101	0.14	-0.5123	-0.5864	1914953	CBDivE_003898	COc1cc(cc(OC)c1OC)C2NCCc3cc(OC)c(OC)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C19	compound treatment	1.141	0.0131	0.18	1.185	0.0201	0.27	0.3187	0.977	1199318	CBDivE_003899	COc1ccc(CCc2nc(C)cc(CN(C)C)c2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	C20	compound treatment	1.161	0.0331	0.45	1.172	0.00713	0.1	0.3841	0.8416	1914954	CBDivE_003900	CC(=O)c1ccc(NC(=O)Cn2nc(C)cc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D01	compound treatment	1.106	-0.0219	-0.3	1.171	0.00613	0.08	-0.1502	-0.4882	1294614	CBDivE_003901	Cc1ccc(cc1)S(=O)(=O)N(Cc2ccccc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D02	compound treatment	1.147	0.0191	0.26	1.125	-0.0399	-0.54	-0.2026	-0.337	1914955	CBDivE_003902	COc1ccc(/C=N/NC(=O)CCC2(O)CCCC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D03	compound treatment	1.096	-0.0319	-0.43	1.158	-0.00687	-0.09	-0.371	-0.8411	1914956	CBDivE_003903	Oc1c(C(=O)Nc2cccc(c2)[N+](=O)[O-])c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D04	compound treatment	1.081	-0.0469	-0.63	1.139	-0.0259	-0.35	-0.6972	-0.9618	1914957	CBDivE_003904	OC(CC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D05	compound treatment	1.151	0.0231	0.31	1.186	0.0211	0.29	0.4237	0.9993	1914958	CBDivE_003905	CCc1[n+](CC(=O)C)ccn2c(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D06	compound treatment	1.09	-0.0379	-0.51	1.111	-0.0539	-0.73	-0.8814	-0.9844	1914959	CBDivE_003906	C/C(=N\NC(=O)Cc1ccccc1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D07	compound treatment	1.149	0.0211	0.28	1.169	0.00413	0.06	0.2407	0.8312	1245575	CBDivE_003907	CCOC(=O)c1c(N)sc2C(=O)CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D08	compound treatment	1.152	0.0241	0.32	1.191	0.0261	0.36	0.4815	0.9989	1088274	CBDivE_003908	CC(=O)Oc1cccc2C(=O)c3cccc(OC(=O)C)c3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D09	compound treatment	1.11	-0.0179	-0.24	1.17	0.00513	0.07	-0.1217	-0.4828	1914960	CBDivE_003909	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D10	compound treatment	1.19	0.0621	0.84	1.143	-0.0219	-0.3	0.3811	0.4289	1199841	CBDivE_003910	COc1ccc(cc1OC)C2Nc3ccccc3NC4=C2C(=O)NC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D11	compound treatment	1.138	0.0101	0.14	1.08	-0.0849	-1.16	-0.7224	-0.62	1914961	CBDivE_003911	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4cccc(c4)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D12	compound treatment	1.113	-0.0149	-0.2	1.154	-0.0109	-0.15	-0.2474	-0.9885	1914962	CBDivE_003912	NNC(=O)c1ccc(OCc2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D13	compound treatment	1.176	0.0481	0.65	1.185	0.0201	0.27	0.6525	0.9269	1914963	CBDivE_003913	Cc1cc2/C(=N\NC(=O)c3ccccc3O)/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D14	compound treatment	1.129	0.00105	0.01	1.161	-0.00387	-0.05	-0.0272	-0.4987	1914964	CBDivE_003914	Cc1cc(N=Nc2c(O)ccc3ccccc23)c(CCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D15	compound treatment	1.157	0.0291	0.39	1.133	-0.0319	-0.43	-0.0301	-0.0515	1914965	CBDivE_003915	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D16	compound treatment	1.143	0.0151	0.2	1.137	-0.0279	-0.38	-0.1251	-0.2903	1038787	CBDivE_003916	OC(=O)C#Cc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D17	compound treatment	1.154	0.0261	0.35	1.144	-0.0209	-0.28	0.0473	0.1047	1774792	CBDivE_003917	CCCOC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D18	compound treatment	1.149	0.0211	0.28	1.173	0.00813	0.11	0.2793	0.9159	1914966	CBDivE_003918	Cc1ccc2[nH]c3/C(=N/O)/CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D19	compound treatment	1.115	-0.0129	-0.17	1.21	0.0451	0.62	0.3117	0.4872	1914967	CBDivE_003919	Cc1cc(O)c(C(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	D20	compound treatment	1.17	0.0421	0.57	1.154	-0.0109	-0.15	0.2964	0.5055	1642280	CBDivE_003920	COc1ccc(cc1)C2=NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E01	compound treatment	1.137	0.00905	0.12	1.177	0.0121	0.17	0.2034	0.9888	1914968	CBDivE_003921	Nc1nc(nc2sc3CCCCc3c12)C(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E02	compound treatment	1.185	0.0571	0.77	1.177	0.0121	0.17	0.6613	0.8399	1914969	CBDivE_003922	COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccccc3)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E03	compound treatment	1.126	-0.00195	-0.03	1.143	-0.0219	-0.3	-0.2294	-0.7664	1616916	CBDivE_003923	Brc1ccc(cc1)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E04	compound treatment	1.178	0.0501	0.68	1.213	0.0481	0.66	0.9416	0.9999	1914970	CBDivE_003924	NC(=N)Nc1nc(O)c2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E05	compound treatment	1.136	0.00805	0.11	1.153	-0.0119	-0.16	-0.0376	-0.1929	1914971	CBDivE_003925	COc1cc(OC)nc(NC(=O)Nc2cccc(Cl)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E06	compound treatment	1.191	0.0631	0.85	1.177	0.0121	0.17	0.7185	0.8291	1914972	CBDivE_003926	[O-][N+](=O)c1ccc(NN/C=N\C(=O)CN2CCCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E07	compound treatment	1.056	-0.0719	-0.97	1.185	0.0201	0.27	-0.4922	-0.4879	1914973	CBDivE_003927	OC(=O)/C=C/C(=O)Nc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E08	compound treatment	1.153	0.0251	0.34	1.173	0.00813	0.11	0.3174	0.8923	1226709	CBDivE_003928	CN(C)Cc1c(O)ccc2occ(C(O)c3ccc(C)cc3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E09	compound treatment	1.204	0.0761	1.03	1.143	-0.0219	-0.3	0.5147	0.4817	1914974	CBDivE_003929	COc1cccc(/C=C/C2=NN(C(C2)c3cccc(OC)c3OC)c4cccc(F)c4)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E10	compound treatment	1.11	-0.0179	-0.24	1.192	0.0271	0.37	0.0904	0.2045	1914975	CBDivE_003930	N/N=C\1/CC(Cc2n[nH]c(=O)cc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E11	compound treatment	1.065	-0.0629	-0.85	1.131	-0.0339	-0.46	-0.927	-0.959	1914976	CBDivE_003931	CC1(C)C(N(O)C(=O)Nc2ccccc2)N(C(=O)N1CC(=O)N/N=C\c3ccc(cc3)[N+](=O)[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E12	compound treatment	1.104	-0.0239	-0.32	1.21	0.0451	0.62	0.2068	0.2975	1686828	CBDivE_003932	CC(C)NC(=O)c1c(C)c(C)sc1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E13	compound treatment	1.039	-0.0889	-1.2	1.203	0.0381	0.52	-0.4808	-0.3676	1914977	CBDivE_003933	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4cccc(c4)[N+](=O)[O-])c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E14	compound treatment	1.128	5.33E-5	0.0	1.241	0.0761	1.04	0.7346	0.7076	1914978	CBDivE_003934	Oc1ccc(Br)cc1/C=N/NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E15	compound treatment	1.12	-0.00795	-0.11	1.201	0.0361	0.49	0.2726	0.5406	1666555	CBDivE_003935	Cc1cccc(C)c1NC(=O)C2(CCCC2)NC(=O)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E16	compound treatment	1.08	-0.0479	-0.65	1.182	0.0171	0.23	-0.2922	-0.4248	1914979	CBDivE_003936	COc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E17	compound treatment	1.113	-0.0149	-0.2	1.119	-0.0459	-0.63	-0.5848	-0.89	1914980	CBDivE_003937	O=C/1Nc2ccccc2\C1=N\c3ccc(cc3)c4ccc(/N=C/5\C(=O)Nc6ccccc56)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E18	compound treatment	1.105	-0.0229	-0.31	1.139	-0.0259	-0.35	-0.4683	-0.9979	1298140	CBDivE_003938	COc1cc2CCNC(c3ccc4OCOc4c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E19	compound treatment	1.116	-0.0119	-0.16	1.139	-0.0259	-0.35	-0.3634	-0.937	1914981	CBDivE_003939	Cc1cc(ccc1/N=C/2\C(=O)Nc3ccccc23)c4ccc(/N=C/5\C(=O)Nc6ccccc56)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	E20	compound treatment	1.094	-0.0339	-0.46	1.162	-0.00287	-0.04	-0.3515	-0.7647	1914982	CBDivE_003940	CC(=O)c1ccc(NC(=O)CN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F01	compound treatment	1.05	-0.0779	-1.05	1.137	-0.0279	-0.38	-1.0123	-0.9053	1914983	CBDivE_003941	OS(=O)(=O)SCC(=O)N1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F02	compound treatment	1.102	-0.0259	-0.35	1.155	-0.00987	-0.13	-0.3426	-0.9137	1914984	CBDivE_003942	OC(OCc1ccc(o1)C(O)(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F03	compound treatment	1.096	-0.0319	-0.43	1.142	-0.0229	-0.31	-0.5252	-0.9874	1914985	CBDivE_003943	CN(C)CCC(=O)/C(=C/c1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F04	compound treatment	1.12	-0.00795	-0.11	1.152	-0.0129	-0.18	-0.1999	-0.9721	1914986	CBDivE_003944	OC(CC(O)C(Cl)(Cl)Cl)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F05	compound treatment	1.177	0.0491	0.66	1.169	0.00413	0.06	0.5078	0.7646	1512828	CBDivE_003945	COc1ccc2[nH]c3C(=O)NCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F06	compound treatment	1.14	0.0121	0.16	1.127	-0.0379	-0.52	-0.2501	-0.4621	1914987	CBDivE_003946	C/C(=N\NC(=O)c1ccncc1)/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F07	compound treatment	1.131	0.00305	0.04	1.123	-0.0419	-0.57	-0.3746	-0.6544	1521553	CBDivE_003947	CCOC(=O)c1c(N)sc2c(N)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F08	compound treatment	1.158	0.0301	0.41	1.16	-0.00487	-0.07	0.2398	0.5836	1914988	CBDivE_003948	O=C(Oc1ccc(/C=N/c2cccc3ccccc23)cc1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F09	compound treatment	1.159	0.0311	0.42	1.165	1.34E-4	0.0	0.2975	0.7102	1343506	CBDivE_003949	Cc1ccc(NC(=O)c2ccccc2C(=O)O)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F10	compound treatment	1.114	-0.0139	-0.19	1.174	0.00913	0.12	-0.045	-0.1993	1914989	CBDivE_003950	CC1(C)Cc2c(cnn2c3ccc(cc3)[N+](=O)[O-])-c4[nH]c5ccccc5c41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F11	compound treatment	1.137	0.00905	0.12	1.13	-0.0349	-0.48	-0.2498	-0.5089	1914990	CBDivE_003951	Cc1cccc(c1)N2C(=O)CC(N3CCN(CC3)c4cccc(c4)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F12	compound treatment	1.118	-0.00995	-0.13	1.102	-0.0629	-0.86	-0.7011	-0.808	1914991	CBDivE_003952	COc1ccc(C[C@@H]2NCC[C@]3(O)CCCC[C@H]23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F13	compound treatment	1.125	-0.00295	-0.04	1.201	0.0361	0.49	0.3203	0.648	1914992	CBDivE_003953	CC(C)CC(N(Cc1ccccc1)Cc2ccccc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F14	compound treatment	1.157	0.0291	0.39	1.193	0.0281	0.38	0.5484	0.9999	1914993	CBDivE_003954	COC(=O)CCC(=O)c1cc(sc1C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F15	compound treatment	1.163	0.0351	0.47	1.101	-0.0639	-0.87	-0.2814	-0.284	1914994	CBDivE_003955	COc1ccc(/C=N/NC(=O)c2ccncc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F16	compound treatment	1.121	-0.00695	-0.09	1.16	-0.00487	-0.07	-0.1132	-0.9857	1914995	CBDivE_003956	Clc1ccc(OCC(=O)ON=C2CCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F17	compound treatment	1.135	0.00705	0.1	1.108	-0.0569	-0.78	-0.481	-0.6157	1914996	CBDivE_003957	CNC(=O)c1cc([N+](=O)[O-])c(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F18	compound treatment	1.161	0.0331	0.45	1.203	0.0381	0.52	0.683	0.9971	1230490	CBDivE_003958	Cc1ccc2n3CCN(C=O)C4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F19	compound treatment	1.158	0.0301	0.41	1.132	-0.0329	-0.45	-0.0302	-0.05	1914997	CBDivE_003959	COc1ccc(O)c(/C=C/C(=O)c2c(O)cc(C)oc2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	F20	compound treatment	1.139	0.0111	0.15	1.191	0.0261	0.36	0.3574	0.9252	1914998	CBDivE_003960	CCOC(=O)c1c(/N=C/c2cccc(c2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G01	compound treatment	1.07	-0.0579	-0.78	1.159	-0.00587	-0.08	-0.6093	-0.7754	1914999	CBDivE_003961	[O-][N+](=O)c1ccc(/C=N/c2ccc(Cc3ccc(\N=C\c4ccc(cc4)[N+](=O)[O-])cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G02	compound treatment	1.131	0.00305	0.04	1.17	0.00513	0.07	0.0786	0.968	1915000	CBDivE_003962	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(OC)c(OC)c3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G03	compound treatment	1.197	0.0691	0.93	1.16	-0.00487	-0.07	0.6118	0.6551	1915001	CBDivE_003963	C/C(=N/NC(=O)NC1=CCCC=C1)/c2cccc(c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G04	compound treatment	1.087	-0.0409	-0.55	1.167	0.00213	0.03	-0.37	-0.6689	1915002	CBDivE_003964	CNC(=O)N(O)C1N(NC(=O)Nc2ccccc2)C(=S)SC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G05	compound treatment	1.168	0.0401	0.54	1.122	-0.0429	-0.58	-0.0312	-0.0393	1915003	CBDivE_003965	C/C(=N/NC(=O)c1cc2ccccc2cc1O)/c3cccc(c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G06	compound treatment	1.126	-0.00195	-0.03	1.196	0.0311	0.42	0.2816	0.6621	1915004	CBDivE_003966	[O-][N+](=O)c1ccc(NN/C=N/C(=O)CN2CCCC2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G07	compound treatment	1.106	-0.0219	-0.3	1.161	-0.00387	-0.05	-0.2466	-0.8201	1915005	CBDivE_003967	COc1ccccc1/C=C/C2=NN(C(C2)c3ccccc3OC)c4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G08	compound treatment	1.102	-0.0259	-0.35	1.184	0.0191	0.26	-0.063	-0.1443	1576240	CBDivE_003968	CN(C)Cc1c(O)ccc2occ(C(O)c3ccccc3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G09	compound treatment	1.08	-0.0479	-0.65	1.168	0.00313	0.04	-0.4272	-0.6589	1335094	CBDivE_003969	OC(=O)CCC(=O)N1CCN(CC1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G10	compound treatment	1.085	-0.0429	-0.58	1.186	0.0211	0.29	-0.2059	-0.3182	1915006	CBDivE_003970	COc1ccc(NC2=CC(=O)NC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G11	compound treatment	1.16	0.0321	0.43	1.169	0.00413	0.06	0.3456	0.7926	1915007	CBDivE_003971	C1C(N(N=C1/C=C/c2cccs2)c3ccccc3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G12	compound treatment	1.073	-0.0549	-0.74	1.167	0.00213	0.03	-0.5036	-0.6788	1915008	CBDivE_003972	CCOC(=O)c1c(NC(=O)CN(C)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G13	compound treatment	1.097	-0.0309	-0.42	1.142	-0.0229	-0.31	-0.5157	-0.9897	1915009	CBDivE_003973	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4ccc(cc4)[N+](=O)[O-])c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G14	compound treatment	1.16	0.0321	0.43	1.195	0.0301	0.41	0.5963	0.9997	1915010	CBDivE_003974	CCN(CC)c1ccc(/C=N/N(Cc2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G15	compound treatment	1.154	0.0261	0.35	1.179	0.0141	0.19	0.3848	0.96	1915011	CBDivE_003975	CN(C)C1(CCCCC1)c2nnnn2c3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G16	compound treatment	1.205	0.0771	1.04	1.155	-0.00987	-0.13	0.6399	0.6105	1915012	CBDivE_003976	[O-][N+](=O)c1ccc(/C=C\2/S\C(=N/c3ccccc3)\N(C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G17	compound treatment	1.147	0.0191	0.26	1.111	-0.0539	-0.73	-0.3376	-0.4339	1915013	CBDivE_003977	Cc1cc2/C(=C/c3cccs3)/OC(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G18	compound treatment	1.165	0.0371	0.5	1.175	0.0101	0.14	0.4512	0.87	1915014	CBDivE_003978	[O-][N+](=O)c1ccc(cc1)C(=O)OCCC2(C(=O)c3ccccc3C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G19	compound treatment	1.173	0.0451	0.61	1.186	0.0211	0.29	0.6336	0.9419	1915015	CBDivE_003979	O=C/1Nc2ccccc2\C1=N\c3cccc4c(/N=C/5\C(=O)Nc6ccccc56)cccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	G20	compound treatment	1.232	0.104	1.4	1.205	0.0401	0.55	1.3796	0.9157	1915016	CBDivE_003980	O=C(N/N=C(/N=C/c1cccs1)\c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H01	compound treatment	1.115	-0.0129	-0.17	1.196	0.0311	0.42	0.1767	0.3849	1479057	CBDivE_003981	CC(C)Oc1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H02	compound treatment	1.103	-0.0249	-0.34	1.103	-0.0619	-0.84	-0.8345	-0.9188	1915017	CBDivE_003982	Cc1ccc(N[C@H]2CS(=O)(=O)C[C@H]2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H03	compound treatment	1.13	0.00205	0.03	1.115	-0.0499	-0.68	-0.4612	-0.6777	1466610	CBDivE_003983	CC1CC(OC(=O)c2ccccc2)(C(C)CN1C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H04	compound treatment	1.151	0.0231	0.31	1.156	-0.00887	-0.12	0.1344	0.4029	1915018	CBDivE_003984	OC(C(Br)C(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H05	compound treatment	1.124	-0.00395	-0.05	1.175	0.0101	0.14	0.0601	0.4056	1915019	CBDivE_003985	COC(=O)CCCc1c2ccccc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H06	compound treatment	1.063	-0.0649	-0.88	1.171	0.00613	0.08	-0.5604	-0.6367	1915020	CBDivE_003986	[O-][N+](=O)c1cccc(/C=N/NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H07	compound treatment	1.156	0.0281	0.38	1.158	-0.00687	-0.09	0.2014	0.5166	1915021	CBDivE_003987	CCOC(=O)c1c(N)sc2/C(=N\O)/CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H08	compound treatment	1.161	0.0331	0.45	1.15	-0.0149	-0.2	0.172	0.3511	1686311	CBDivE_003988	Cn1c(=O)[nH]c(=O)c2n3CCSc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H09	compound treatment	1.141	0.0131	0.18	1.101	-0.0639	-0.87	-0.4913	-0.5529	1915022	CBDivE_003989	Cc1cc(C)c(/C=N/NC(=O)N)c(C)c1Cc2c(C)cc(C)c(/C=N/NC(=O)N)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H10	compound treatment	1.146	0.0181	0.24	1.173	0.00813	0.11	0.2507	0.9366	1481219	CBDivE_003990	CC(Oc1cccc2ccccc12)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H11	compound treatment	1.139	0.0111	0.15	1.172	0.00713	0.1	0.1742	0.9786	1915023	CBDivE_003991	COc1ccccc1N2C(=O)CC(N3CCN(CC3)c4cccc(c4)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H12	compound treatment	1.131	0.00305	0.04	1.094	-0.0709	-0.97	-0.6542	-0.6764	1915024	CBDivE_003992	Oc1ccc(cc1/C=N/NC(=O)c2ccccc2OCc3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H13	compound treatment	1.135	0.00705	0.1	1.09	-0.0749	-1.02	-0.6546	-0.6384	1538947	CBDivE_003993	CCCC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H14	compound treatment	1.162	0.0341	0.46	1.191	0.0261	0.36	0.5768	0.9921	1915025	CBDivE_003994	OC(=O)CCCCC1CCNC(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H15	compound treatment	1.108	-0.0199	-0.27	1.145	-0.0199	-0.27	-0.3818	-1.0	1915026	CBDivE_003995	COc1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H16	compound treatment	1.279	0.151	2.04	1.272	0.107	1.46	2.474	0.9867	1915027	CBDivE_003996	O/N=C(\C(=O)O)/c1ccc(CCc2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H17	compound treatment	1.128	5.33E-5	0.0	1.126	-0.0389	-0.53	-0.3742	-0.7061	1915028	CBDivE_003997	Cc1c(cc(cc1[N+](=O)[O-])C(=O)NCc2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H18	compound treatment	1.142	0.0141	0.19	1.165	1.34E-4	0.0	0.1354	0.7139	1027930	CBDivE_003998	Oc1ccccc1N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H19	compound treatment	1.075	-0.0529	-0.71	1.11	-0.0549	-0.75	-1.0341	-0.9997	1915029	CBDivE_003999	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4cc(Cl)cc(Cl)c4O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	H20	compound treatment	1.185	0.0571	0.77	1.184	0.0191	0.26	0.7288	0.8967	1915030	CBDivE_004000	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I01	compound treatment	0.935	-0.193	-2.6	1.242	0.0771	1.05	-1.0968	-0.3907	1003597	CBDivE_004001	Oc1cc2oc3cc(=O)c(O)cc3c(c4ccccc4)c2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I02	compound treatment	1.149	0.0211	0.28	1.261	0.0961	1.31	1.1278	0.8408	1915031	CBDivE_004002	COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(OC)c(OC)c3)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I03	compound treatment	1.113	-0.0149	-0.2	1.189	0.0241	0.33	0.0901	0.2335	1915032	CBDivE_004003	Cc1c(Cl)c(C)c(C#[N+][O-])c(C)c1Cc2c(C)c(Cl)c(C)c(C#[N+][O-])c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I04	compound treatment	1.132	0.00405	0.05	1.143	-0.0219	-0.3	-0.1722	-0.568	1222664	CBDivE_004004	CN1C(=O)N(C(NC(=O)Nc2ccc(Cl)c(Cl)c2)C1(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I05	compound treatment	1.084	-0.0439	-0.59	1.092	-0.0729	-0.99	-1.1218	-0.9695	1915033	CBDivE_004005	[O-][N+](=O)c1cccc(/C=N/c2ccc(Cc3ccc(\N=C\c4cccc(c4)[N+](=O)[O-])cc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I06	compound treatment	1.11	-0.0179	-0.24	1.188	0.0231	0.32	0.0519	0.1304	1624938	CBDivE_004006	O=C1CCCN1CCNC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I07	compound treatment	1.154	0.0261	0.35	1.132	-0.0329	-0.45	-0.0684	-0.12	1775034	CBDivE_004007	COc1ccccc1/C=C/C2=NN(C(C2)c3ccccc3OC)c4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I08	compound treatment	1.107	-0.0209	-0.28	1.142	-0.0229	-0.31	-0.4203	-0.9988	1611337	CBDivE_004008	COc1ccc2occ(C(O)c3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I09	compound treatment	1.117	-0.0109	-0.15	1.173	0.00813	0.11	-0.026	-0.1407	1915034	CBDivE_004009	CC(NC(=O)c1ccc(Cl)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I10	compound treatment	1.126	-0.00195	-0.03	1.225	0.0601	0.82	0.5613	0.6841	1915035	CBDivE_004010	C/C(=N\NC(=O)c1cc2ccccc2cc1O)/c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I11	compound treatment	1.119	-0.00895	-0.12	1.173	0.00813	0.11	-0.0069	-0.0422	1915036	CBDivE_004011	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)cc2)N(C(=O)N1CC(=O)N/N=C\c3ccco3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I12	compound treatment	1.077	-0.0509	-0.69	1.217	0.0521	0.71	0.0167	0.0169	1915037	CBDivE_004012	CC(=O)Nc1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I13	compound treatment	1.182	0.0541	0.73	1.224	0.0591	0.81	1.0858	0.9987	1915038	CBDivE_004013	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4ccc(Cl)cc4)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I14	compound treatment	1.107	-0.0209	-0.28	1.155	-0.00987	-0.13	-0.2949	-0.9424	1915039	CBDivE_004014	Oc1ccc2ccccc2c1/C=N/NC(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I15	compound treatment	1.111	-0.0169	-0.23	1.167	0.00213	0.03	-0.1411	-0.6121	1915040	CBDivE_004015	CCOc1ccc(NC2(CCCCC2)c3nnnn3c4c(C)cccc4C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I16	compound treatment	1.15	0.0221	0.3	1.196	0.0311	0.42	0.5106	0.9849	1915041	CBDivE_004016	[O-][N+](=O)c1cccc2cc(F)c(F)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I17	compound treatment	1.107	-0.0209	-0.28	1.194	0.0291	0.4	0.0811	0.1664	1328615	CBDivE_004017	NCCNC(=O)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I18	compound treatment	1.092	-0.0359	-0.48	1.222	0.0571	0.78	0.208	0.2267	1123477	CBDivE_004018	Cc1cccc(c1)C(=O)OC2=C(C(=O)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I19	compound treatment	1.146	0.0181	0.24	1.161	-0.00387	-0.05	0.1349	0.5415	1915042	CBDivE_004019	C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	I20	compound treatment	1.143	0.0151	0.2	1.222	0.0571	0.78	0.6945	0.8626	1915043	CBDivE_004020	CCOC(=O)c1c(N)scc1c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J01	compound treatment	1.097	-0.0309	-0.42	1.199	0.0341	0.47	0.0339	0.0543	1119735	CBDivE_004021	COc1ccc2[nH]cc(CCNC(=O)c3ccco3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J02	compound treatment	1.156	0.0281	0.38	1.26	0.0951	1.3	1.1849	0.8768	1915044	CBDivE_004022	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccc5OCOc5c4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J03	compound treatment	1.074	-0.0539	-0.73	1.179	0.0141	0.19	-0.3783	-0.5025	1487392	CBDivE_004023	CC1C(O)CCN(C)C1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J04	compound treatment	1.103	-0.0249	-0.34	1.155	-0.00987	-0.13	-0.3331	-0.9191	1915045	CBDivE_004024	CC(=O)Nc1sc2CCCCc2c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J05	compound treatment	1.148	0.0201	0.27	1.092	-0.0729	-0.99	-0.5113	-0.4965	1915046	CBDivE_004025	Cc1ccc(N)c(c1)C(=O)CCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J06	compound treatment	1.173	0.0451	0.61	1.175	0.0101	0.14	0.5275	0.8463	1915047	CBDivE_004026	C/C(=N\NC(=O)c1ccn[nH]1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J07	compound treatment	1.175	0.0471	0.63	1.179	0.0141	0.19	0.5851	0.882	1915048	CBDivE_004027	Clc1ccc(cc1)N2C(=O)C=C(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J08	compound treatment	1.126	-0.00195	-0.03	1.136	-0.0289	-0.39	-0.2969	-0.7526	1045240	CBDivE_004028	O(c1ccccc1)c2nc(Oc3ccccc3)nc(Oc4ccccc4)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J09	compound treatment	1.136	0.00805	0.11	1.149	-0.0159	-0.22	-0.0762	-0.3146	1915049	CBDivE_004029	Cc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1NC(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J10	compound treatment	1.156	0.0281	0.38	1.165	1.34E-4	0.0	0.2689	0.7105	1314862	CBDivE_004030	CC(Oc1ccc2ccccc2c1)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J11	compound treatment	1.172	0.0441	0.59	1.183	0.0181	0.25	0.5951	0.9245	1915050	CBDivE_004031	Oc1ccc(/C=N/N=C/c2ccc(O)cc2O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J12	compound treatment	1.109	-0.0189	-0.26	1.138	-0.0269	-0.37	-0.4398	-0.9845	1915051	CBDivE_004032	COc1ccccc1N2C(=O)CC(N3CCN(CC3)c4ccc(F)cc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J13	compound treatment	1.155	0.0271	0.36	1.146	-0.0189	-0.26	0.0762	0.1706	1915052	CBDivE_004033	COC(=O)C(O)(c1ccc(N)cc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J14	compound treatment	1.113	-0.0149	-0.2	1.155	-0.00987	-0.13	-0.2377	-0.9807	1915053	CBDivE_004034	Clc1ccc(/C=N/NC(=O)N\N=C\c2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J15	compound treatment	1.163	0.0351	0.47	1.116	-0.0489	-0.67	-0.1368	-0.1674	1915054	CBDivE_004035	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J16	compound treatment	1.091	-0.0369	-0.5	1.159	-0.00587	-0.08	-0.409	-0.8102	1915055	CBDivE_004036	CCCC1NC(=O)NC1CCCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J17	compound treatment	1.145	0.0171	0.23	1.085	-0.0799	-1.09	-0.6074	-0.5457	1915056	CBDivE_004037	CC(NC(=O)c1cc([N+](=O)[O-])c(C)c(c1)[N+](=O)[O-])c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J18	compound treatment	1.127	-9.47E-4	-0.01	1.193	0.0281	0.38	0.2623	0.6832	1027977	CBDivE_004038	O=C1C=CC(=O)N1c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J19	compound treatment	1.104	-0.0239	-0.32	1.117	-0.0479	-0.65	-0.69	-0.9474	1915057	CBDivE_004039	Cc1cc(=O)n2ccc([N+](=O)[O-])c(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	J20	compound treatment	1.127	-9.47E-4	-0.01	1.192	0.0271	0.37	0.2526	0.6823	1915058	CBDivE_004040	[O-][N+](=O)c1cccc(/C=N/NC(=O)COc2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K01	compound treatment	1.112	-0.0159	-0.22	1.22	0.0551	0.75	0.3795	0.4853	1915059	CBDivE_004041	[O-][N+](=O)c1ccc(N/N=C/c2ccc(OC(=O)c3ccccc3)cc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K02	compound treatment	1.166	0.0381	0.51	1.165	1.34E-4	0.0	0.3643	0.7096	1915060	CBDivE_004042	OCCCNC(=S)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K03	compound treatment	1.097	-0.0309	-0.42	1.15	-0.0149	-0.2	-0.4386	-0.9449	1573322	CBDivE_004043	CCOC(=O)c1c(NC(=O)C)sc2c(OC)c(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K04	compound treatment	1.129	0.00105	0.01	1.162	-0.00287	-0.04	-0.0176	-0.4229	1915061	CBDivE_004044	COc1ccc(NC(=O)N(O)C2N(C(=O)N(CC(=O)N/N=C\c3ccco3)C2(C)C)c4ccc(OC)c(Cl)c4)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K05	compound treatment	1.117	-0.0109	-0.15	1.173	0.00813	0.11	-0.026	-0.1407	1915062	CBDivE_004045	Cc1cc(ccc1/N=C/c2ccc(cc2)[N+](=O)[O-])c3ccc(/N=C/c4ccc(cc4)[N+](=O)[O-])c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K06	compound treatment	1.122	-0.00595	-0.08	1.144	-0.0209	-0.28	-0.2579	-0.8725	1915063	CBDivE_004046	Cc1nc2ccc(Cl)cc2c3c(N)c4ccc(cc4n13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K07	compound treatment	1.093	-0.0349	-0.47	1.119	-0.0459	-0.63	-0.7756	-0.9903	1287372	CBDivE_004047	COc1ccc(NC(=O)N(O)C2N(C(=O)N(CC(=O)NN)C2(C)C)c3ccc(OC)c(Cl)c3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K08	compound treatment	1.172	0.0441	0.59	1.135	-0.0299	-0.41	0.1323	0.1836	1915064	CBDivE_004048	CC(=O)n1c2c(n(C)c3ccccc23)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K09	compound treatment	1.142	0.0141	0.19	1.182	0.0171	0.23	0.2993	0.9946	1295604	CBDivE_004049	CC(Cc1c[nH]c2ccccc12)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K10	compound treatment	1.117	-0.0109	-0.15	1.213	0.0481	0.66	0.3597	0.5347	1915065	CBDivE_004050	C/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K11	compound treatment	1.152	0.0241	0.32	1.155	-0.00987	-0.13	0.1343	0.3824	1915066	CBDivE_004051	CC1(C)C(N(O)C(=O)Nc2ccccc2)N(C(=O)N1CC(=O)N/N=C\c3ccco3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K12	compound treatment	1.154	0.0261	0.35	1.135	-0.0299	-0.41	-0.0394	-0.0733	1915067	CBDivE_004052	Oc1ccccc1/C=N/NC(=O)c2cc3ccccc3cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K13	compound treatment	1.119	-0.00895	-0.12	1.147	-0.0179	-0.24	-0.2576	-0.9475	1915068	CBDivE_004053	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4ccccc4)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K14	compound treatment	1.191	0.0631	0.85	1.21	0.0451	0.62	1.0367	0.9874	1915069	CBDivE_004054	Oc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K15	compound treatment	1.152	0.0241	0.32	1.211	0.0461	0.63	0.6743	0.9526	1915070	CBDivE_004055	COc1cccc(NC2(CCCC2)c3nnnn3c4c(C)cccc4C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K16	compound treatment	1.174	0.0461	0.62	1.157	-0.00787	-0.11	0.3635	0.5765	1782082	CBDivE_004056	[O-][N+](=O)c1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K17	compound treatment	1.144	0.0161	0.22	1.168	0.00313	0.04	0.1834	0.8306	1368453	CBDivE_004057	Cc1cc(OC(=O)c2ccc(Cl)cc2)cc(OC(=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K18	compound treatment	1.147	0.0191	0.26	1.185	0.0201	0.27	0.3759	0.9995	1105394	CBDivE_004058	C1CCc2c(C1)sc3ncn4cnnc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K19	compound treatment	1.15	0.0221	0.3	1.178	0.0131	0.18	0.337	0.9705	1915071	CBDivE_004059	COc1ccc(/C=N/c2cccc3c(/N=C\c4ccc(OC)cc4OC)cccc23)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	K20	compound treatment	1.17	0.0421	0.57	1.204	0.0391	0.53	0.7785	0.9995	1491311	CBDivE_004060	COc1ccccc1NC(=O)c2cc(Cl)cc(Cl)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L01	compound treatment	1.132	0.00405	0.05	1.179	0.0141	0.19	0.175	0.8733	1283305	CBDivE_004061	CC(Cc1c[nH]c2ccccc12)NC(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L02	compound treatment	1.092	-0.0359	-0.48	1.173	0.00813	0.11	-0.2645	-0.5316	1915072	CBDivE_004062	C=CCN1C(=O)c2cccc3c(ccc(C1=O)c23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L03	compound treatment	1.16	0.0321	0.43	1.178	0.0131	0.18	0.4324	0.9239	1474303	CBDivE_004063	CCC(Cc1ccccc1)NC(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L04	compound treatment	1.12	-0.00795	-0.11	1.176	0.0111	0.15	0.0316	0.1698	1915073	CBDivE_004064	COc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L05	compound treatment	1.058	-0.0699	-0.94	1.185	0.0201	0.27	-0.4731	-0.4814	1915074	CBDivE_004065	Cc1sc2nc(C)n(N=C3C=CC(=O)C=C3)c(=O)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L06	compound treatment	1.096	-0.0319	-0.43	1.147	-0.0179	-0.24	-0.477	-0.9635	1915075	CBDivE_004066	Cc1cc([nH]n1)C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L07	compound treatment	1.107	-0.0209	-0.28	1.13	-0.0349	-0.48	-0.536	-0.9691	1915076	CBDivE_004067	Clc1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L08	compound treatment	1.139	0.0111	0.15	1.092	-0.0729	-0.99	-0.5972	-0.5943	1054565	CBDivE_004068	O=C1N(C(=O)c2ccccc12)c3ccc(Cc4ccc(cc4)N5C(=O)c6ccccc6C5=O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L09	compound treatment	1.135	0.00705	0.1	1.175	0.0101	0.14	0.165	0.9834	1493238	CBDivE_004069	Cc1ccc(NC(=O)Nc2ccc(C)c(NC(=O)Nc3ccc(C)cc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L10	compound treatment	1.128	5.33E-5	0.0	1.125	-0.0399	-0.54	-0.3839	-0.7062	1133700	CBDivE_004070	CC(Oc1cccc(Cl)c1)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L11	compound treatment	1.113	-0.0149	-0.2	1.152	-0.0129	-0.18	-0.2666	-0.9976	1915077	CBDivE_004071	C/C(=N\N=C(/C)\c1cccc(N)c1)/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L12	compound treatment	1.083	-0.0449	-0.61	1.159	-0.00587	-0.08	-0.4853	-0.7935	1915078	CBDivE_004072	CC(=O)c1ccc(CCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L13	compound treatment	1.139	0.0111	0.15	1.102	-0.0629	-0.86	-0.5007	-0.5755	1915079	CBDivE_004073	COc1ccc(NN=Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L14	compound treatment	1.147	0.0191	0.26	1.14	-0.0249	-0.34	-0.058	-0.1363	1915080	CBDivE_004074	Cc1ccc(OCC(=O)N/N=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L15	compound treatment	1.106	-0.0219	-0.3	1.104	-0.0609	-0.83	-0.7962	-0.9036	1915081	CBDivE_004075	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L16	compound treatment	1.126	-0.00195	-0.03	1.173	0.00813	0.11	0.0599	0.5252	1673236	CBDivE_004076	Nc1cc(CCCC(=O)O)sc1CCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L17	compound treatment	1.082	-0.0459	-0.62	1.141	-0.0239	-0.33	-0.6684	-0.9548	1915082	CBDivE_004077	CC(NC(=S)NC(c1ccccc1)(c2ccccc2)c3ccccc3)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L18	compound treatment	1.118	-0.00995	-0.13	1.221	0.0561	0.77	0.4464	0.5744	1588286	CBDivE_004078	CCOc1ccccc1N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L19	compound treatment	1.173	0.0451	0.61	1.181	0.0161	0.22	0.5854	0.9056	1915083	CBDivE_004079	CC(N1CCCCCC1)C(=O)Nc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	L20	compound treatment	1.066	-0.0619	-0.84	1.187	0.0221	0.3	-0.3775	-0.4249	1915084	CBDivE_004080	COc1ccccc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M01	compound treatment	1.134	0.00605	0.08	1.182	0.0171	0.23	0.223	0.9008	1915085	CBDivE_004081	CCO/C(=C\c1sc2ccc(OC)cc2[n+]1CCCS(=O)(=O)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M02	compound treatment	1.158	0.0301	0.41	1.177	0.0121	0.17	0.4037	0.9219	1915086	CBDivE_004082	OCCNC(=S)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M03	compound treatment	1.097	-0.0309	-0.42	1.195	0.0301	0.41	-0.0046	-0.0079	1915087	CBDivE_004083	CCOC(=O)c1c(NC(=O)c2ccccc2)sc([N+](=O)[O-])c1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M04	compound treatment	1.161	0.0331	0.45	1.179	0.0141	0.19	0.4516	0.9296	1915088	CBDivE_004084	CC1(C)C(N(O)C(=O)NC2CCCCC2)N(C3CCCCC3)C(=O)N1CC(=O)N/N=C\c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M05	compound treatment	1.232	0.104	1.4	1.286	0.121	1.65	2.1606	0.9967	1915089	CBDivE_004085	[O-][N+](=O)c1ccc(NN=C(c2ccc(Cl)cc2)c3ccc(Cl)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M06	compound treatment	1.13	0.00205	0.03	1.174	0.00913	0.12	0.1077	0.8437	1547460	CBDivE_004086	COc1ccc2nc(C)n3c4ccccc4c(NC(=O)C)c3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M07	compound treatment	1.12	-0.00795	-0.11	1.166	0.00113	0.02	-0.0649	-0.5989	1915090	CBDivE_004087	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)O)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M08	compound treatment	1.134	0.00605	0.08	1.138	-0.0269	-0.37	-0.2013	-0.5363	1915091	CBDivE_004088	COc1ccc(N=Nc2cn(C(=O)C)c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M09	compound treatment	1.18	0.0521	0.7	1.14	-0.0249	-0.34	0.2568	0.3293	1593697	CBDivE_004089	OC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M10	compound treatment	1.139	0.0111	0.15	1.176	0.0111	0.15	0.2128	1.0	1915092	CBDivE_004090	C/C(=N\NC(=O)c1cccc(c1)[N+](=O)[O-])/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M11	compound treatment	1.142	0.0141	0.19	1.163	-0.00187	-0.03	0.1161	0.6068	1915093	CBDivE_004091	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C/c4cc5ccccc5cc4O)c6cccc7ccccc67
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M12	compound treatment	1.103	-0.0249	-0.34	1.157	-0.00787	-0.11	-0.3138	-0.8884	1915094	CBDivE_004092	Oc1ccccc1/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M13	compound treatment	1.1	-0.0279	-0.38	1.135	-0.0299	-0.41	-0.5546	-0.9993	1915095	CBDivE_004093	C1C/C(=N/N=C\2/CCCc3c2[nH]c4ccccc34)/c5[nH]c6ccccc6c5C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M14	compound treatment	1.096	-0.0319	-0.43	1.177	0.0121	0.17	-0.1877	-0.4067	1915096	CBDivE_004094	CC(C)(C)N(Cc1ccc(cc1)[N+](=O)[O-])C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M15	compound treatment	1.123	-0.00495	-0.07	1.155	-0.00987	-0.13	-0.1423	-0.9477	1733476	CBDivE_004095	Nc1nc2ccccc2n1Cc3cccc4nonc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M16	compound treatment	1.183	0.0551	0.74	1.166	0.00113	0.02	0.5361	0.7217	1915097	CBDivE_004096	[O-][N+](=O)c1ccc(/C=N/N(Cc2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M17	compound treatment	1.179	0.0511	0.69	1.163	-0.00187	-0.03	0.469	0.6805	1915098	CBDivE_004097	[O-][N+](=O)c1cccc(c1)C(=O)NN=C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M18	compound treatment	1.164	0.0361	0.49	1.246	0.0811	1.11	1.1263	0.9319	1915099	CBDivE_004098	CC(=O)c1ccc2C(=O)N(C(=O)c3cccc1c32)c4ccc(C)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M19	compound treatment	1.093	-0.0349	-0.47	1.139	-0.0259	-0.35	-0.5828	-0.9898	1915100	CBDivE_004099	C/C(=N\N=C(/C)\c1ccc(cc1)c2ccccc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	M20	compound treatment	1.088	-0.0399	-0.54	1.194	0.0291	0.4	-0.1001	-0.1496	1643324	CBDivE_004100	OC(=O)c1nccnc1C(=O)Nc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N01	compound treatment	1.095	-0.0329	-0.44	1.167	0.00213	0.03	-0.2937	-0.6594	1915101	CBDivE_004101	[O-][N+](=O)c1ccc(cc1)C(=O)NCCc2c[nH]c3ccc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N02	compound treatment	1.134	0.00605	0.08	1.186	0.0211	0.29	0.2615	0.8731	1915102	CBDivE_004102	Oc1ccc2ccccc2c1/C=N\NC(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N03	compound treatment	1.042	-0.0859	-1.16	1.127	-0.0379	-0.52	-1.185	-0.9336	1915103	CBDivE_004103	Cc1ccc2c3c(C)c(cn3ccn12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N04	compound treatment	1.166	0.0381	0.51	1.172	0.00713	0.1	0.4318	0.8264	1660119	CBDivE_004104	CCOC(=O)c1c(NC(=O)c2ccccc2C(=O)O)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N05	compound treatment	1.196	0.0681	0.92	1.172	0.00713	0.1	0.718	0.7777	1915104	CBDivE_004105	CCOC(=O)c1c(NC(=O)C)sc2c(O)c(cc([N+](=O)[O-])c12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N06	compound treatment	1.098	-0.0299	-0.4	1.157	-0.00787	-0.11	-0.3615	-0.8649	1915105	CBDivE_004106	COc1ccc(/C=N/NC(=O)c2cc(C)n[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N07	compound treatment	1.057	-0.0709	-0.96	1.112	-0.0529	-0.72	-1.1865	-0.9902	1915106	CBDivE_004107	Cc1cccc(c1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N08	compound treatment	1.086	-0.0419	-0.57	1.131	-0.0339	-0.46	-0.7267	-0.9949	1669656	CBDivE_004108	C(NC1CCCc2c1[nH]c3ccc(cc23)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N09	compound treatment	1.112	-0.0159	-0.22	1.106	-0.0589	-0.8	-0.7197	-0.8661	1915107	CBDivE_004109	COc1ccc(CN/C(=N\C(=N)N)/N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N10	compound treatment	1.13	0.00205	0.03	1.175	0.0101	0.14	0.1173	0.8323	1614708	CBDivE_004110	NNC(=O)c1ccccc1OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N11	compound treatment	1.129	0.00105	0.01	1.155	-0.00987	-0.13	-0.0851	-0.6289	1915108	CBDivE_004111	C/C(=N/NC(=O)C1CC1c2ccccc2)/CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N12	compound treatment	1.13	0.00205	0.03	1.157	-0.00787	-0.11	-0.0563	-0.5078	1915109	CBDivE_004112	CCc1ccc(C=C(C(=O)O)C(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N13	compound treatment	1.137	0.00905	0.12	1.061	-0.104	-1.42	-0.9152	-0.6437	1048791	CBDivE_004113	COc1ccc(NN=Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N14	compound treatment	1.118	-0.00995	-0.13	1.16	-0.00487	-0.07	-0.1418	-0.9473	1616216	CBDivE_004114	NNC(=O)C(Oc1ccccc1)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N15	compound treatment	1.094	-0.0339	-0.46	1.076	-0.0889	-1.21	-1.1807	-0.9114	1915110	CBDivE_004115	COc1ccc(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N16	compound treatment	1.112	-0.0159	-0.22	1.182	0.0171	0.23	0.0131	0.0412	1915111	CBDivE_004116	O/N=C/1\CCCc2sc(CCCC(=O)O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N17	compound treatment	1.086	-0.0419	-0.57	1.131	-0.0339	-0.46	-0.7267	-0.9949	1915112	CBDivE_004117	S=C(NC(c1ccccc1)(c2ccccc2)c3ccccc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N18	compound treatment	1.091	-0.0369	-0.5	1.173	0.00813	0.11	-0.274	-0.5366	1915113	CBDivE_004118	Brc1ccccc1N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N19	compound treatment	1.129	0.00105	0.01	1.102	-0.0629	-0.86	-0.5961	-0.6953	1915114	CBDivE_004119	Cc1cc(C)c(NC(=O)C2CCCN2C3CCCCC3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	N20	compound treatment	1.153	0.0251	0.34	1.174	0.00913	0.12	0.3271	0.908	1915115	CBDivE_004120	Oc1ccc(O)c(/C=N/NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O01	compound treatment	1.129	0.00105	0.01	1.197	0.0321	0.44	0.3199	0.7297	1915116	CBDivE_004121	C(=N/c1cccc2c(\N=C\c3cccnc3)cccc12)\c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O02	compound treatment	1.1	-0.0279	-0.38	1.238	0.0731	1.0	0.4386	0.4114	1915117	CBDivE_004122	CCN(C(=O)COc1ccccc1)c2ccc(cc2)C(O)(C(=O)OC)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O03	compound treatment	1.114	-0.0139	-0.19	1.169	0.00413	0.06	-0.0932	-0.4744	1722026	CBDivE_004123	CCOC(=O)c1c(NC(=O)c2ccccc2)sc3C(=O)CCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O04	compound treatment	1.13	0.00205	0.03	1.149	-0.0159	-0.22	-0.1334	-0.6116	1915118	CBDivE_004124	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C\c4ccco4)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O05	compound treatment	1.071	-0.0569	-0.77	1.184	0.0191	0.26	-0.3587	-0.4421	1067915	CBDivE_004125	C1CN(C(=C2N(CCN2c3ccccc3)c4ccccc4)N1c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O06	compound treatment	1.1	-0.0279	-0.38	1.149	-0.0159	-0.22	-0.4196	-0.9652	1915119	CBDivE_004126	Cn1c2c([nH]c3ccccc23)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O07	compound treatment	1.118	-0.00995	-0.13	1.162	-0.00287	-0.04	-0.1225	-0.8766	1915120	CBDivE_004127	C(=N/c1cccc2c(\N=C\c3ccccc3)cccc12)\c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O08	compound treatment	1.146	0.0181	0.24	1.195	0.0301	0.41	0.4628	0.9688	1915121	CBDivE_004128	CC(=O)n1cc(N=Nc2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O09	compound treatment	1.176	0.0481	0.65	1.16	-0.00487	-0.07	0.4115	0.6314	1915122	CBDivE_004129	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)c(Cl)c2)N(C(=O)N1CC(=O)N/N=C/3\CCCc4c3no[n+]4[O-])c5ccc(Cl)c(Cl)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O10	compound treatment	1.167	0.0391	0.53	1.155	-0.00987	-0.13	0.2774	0.5102	1915123	CBDivE_004130	Oc1cc2ccccc2cc1C(=O)NN=C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O11	compound treatment	1.141	0.0131	0.18	1.152	-0.0129	-0.18	5.0E-4	0.0019	1915124	CBDivE_004131	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)N/N=C\C=C/c4ccc(o4)[N+](=O)[O-])c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O12	compound treatment	1.142	0.0141	0.19	1.199	0.0341	0.47	0.4632	0.9216	1915125	CBDivE_004132	Oc1ccccc1/C=N/N(Cc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O13	compound treatment	1.118	-0.00995	-0.13	1.161	-0.00387	-0.05	-0.1322	-0.9167	1915126	CBDivE_004133	CCOC(=O)c1c(C)n(C)c2ccc(OS(=O)(=O)c3ccc(C)cc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O14	compound treatment	1.146	0.0181	0.24	1.168	0.00313	0.04	0.2024	0.8187	3105992	CBDivE_004134	CN1CCN(CC(O)COc2ccccc2)CC1.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O15	compound treatment	1.149	0.0211	0.28	1.215	0.0501	0.68	0.6843	0.9243	1915127	CBDivE_004135	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccccc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O16	compound treatment	1.161	0.0331	0.45	1.18	0.0151	0.21	0.4612	0.9387	1648768	CBDivE_004136	COc1cc(ccc1O)C2NCCc3cc(OC)c(OC)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O17	compound treatment	1.149	0.0211	0.28	1.18	0.0151	0.21	0.3468	0.9877	1915128	CBDivE_004137	CCOC(=O)c1c(NC(=O)C)sc2C(=C(CCc12)C=O)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O18	compound treatment	1.121	-0.00695	-0.09	1.219	0.0541	0.74	0.4557	0.6124	1539129	CBDivE_004138	O=C(NN1C(=O)c2cccc3cccc(C1=O)c23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O19	compound treatment	1.146	0.0181	0.24	1.178	0.0131	0.18	0.2989	0.9886	1349069	CBDivE_004139	COc1ccc(cc1OC)C(=O)Nc2ccc(Cl)cc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	O20	compound treatment	1.156	0.0281	0.38	1.204	0.0391	0.53	0.645	0.9858	1915129	CBDivE_004140	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P01	compound treatment	1.128	5.33E-5	0.0	1.154	-0.0109	-0.15	-0.1043	-0.7037	1915130	CBDivE_004141	CCS(=O)c1sc(CC)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P02	compound treatment	1.099	-0.0289	-0.39	1.153	-0.0119	-0.16	-0.3905	-0.9239	1915131	CBDivE_004142	NC(CC(=O)c1ccc(Cl)cc1Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P03	compound treatment	1.123	-0.00495	-0.07	1.182	0.0171	0.23	0.118	0.4857	1915132	CBDivE_004143	CC(=O)C[n+]1ccc2ccccc2c1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P04	compound treatment	1.139	0.0111	0.15	1.14	-0.0249	-0.34	-0.1343	-0.3626	3006997	CBDivE_004144	NCCO.OC(=O)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P05	compound treatment	1.108	-0.0199	-0.27	1.119	-0.0459	-0.63	-0.6325	-0.929	1570532	CBDivE_004145	Nn1c(CCC(=O)O)nc2sc3CCCCc3c2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P06	compound treatment	1.118	-0.00995	-0.13	1.133	-0.0319	-0.43	-0.4021	-0.8843	1915133	CBDivE_004146	C/C(=N\NC(=O)c1cc(C)n[nH]1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P07	compound treatment	1.094	-0.0339	-0.46	1.069	-0.0959	-1.31	-1.2482	-0.9011	1915134	CBDivE_004147	COc1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P08	compound treatment	1.15	0.0221	0.3	1.108	-0.0569	-0.78	-0.3379	-0.4069	1915135	CBDivE_004148	Cc1ccc(NC(=O)C2=C3Nc4ccccc4N3CCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P09	compound treatment	1.129	0.00105	0.01	1.181	0.0161	0.22	0.1656	0.7512	1915136	CBDivE_004149	C/C(=N\NC(=O)N)/c1cc(CNC(=O)CCl)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P10	compound treatment	1.07	-0.0579	-0.78	1.128	-0.0369	-0.5	-0.9082	-0.9772	1915137	CBDivE_004150	NNC(=O)c1ccccc1OCc2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P11	compound treatment	1.043	-0.0849	-1.15	1.092	-0.0729	-0.99	-1.5129	-0.9975	1915138	CBDivE_004151	CCCC/C(=N/NC(=O)Nc1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P12	compound treatment	1.104	-0.0239	-0.32	1.116	-0.0489	-0.67	-0.6996	-0.9447	1915139	CBDivE_004152	NC(C(=O)O)c1ccc(CCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P13	compound treatment	1.089	-0.0389	-0.53	1.142	-0.0229	-0.31	-0.592	-0.969	1048789	CBDivE_004153	Cc1ccc(N=NNc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P14	compound treatment	1.153	0.0251	0.34	1.128	-0.0369	-0.5	-0.1165	-0.1923	1915140	CBDivE_004154	OC(=O)CCC(NC(=O)c1ccc(I)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P15	compound treatment	1.074	-0.0539	-0.73	1.112	-0.0529	-0.72	-1.0244	-1.0	1215251	CBDivE_004155	C(C1NCCn2cccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P16	compound treatment	1.062	-0.0659	-0.89	1.135	-0.0299	-0.41	-0.9171	-0.9373	1915141	CBDivE_004156	CC/C(=N\O)/c1ccc(CCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P17	compound treatment	1.066	-0.0619	-0.84	1.171	0.00613	0.08	-0.5318	-0.6332	1915142	CBDivE_004157	Cc1nc2sc3CCCCc3c2c(=O)n1/N=C/c4c(O)ccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P18	compound treatment	1.139	0.0111	0.15	1.132	-0.0329	-0.45	-0.2115	-0.4477	1432713	CBDivE_004158	COc1ccccc1N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P19	compound treatment	1.101	-0.0269	-0.36	1.138	-0.0269	-0.37	-0.5161	-1.0	1915143	CBDivE_004159	Cc1ccccc1NC(=O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.13	P20	compound treatment	1.103	-0.0249	-0.34	1.187	0.0221	0.3	-0.0245	-0.0543	1567575	CBDivE_004160	Cc1cc(C)c(NC(=O)C2CCCCN2N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A01	compound treatment	1.126	0.00436	0.06	1.212	0.0477	0.65	0.5012	0.768	1915144	CBDivE_004161	CCO/C(=C/c1sc2cc(OC)c3ccsc3c2[n+]1CCC[SH](=O)(=O)=O)/CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A02	compound treatment	1.078	-0.0436	-0.59	1.221	0.0567	0.77	0.1301	0.1339	1915145	CBDivE_004162	Fc1cccc(NC(=O)C2CC=CCC2C(=O)OCC(=C(Cl)Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A03	compound treatment	1.125	0.00336	0.05	1.232	0.0677	0.92	0.6845	0.7409	1915146	CBDivE_004163	[O-][N+](=O)c1c2NCNc2c([N+](=O)[O-])c3Nc4nonc4Nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A04	compound treatment	1.162	0.0404	0.54	1.239	0.0747	1.02	1.1049	0.957	1915147	CBDivE_004164	OC(CCl)Cn1c-2c(CCc3c2cnn3c4ccccc4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A05	compound treatment	1.095	-0.0266	-0.36	1.178	0.0137	0.19	-0.1224	-0.3023	1775449	CBDivE_004165	OCC(O)C1OC(Nc2ccc(Br)cc2)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A06	compound treatment	1.175	0.0534	0.72	1.175	0.0107	0.15	0.6118	0.8331	1915148	CBDivE_004166	OC(CBr)Cn1c-2c(CCc3c2cnn3c4ccccc4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A07	compound treatment	1.103	-0.0186	-0.25	1.157	-0.00734	-0.1	-0.2486	-0.9184	1071560	CBDivE_004167	CCOC(=O)c1sc(N)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A08	compound treatment	1.156	0.0344	0.46	1.169	0.00466	0.06	0.3727	0.7966	1915149	CBDivE_004168	Cc1cc2/C(=N\NC(=O)COc3ccccc3)/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A09	compound treatment	1.112	-0.00964	-0.13	1.126	-0.0383	-0.52	-0.4616	-0.8569	1915150	CBDivE_004169	[O-][N+](=O)c1cccc(c1)N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A10	compound treatment	1.123	0.00136	0.02	1.22	0.0557	0.76	0.5497	0.724	1915151	CBDivE_004170	CCCCOC(=O)CNc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A11	compound treatment	1.126	0.00436	0.06	1.155	-0.00934	-0.13	-0.0485	-0.3454	1915152	CBDivE_004171	ON(C(=O)Nc1ccccc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A12	compound treatment	1.139	0.0174	0.23	1.191	0.0267	0.36	0.4227	0.9774	1032506	CBDivE_004172	O=S(=O)(NS(=O)(=O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A13	compound treatment	1.156	0.0344	0.46	1.177	0.0127	0.17	0.4499	0.9095	1915153	CBDivE_004173	C/C(=N\O)/c1ccc(cc1)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A14	compound treatment	1.159	0.0374	0.5	1.135	-0.0293	-0.4	0.0735	0.1142	1112096	CBDivE_004174	COc1ccc(cc1)C(=O)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A15	compound treatment	1.097	-0.0246	-0.33	1.31	0.146	1.99	1.1695	0.5807	1912926	CBDivE_004175	Nc1cc(nn1c2ccccc2)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A16	compound treatment	1.201	0.0794	1.07	1.184	0.0197	0.27	0.9466	0.8577	1720413	CBDivE_004176	CCc1ccccc1NC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A17	compound treatment	1.077	-0.0446	-0.6	1.111	-0.0533	-0.73	-0.9401	-0.9956	1915154	CBDivE_004177	COc1ccc(cc1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A18	compound treatment	1.157	0.0354	0.48	1.175	0.0107	0.15	0.4401	0.8825	1915155	CBDivE_004178	COc1cc(OC)nc(NC(=O)Nc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A19	compound treatment	1.11	-0.0116	-0.16	1.094	-0.0703	-0.96	-0.7893	-0.8121	1915156	CBDivE_004179	Cc1cccc(NC(=N)NC(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	A20	compound treatment	1.098	-0.0236	-0.32	1.192	0.0277	0.38	0.0412	0.0834	1915157	CBDivE_004180	Cc1cc2/C(=N\NC(=O)c3ccc(cc3)[N+](=O)[O-])/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B01	compound treatment	1.161	0.0394	0.53	1.227	0.0627	0.85	0.9797	0.9738	1915158	CBDivE_004181	Cc1ccc(cc1)S(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B02	compound treatment	1.14	0.0184	0.25	1.134	-0.0303	-0.41	-0.1174	-0.2435	1531696	CBDivE_004182	Clc1ccccc1NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B03	compound treatment	1.125	0.00336	0.05	1.13	-0.0343	-0.47	-0.2991	-0.6357	1915159	CBDivE_004183	Cc1ccc(cc1)C(=O)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B04	compound treatment	1.193	0.0714	0.96	1.235	0.0707	0.96	1.3621	1.0	1915160	CBDivE_004184	CCOC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B05	compound treatment	1.14	0.0184	0.25	1.16	-0.00434	-0.06	0.1333	0.5235	1915161	CBDivE_004185	OC(CN1CCSC1=N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B06	compound treatment	1.144	0.0224	0.3	1.151	-0.0133	-0.18	0.0847	0.2404	1179408	CBDivE_004186	CCc1ccc(OCC(O)CN2CCN(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B07	compound treatment	1.087	-0.0346	-0.47	1.195	0.0307	0.42	-0.0348	-0.0555	1915162	CBDivE_004187	CC(C)CC(=O)NC(NC(=S)Nc1ccccc1Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B08	compound treatment	1.144	0.0224	0.3	1.099	-0.0653	-0.89	-0.4167	-0.443	1915163	CBDivE_004188	OC(=O)/C=C/C(=O)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B09	compound treatment	1.085	-0.0366	-0.49	1.139	-0.0253	-0.35	-0.5938	-0.9847	1864902	CBDivE_004189	O=S(=O)(NCc1ccccc1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B10	compound treatment	1.136	0.0144	0.19	1.182	0.0177	0.24	0.3073	0.9942	1915164	CBDivE_004190	OC(=O)/C=C/C(=O)NNC(=O)c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B11	compound treatment	1.042	-0.0796	-1.07	1.15	-0.0143	-0.2	-0.898	-0.8223	1333181	CBDivE_004191	CN1CCN(CC(O)COCc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B12	compound treatment	1.176	0.0544	0.73	1.163	-0.00134	-0.02	0.5057	0.6893	1915165	CBDivE_004192	Oc1c(CC=C)cccc1/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B13	compound treatment	1.131	0.00936	0.13	1.154	-0.0103	-0.14	-0.0104	-0.0549	1324103	CBDivE_004193	OC(c1coc2ccc(O)c(CN3CCOCC3)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B14	compound treatment	1.036	-0.0856	-1.16	1.176	0.0117	0.16	-0.7045	-0.6041	1915166	CBDivE_004194	Cc1ccc(O)c(/C=N/NC(=O)Cc2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B15	compound treatment	1.168	0.0464	0.63	1.182	0.0177	0.24	0.6125	0.914	1915167	CBDivE_004195	CC(C)C1CCC(C)CC1OC(=O)Cn2c(COc3ccc(C)cc3)[n+](C)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B16	compound treatment	1.182	0.0604	0.81	1.124	-0.0403	-0.55	0.1868	0.1901	1915168	CBDivE_004196	Cc1n[nH]c(Nc2ccc(C)cc2C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B17	compound treatment	1.137	0.0154	0.21	1.123	-0.0413	-0.56	-0.2521	-0.4197	1295605	CBDivE_004197	Cc1ccc2[nH]c3C(CCCc3c2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B18	compound treatment	1.172	0.0504	0.68	1.137	-0.0273	-0.37	0.2168	0.2798	1052255	CBDivE_004198	CN(C)c1ccc(C=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B19	compound treatment	1.175	0.0534	0.72	1.18	0.0157	0.21	0.66	0.879	1915169	CBDivE_004199	Brc1ccc(o1)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	B20	compound treatment	1.144	0.0224	0.3	1.109	-0.0553	-0.75	-0.3203	-0.3941	3007320	CBDivE_004200	Cc1ccc(cc1)[SH](=O)(=O)=O.C[n+]1c(CO)sc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C01	compound treatment	1.082	-0.0396	-0.53	1.17	0.00566	0.08	-0.3235	-0.5988	1915172	CBDivE_004201	Oc1c(C(=O)NCC/N=C/c2ccc(cc2)[N+](=O)[O-])c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C02	compound treatment	1.141	0.0194	0.26	1.176	0.0117	0.16	0.2971	0.9717	1915173	CBDivE_004202	Oc1ccc(cc1)c2nc3cc(ccc3nc2c4ccccc4)S(=O)(=O)c5ccc6nc(c7ccccc7)c(nc6c5)c8ccc(O)cc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C03	compound treatment	1.135	0.0134	0.18	1.156	-0.00834	-0.11	0.047	0.2208	1915174	CBDivE_004203	N1c2nonc2Nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C04	compound treatment	1.142	0.0204	0.27	1.146	-0.0183	-0.25	0.0174	0.0468	1915175	CBDivE_004204	CC(O)c1c(C)oc2ccc(O)c(CN3CCOCC3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C05	compound treatment	1.111	-0.0106	-0.14	1.169	0.00466	0.06	-0.0565	-0.3602	1915176	CBDivE_004205	Clc1ccc(NN=Nc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C06	compound treatment	1.167	0.0454	0.61	1.213	0.0487	0.66	0.9019	0.9992	1915177	CBDivE_004206	CC1(C)Cc2c(cnn2c3ccccc3)-c4c1c5ccccc5n4CC(O)CBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C07	compound treatment	1.105	-0.0166	-0.22	1.124	-0.0403	-0.55	-0.5477	-0.9219	1915178	CBDivE_004207	CCCCNC(O)COc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C08	compound treatment	1.095	-0.0266	-0.36	1.191	0.0267	0.36	0.003	0.0058	1291339	CBDivE_004208	CCOC(=O)c1c(CN2CCOCC2)n(C)c3ccc(O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C09	compound treatment	1.107	-0.0146	-0.2	1.121	-0.0433	-0.59	-0.5575	-0.8948	1599505	CBDivE_004209	O=C(c1ccccc1)C2(COCO2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C10	compound treatment	1.143	0.0214	0.29	1.15	-0.0143	-0.2	0.0655	0.1881	1438870	CBDivE_004210	O=C(CNc1n[nH]c(=O)[nH]c1=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C11	compound treatment	1.119	-0.00264	-0.04	1.203	0.0387	0.53	0.3476	0.6578	1915179	CBDivE_004211	ON(C(=O)Nc1ccccc1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C12	compound treatment	1.164	0.0424	0.57	1.196	0.0317	0.43	0.7094	0.9904	1005055	CBDivE_004212	Oc1c(cc([N+](=O)[O-])c2ccc(cc12)S(=O)(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C13	compound treatment	1.047	-0.0746	-1.01	1.124	-0.0403	-0.55	-1.101	-0.9595	1915180	CBDivE_004213	CC(=O)c1ccc2[nH]c3C(=O)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C14	compound treatment	1.134	0.0124	0.17	1.178	0.0137	0.19	0.2496	0.9985	1075900	CBDivE_004214	CC(=O)c1cccc(NC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C15	compound treatment	1.12	-0.00164	-0.02	1.25	0.0857	1.17	0.8103	0.6936	1915181	CBDivE_004215	COc1ccc(cc1)c2cc(O)[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C16	compound treatment	1.175	0.0534	0.72	1.162	-0.00234	-0.03	0.4865	0.6751	1915182	CBDivE_004216	Cc1ccccc1NC(=O)COc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C17	compound treatment	1.101	-0.0206	-0.28	1.137	-0.0273	-0.37	-0.4605	-0.9897	1915183	CBDivE_004217	Oc1c(C=C2N=C(OC2=O)c3ccccc3)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C18	compound treatment	1.072	-0.0496	-0.67	1.182	0.0177	0.24	-0.3032	-0.4261	1915184	CBDivE_004218	CC(=O)NC(NC(=S)Nc1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C19	compound treatment	1.134	0.0124	0.17	1.175	0.0107	0.15	0.2207	0.9977	1915185	CBDivE_004219	CCOC(=O)c1c(NC(=O)C)sc2C(=O)C(CCc12)Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	C20	compound treatment	1.144	0.0224	0.3	1.196	0.0317	0.43	0.5186	0.9846	1915186	CBDivE_004220	Cc1cc2/C(=N\NC(=O)Nc3ccccc3)/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D01	compound treatment	1.123	0.00136	0.02	1.172	0.00766	0.1	0.0869	0.8187	1383995	CBDivE_004221	Cc1ccc(cc1)S(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D02	compound treatment	1.121	-6.41E-4	-0.01	1.124	-0.0403	-0.55	-0.3951	-0.7181	1915187	CBDivE_004222	FC(F)(F)c1ccc(NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D03	compound treatment	1.09	-0.0316	-0.43	1.154	-0.0103	-0.14	-0.4015	-0.8932	1170983	CBDivE_004223	COC(=O)C(NC(=O)Nc1ccccc1)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D04	compound treatment	1.076	-0.0456	-0.62	1.146	-0.0183	-0.25	-0.6122	-0.9212	1915188	CBDivE_004224	CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(cc4)[N+](=O)[O-])ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D05	compound treatment	1.158	0.0364	0.49	1.188	0.0237	0.32	0.575	0.9794	1915189	CBDivE_004225	CCOC(=O)c1c(C)c(sc1N)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D06	compound treatment	1.066	-0.0556	-0.75	1.127	-0.0373	-0.51	-0.8908	-0.9821	1915190	CBDivE_004226	CC(C)NCC(O)COCCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D07	compound treatment	1.13	0.00836	0.11	1.163	-0.00134	-0.02	0.0668	0.5851	1915191	CBDivE_004227	COC(=O)c1ccccc1NC(=S)NC(NC(=O)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D08	compound treatment	1.15	0.0284	0.38	1.139	-0.0253	-0.35	0.0262	0.0509	1915192	CBDivE_004228	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2cccnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D09	compound treatment	1.108	-0.0136	-0.18	1.165	6.63E-4	0.01	-0.1237	-0.6716	1776027	CBDivE_004229	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D10	compound treatment	1.175	0.0534	0.72	1.169	0.00466	0.06	0.554	0.7666	1442153	CBDivE_004230	CCOC(=O)c1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D11	compound treatment	1.169	0.0474	0.64	1.151	-0.0133	-0.18	0.3232	0.4865	1221113	CBDivE_004231	CC(C)c1ccc(C)cc1OCC(O)CN2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D12	compound treatment	1.108	-0.0136	-0.18	1.147	-0.0173	-0.24	-0.2973	-0.9923	1558882	CBDivE_004232	NNc1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D13	compound treatment	1.13	0.00836	0.11	1.153	-0.0113	-0.15	-0.0296	-0.1546	1333937	CBDivE_004233	O=S(=O)(C1CCS(=O)(=O)C1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D14	compound treatment	1.104	-0.0176	-0.24	1.167	0.00266	0.04	-0.1426	-0.5924	1915193	CBDivE_004234	Brc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D15	compound treatment	1.123	0.00136	0.02	1.107	-0.0573	-0.78	-0.5399	-0.6903	1915194	CBDivE_004235	CC(C)C1CCC(C)CC1OC(=O)Cn2c(COc3ccccc3C)[n+](C)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D16	compound treatment	1.126	0.00436	0.06	1.129	-0.0353	-0.48	-0.2992	-0.6162	1915195	CBDivE_004236	CCOc1ccc(Nc2[nH]nc(C)c2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D17	compound treatment	1.151	0.0294	0.4	1.136	-0.0283	-0.39	0.0068	0.0123	1915196	CBDivE_004237	Cc1ccc2[nH]c3C(CCCc3c2c1)NC(=O)CCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D18	compound treatment	1.145	0.0234	0.32	1.173	0.00866	0.12	0.3064	0.9103	1915197	CBDivE_004238	CC(=O)Nc1ccc(/N=C\c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D19	compound treatment	1.118	-0.00364	-0.05	1.199	0.0347	0.47	0.2995	0.6302	1915198	CBDivE_004239	Cc1c(NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	D20	compound treatment	1.122	3.59E-4	0.0	1.143	-0.0213	-0.29	-0.2023	-0.6952	1915199	CBDivE_004240	CC(C)C1CCC(C)CC1OC(=O)Cn2c(C)[n+](C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E01	compound treatment	1.129	0.00736	0.1	1.171	0.00666	0.09	0.1344	0.999	1915200	CBDivE_004241	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E02	compound treatment	1.176	0.0544	0.73	1.151	-0.0133	-0.18	0.3899	0.5161	3007449	CBDivE_004242	CCCCc1nc2ccccc2c(N)c1CCC.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E03	compound treatment	1.117	-0.00464	-0.06	1.126	-0.0383	-0.52	-0.4139	-0.7862	1623275	CBDivE_004243	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C3(CC4CC5CC(C4)C3)C5)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E04	compound treatment	1.151	0.0294	0.4	1.195	0.0307	0.42	0.5757	0.9996	1734332	CBDivE_004244	CCOC(=O)c1c(OCC)[nH]c2ccc(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E05	compound treatment	1.129	0.00736	0.1	1.148	-0.0163	-0.22	-0.0873	-0.358	1915201	CBDivE_004245	Cc1ccc(NN=Nc2ccc(Br)cc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E06	compound treatment	1.167	0.0454	0.61	1.181	0.0167	0.23	0.5934	0.909	1050053	CBDivE_004246	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E07	compound treatment	1.066	-0.0556	-0.75	1.171	0.00666	0.09	-0.4665	-0.617	1915202	CBDivE_004247	[O-][N+](=O)c1cccc(c1)N2C(=O)C3C(C2=O)C4(Br)c5ccccc5C3c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E08	compound treatment	1.146	0.0244	0.33	1.175	0.0107	0.15	0.3352	0.9327	1145555	CBDivE_004248	CCOC(=O)c1c(CN2CCN(CC2)c3ccccc3)n(C)c4cc(Br)c(O)cc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E09	compound treatment	1.186	0.0644	0.87	1.127	-0.0373	-0.51	0.2539	0.2523	1915203	CBDivE_004249	Cc1ccc(cc1NC(=O)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E10	compound treatment	1.132	0.0104	0.14	1.197	0.0327	0.45	0.4138	0.8864	1915204	CBDivE_004250	CCCOC(=O)C(C)Nc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E11	compound treatment	1.064	-0.0576	-0.78	1.133	-0.0313	-0.43	-0.852	-0.9602	1915205	CBDivE_004251	Cc1ccc2n3CCN(CS(=O)(=O)O)C4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E12	compound treatment	1.091	-0.0306	-0.41	1.223	0.0587	0.8	0.2734	0.3036	1915206	CBDivE_004252	Cc1sc2cc(C)ccc2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E13	compound treatment	1.065	-0.0566	-0.76	1.189	0.0247	0.34	-0.3025	-0.3623	1666824	CBDivE_004253	Fc1ccc2[nH]c3C(=O)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E14	compound treatment	1.159	0.0374	0.5	1.262	0.0977	1.33	1.2981	0.9116	1915207	CBDivE_004254	CC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E15	compound treatment	1.106	-0.0156	-0.21	1.18	0.0157	0.21	0.0018	0.0061	1915208	CBDivE_004255	[O-][N+](=O)c1ccc(/C=C/C(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E16	compound treatment	1.067	-0.0546	-0.74	1.174	0.00966	0.13	-0.4281	-0.5717	1915209	CBDivE_004256	CC1CCN(CC1)C(=O)COc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E17	compound treatment	1.103	-0.0186	-0.25	1.152	-0.0123	-0.17	-0.2968	-0.9809	1915210	CBDivE_004257	CC1=NC(=Cc2cc(Br)cc(Br)c2O)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E18	compound treatment	1.102	-0.0196	-0.26	1.177	0.0127	0.17	-0.0653	-0.2064	1915211	CBDivE_004258	COc1ccccc1NC(=S)NC(NC(=O)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E19	compound treatment	1.122	3.59E-4	0.0	1.146	-0.0183	-0.25	-0.1734	-0.6933	1915212	CBDivE_004259	CCOC(=O)c1c(NC(=O)CSc2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	E20	compound treatment	1.102	-0.0196	-0.26	1.179	0.0147	0.2	-0.046	-0.1385	1915213	CBDivE_004260	Cc1cc2/C(=N\Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F01	compound treatment	1.043	-0.0786	-1.06	1.136	-0.0283	-0.39	-1.0234	-0.9064	1089087	CBDivE_004261	CC(=O)c1cccc(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F02	compound treatment	1.085	-0.0366	-0.49	1.153	-0.0113	-0.15	-0.4588	-0.8859	1199925	CBDivE_004262	CCCOc1ccccc1NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F03	compound treatment	1.106	-0.0156	-0.21	1.166	0.00166	0.02	-0.1332	-0.6275	1915214	CBDivE_004263	CCc1ccccc1NC(=O)COc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F04	compound treatment	1.099	-0.0226	-0.31	1.158	-0.00634	-0.09	-0.2771	-0.8729	1915215	CBDivE_004264	CN1/C(=C\C=N\c2cccc(c2)C(=O)O)/C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F05	compound treatment	1.183	0.0614	0.83	1.154	-0.0103	-0.14	0.4856	0.5784	1522785	CBDivE_004265	CCc1ccc(OCC(=O)NCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F06	compound treatment	1.12	-0.00164	-0.02	1.138	-0.0263	-0.36	-0.2696	-0.7493	1620288	CBDivE_004266	CN1CCN(CC(O)COc2ccc(cc2)C3(CC4CC5CC(C4)C3)C5)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F07	compound treatment	1.147	0.0254	0.34	1.139	-0.0253	-0.35	-0.0024	-0.0049	1915216	CBDivE_004267	CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccccc4[N+](=O)[O-])ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F08	compound treatment	1.165	0.0434	0.58	1.182	0.0177	0.24	0.5839	0.9231	1915217	CBDivE_004268	[O-][N+](=O)c1cccc(NCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F09	compound treatment	1.185	0.0634	0.85	1.173	0.00866	0.12	0.6879	0.7973	1194238	CBDivE_004269	CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccccc4)ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F10	compound treatment	1.094	-0.0276	-0.37	1.141	-0.0233	-0.32	-0.4887	-0.9969	1915218	CBDivE_004270	Oc1cccc(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F11	compound treatment	1.139	0.0174	0.23	1.152	-0.0123	-0.17	0.0466	0.1617	1915219	CBDivE_004271	CCOc1ccc(NC(=O)c2cc(C)cc(C)c2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F12	compound treatment	1.148	0.0264	0.36	1.113	-0.0513	-0.7	-0.2436	-0.3102	1560196	CBDivE_004272	COc1ccc2[nH]cc(CCNC(=O)c3ccc(Cl)cc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F13	compound treatment	1.126	0.00436	0.06	1.193	0.0287	0.39	0.318	0.8044	1377868	CBDivE_004273	O=S(=O)(NCc1ccccc1)C2CCS(=O)(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F14	compound treatment	1.143	0.0214	0.29	1.219	0.0547	0.75	0.7308	0.9145	1915220	CBDivE_004274	Clc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F15	compound treatment	1.149	0.0274	0.37	1.147	-0.0173	-0.24	0.0938	0.214	1160883	CBDivE_004275	O=S(=O)(C1CCS(=O)(=O)C1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F16	compound treatment	1.115	-0.00664	-0.09	1.132	-0.0323	-0.44	-0.3752	-0.8337	1915221	CBDivE_004276	Oc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F17	compound treatment	1.157	0.0354	0.48	1.161	-0.00334	-0.05	0.3051	0.6368	1915222	CBDivE_004277	OC(=O)/C=C/c1cccc(NS(=O)(=O)c2ccc(O)c(c2)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F18	compound treatment	1.139	0.0174	0.23	1.197	0.0327	0.45	0.4805	0.9549	1915223	CBDivE_004278	Oc1c(CC=C)cccc1/C=N/NC(=O)Cc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F19	compound treatment	1.145	0.0234	0.32	1.14	-0.0243	-0.33	-0.0118	-0.0259	1915224	CBDivE_004279	Cc1c(NC(NC(=O)CF)C(Cl)(Cl)Cl)c(=O)n(c2ccccc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	F20	compound treatment	1.113	-0.00864	-0.12	1.171	0.00666	0.09	-0.0182	-0.123	1915225	CBDivE_004280	Cn1c(COc2ccc(Cl)cc2Cl)[n+](C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G01	compound treatment	1.098	-0.0236	-0.32	1.135	-0.0293	-0.4	-0.5084	-0.9937	1915226	CBDivE_004281	CC/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G02	compound treatment	1.136	0.0144	0.19	1.147	-0.0173	-0.24	-0.0302	-0.0988	3007559	CBDivE_004282	CCCc1nc2ccccc2c(N)c1CC.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G03	compound treatment	1.182	0.0604	0.81	1.172	0.00766	0.1	0.6497	0.7914	1915227	CBDivE_004283	OC(=O)c1ccccc1C(=O)NNc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G04	compound treatment	1.102	-0.0196	-0.26	1.153	-0.0113	-0.15	-0.2967	-0.9671	1467758	CBDivE_004284	Cc1ccc2[nH]c3C(CCCc3c2c1)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G05	compound treatment	1.119	-0.00264	-0.04	1.114	-0.0503	-0.69	-0.5106	-0.7428	1016507	CBDivE_004285	Cc1ccc(NCC(O)C(O)C(O)CO)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G06	compound treatment	1.129	0.00736	0.1	1.204	0.0397	0.54	0.4526	0.8232	1915228	CBDivE_004286	Cc1ccccc1NN2C(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G07	compound treatment	1.1	-0.0216	-0.29	1.173	0.00866	0.12	-0.1229	-0.3903	1915229	CBDivE_004287	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccc(cc4)[N+](=O)[O-])C1(C)C5C2C(=O)N(C5=O)c6ccc(cc6)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G08	compound treatment	1.114	-0.00764	-0.1	1.192	0.0277	0.38	0.1938	0.4957	1263901	CBDivE_004288	CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G09	compound treatment	1.143	0.0214	0.29	1.136	-0.0283	-0.39	-0.0695	-0.1442	1915230	CBDivE_004289	CC(C)COC(=O)NCCCOC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G10	compound treatment	1.071	-0.0506	-0.68	1.2	0.0357	0.49	-0.1392	-0.166	1780856	CBDivE_004290	CCCOC(=O)CNc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G11	compound treatment	1.114	-0.00764	-0.1	1.172	0.00766	0.1	0.001	0.0068	1668146	CBDivE_004291	Cc1ccc2n3CCN(CC(O)COc4ccccc4)C5CCCc(c53)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G12	compound treatment	1.064	-0.0576	-0.78	1.167	0.00266	0.04	-0.5242	-0.6734	1915231	CBDivE_004292	COc1cc2[n+](CCCS(=O)(=O)O)c(C)sc2cc1SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G13	compound treatment	1.107	-0.0146	-0.2	1.144	-0.0203	-0.28	-0.3358	-0.9862	1915232	CBDivE_004293	Cc1ccc([N+](=O)[O-])c2c3CCC/C(=N\CCO)/c3[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G14	compound treatment	1.152	0.0304	0.41	1.207	0.0427	0.58	0.701	0.9852	1351042	CBDivE_004294	O=C(Nc1ccccc1)Nc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G15	compound treatment	1.143	0.0214	0.29	1.113	-0.0513	-0.7	-0.2913	-0.3847	1915233	CBDivE_004295	[O-][N+](=O)c1ccc(/C=N/N=C/c2ccc(o2)[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G16	compound treatment	1.182	0.0604	0.81	1.158	-0.00634	-0.09	0.5147	0.6285	1915234	CBDivE_004296	COc1cc(F)nc(NC(=O)Nc2ccc3ccccc3c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G17	compound treatment	1.161	0.0394	0.53	1.161	-0.00334	-0.05	0.3433	0.6441	1775892	CBDivE_004297	[O-][N+](=O)C1(C(CC(=O)c2ccccc2)c3ccccc3)C(=O)c4ccccc4C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G18	compound treatment	1.143	0.0214	0.29	1.195	0.0307	0.42	0.4994	0.9835	1915235	CBDivE_004298	CC(=O)NC(NC(=S)Nc1cccc(c1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G19	compound treatment	1.16	0.0384	0.52	1.186	0.0217	0.3	0.5748	0.9646	1278666	CBDivE_004299	Nc1sc2CCCCc2c1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	G20	compound treatment	1.233	0.111	1.5	1.21	0.0457	0.62	1.5026	0.924	1915236	CBDivE_004300	Cc1ccc2NC(=O)/C(=N\c3cccc4c(=O)[nH][nH]c(=O)c34)/c2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H01	compound treatment	1.113	-0.00864	-0.12	1.179	0.0147	0.2	0.059	0.2547	1202819	CBDivE_004301	O=C(NCCc1ccccc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H02	compound treatment	1.077	-0.0446	-0.6	1.138	-0.0263	-0.36	-0.6798	-0.9695	1210031	CBDivE_004302	CCOc1ccccc1NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H03	compound treatment	1.126	0.00436	0.06	1.099	-0.0653	-0.89	-0.5884	-0.659	1027164	CBDivE_004303	COC(=O)c1ccc(NC(=O)CCl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H04	compound treatment	1.14	0.0184	0.25	1.157	-0.00734	-0.1	0.1044	0.3908	1915237	CBDivE_004304	[O-][N+](=O)c1ccc(cc1)c2cc(nc(=O)[nH]2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H05	compound treatment	1.123	0.00136	0.02	1.192	0.0277	0.38	0.2797	0.7406	1585073	CBDivE_004305	CCc1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H06	compound treatment	1.126	0.00436	0.06	1.165	6.63E-4	0.01	0.048	0.8063	1116313	CBDivE_004306	OC(=O)Cn1c(=S)sc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H07	compound treatment	1.164	0.0424	0.57	1.169	0.00466	0.06	0.449	0.781	1915238	CBDivE_004307	[O-][N+](=O)c1ccc(/C=C/2\N3CCC(CC3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H08	compound treatment	1.142	0.0204	0.27	1.149	-0.0153	-0.21	0.0463	0.1342	1915239	CBDivE_004308	CC1CCN(CN2C(=O)C(=O)c3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H09	compound treatment	1.132	0.0104	0.14	1.086	-0.0783	-1.07	-0.6565	-0.6094	1453125	CBDivE_004309	CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(C)cc4)ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H10	compound treatment	1.145	0.0234	0.32	1.195	0.0307	0.42	0.5185	0.9903	1915240	CBDivE_004310	Cc1cccc(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H11	compound treatment	1.145	0.0234	0.32	1.157	-0.00734	-0.1	0.1521	0.46	1915241	CBDivE_004311	Clc1ccccc1C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H12	compound treatment	1.086	-0.0356	-0.48	1.095	-0.0693	-0.95	-1.0086	-0.9508	1638314	CBDivE_004312	CCCc1cc2C(=O)C(COc2cc1OC)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H13	compound treatment	1.123	0.00136	0.02	1.112	-0.0523	-0.71	-0.4917	-0.6887	1915242	CBDivE_004313	O=C(/N=C/1\NC2CS(=O)(=O)CC2S1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H14	compound treatment	1.165	0.0434	0.58	1.164	-3.38E-4	0.0	0.4104	0.7015	1915243	CBDivE_004314	Oc1ccc2ccccc2c1/C=N\NC(=O)Cc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H15	compound treatment	1.082	-0.0396	-0.53	1.19	0.0257	0.35	-0.1307	-0.2045	1915244	CBDivE_004315	O=C1CN2CSCC2C(=O)N1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H16	compound treatment	1.14	0.0184	0.25	1.161	-0.00334	-0.05	0.143	0.5677	1295783	CBDivE_004316	Cc1sc2ncnc(NCc3ccccc3)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H17	compound treatment	1.143	0.0214	0.29	1.152	-0.0123	-0.17	0.0848	0.2541	1915245	CBDivE_004317	Cc1cc(C)n2nc(CCCCc3nc4nc(C)cc(C)n4n3)nc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H18	compound treatment	1.126	0.00436	0.06	1.129	-0.0353	-0.48	-0.2992	-0.6162	1915246	CBDivE_004318	O=C(Cc1cccc2ccccc12)N/N=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H19	compound treatment	1.09	-0.0316	-0.43	1.169	0.00466	0.06	-0.2569	-0.5952	1915247	CBDivE_004319	CC(=O)NC(NC(=S)Nc1c(C)n(C)n(c2ccccc2)c1=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	H20	compound treatment	1.186	0.0644	0.87	1.149	-0.0153	-0.21	0.4661	0.5218	1915248	CBDivE_004320	C(/C(=N\Nc1ccccc1)/c2ccccc2)c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I01	compound treatment	1.095	-0.0266	-0.36	1.228	0.0637	0.87	0.3597	0.3829	1915249	CBDivE_004321	C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I02	compound treatment	1.143	0.0214	0.29	1.235	0.0707	0.96	0.8851	0.8801	3106096	CBDivE_004322	CCc1nc2ccccc2c(N)c1C.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I03	compound treatment	1.114	-0.00764	-0.1	1.18	0.0157	0.21	0.0781	0.3295	1915250	CBDivE_004323	FC(F)(C(=O)NC1CCCCC1)C(F)(F)C(F)(F)C(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I04	compound treatment	1.115	-0.00664	-0.09	1.12	-0.0443	-0.6	-0.4909	-0.8031	1374540	CBDivE_004324	Cc1ccc2[nH]c3C(CCCc3c2c1)NCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I05	compound treatment	1.085	-0.0366	-0.49	1.116	-0.0483	-0.66	-0.8156	-0.9899	1915251	CBDivE_004325	NNC(=O)CCCCC1SC[C@H]2NC(=O)N[C@@H]12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I06	compound treatment	1.132	0.0104	0.14	1.183	0.0187	0.25	0.2788	0.9602	1915252	CBDivE_004326	CC(=O)c1c(C)n(c2ccccc2)c3ccc(O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I07	compound treatment	1.147	0.0254	0.34	1.147	-0.0173	-0.24	0.0747	0.1797	1915253	CBDivE_004327	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccccc4[N+](=O)[O-])C1(C)C5C2C(=O)N(C5=O)c6ccccc6[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I08	compound treatment	1.082	-0.0396	-0.53	1.17	0.00566	0.08	-0.3235	-0.5988	1740222	CBDivE_004328	O=C(OCCN1CCOCC1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I09	compound treatment	1.122	3.59E-4	0.0	1.146	-0.0183	-0.25	-0.1734	-0.6933	1915254	CBDivE_004329	Clc1ccc(NC(=O)OCCNC(=O)Oc2ccccc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I10	compound treatment	1.107	-0.0146	-0.2	1.212	0.0477	0.65	0.3199	0.471	1915255	CBDivE_004330	CCCCCCn1c(csc1=Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I11	compound treatment	1.107	-0.0146	-0.2	1.158	-0.00634	-0.09	-0.2008	-0.9313	1915256	CBDivE_004331	O/N=C/1\CCCc2c1[nH]c3ccc(cc23)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I12	compound treatment	1.077	-0.0446	-0.6	1.182	0.0177	0.24	-0.2555	-0.394	1915257	CBDivE_004332	[O-][N+](=O)c1ccc(OCC(=O)N2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I13	compound treatment	1.171	0.0494	0.67	1.214	0.0497	0.68	0.9497	1.0	1915258	CBDivE_004333	CC/1=NN(C(=O)\C1=C\c2ccc(cc2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I14	compound treatment	1.124	0.00236	0.03	1.186	0.0217	0.3	0.2314	0.7788	1290712	CBDivE_004334	Clc1ccc(OCC(=O)NCCc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I15	compound treatment	1.12	-0.00164	-0.02	1.169	0.00466	0.06	0.0293	0.4353	1915259	CBDivE_004335	Clc1ccc(Cl)c(NC(=O)C(=O)N/N=C\2/C(=O)Nc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I16	compound treatment	1.139	0.0174	0.23	1.209	0.0447	0.61	0.5963	0.9138	1915260	CBDivE_004336	COc1cc(F)nc(NC(=O)Nc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I17	compound treatment	1.075	-0.0466	-0.63	1.194	0.0297	0.4	-0.1589	-0.2124	1915261	CBDivE_004337	CC(=C)C(=O)NNS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I18	compound treatment	1.092	-0.0296	-0.4	1.196	0.0317	0.43	0.0226	0.0383	1915262	CBDivE_004338	COc1ccc(NC(=S)NC(NC(=O)C)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I19	compound treatment	1.155	0.0334	0.45	1.156	-0.00834	-0.11	0.2378	0.5124	1028781	CBDivE_004339	CCOC(=O)c1c(C)oc2ccc(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	I20	compound treatment	1.129	0.00736	0.1	1.213	0.0487	0.66	0.5394	0.804	1915263	CBDivE_004340	Cc1ccc2NC(=O)/C(=N\NC(=O)Nc3ccccc3)/c2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J01	compound treatment	1.102	-0.0196	-0.26	1.194	0.0297	0.4	0.0987	0.204	1502196	CBDivE_004341	CCc1ccc(OCC(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J02	compound treatment	1.146	0.0244	0.33	1.236	0.0717	0.98	0.9234	0.8956	1915264	CBDivE_004342	O=C(CN1C(=O)c2cccc3cccc(C1=O)c23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J03	compound treatment	1.075	-0.0466	-0.63	1.181	0.0167	0.23	-0.2843	-0.4249	1343988	CBDivE_004343	CCc1nc2n(C)c(=O)n(C)c(=O)c2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J04	compound treatment	1.106	-0.0156	-0.21	1.148	-0.0163	-0.22	-0.3067	-0.9996	1915265	CBDivE_004344	COc1ccc(cc1)C(CC(=O)c2ccc(Br)cc2)Sc3ccccc3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J05	compound treatment	1.154	0.0324	0.44	1.101	-0.0633	-0.86	-0.302	-0.3121	1662111	CBDivE_004345	CCc1ccc(OCC(=O)Nc2nccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J06	compound treatment	1.144	0.0224	0.3	1.167	0.00266	0.04	0.239	0.7865	1915266	CBDivE_004346	Cc1cc[n+](CCC(=O)O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J07	compound treatment	1.182	0.0604	0.81	1.179	0.0147	0.2	0.7172	0.8553	1915267	CBDivE_004347	N/C=C/1\C(=O)N(c2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J08	compound treatment	1.111	-0.0106	-0.14	1.131	-0.0333	-0.45	-0.423	-0.8872	1435875	CBDivE_004348	Cc1cc(=O)oc2cc(OCC(=O)Nc3ccccc3Cl)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J09	compound treatment	1.146	0.0244	0.33	1.158	-0.00634	-0.09	0.1713	0.504	1915268	CBDivE_004349	CN1/C(=C/C=C2C(=O)NC(=S)NC2=O)/C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J10	compound treatment	1.167	0.0454	0.61	1.17	0.00566	0.08	0.4873	0.7901	1516059	CBDivE_004350	NS(=O)(=O)c1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J11	compound treatment	1.13	0.00836	0.11	1.185	0.0207	0.28	0.279	0.9192	1865015	CBDivE_004351	Cn1cnc([N+](=O)[O-])c1C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J12	compound treatment	1.12	-0.00164	-0.02	1.181	0.0167	0.23	0.145	0.6352	1915269	CBDivE_004352	CCCCOC(=O)c1ccc(CC(=O)c2ccc(O)cc2O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J13	compound treatment	1.144	0.0224	0.3	1.166	0.00166	0.02	0.2293	0.7581	1915270	CBDivE_004353	OC(CCl)Cn1nnnc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J14	compound treatment	1.098	-0.0236	-0.32	1.161	-0.00334	-0.05	-0.2577	-0.7999	1915271	CBDivE_004354	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)Cc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J15	compound treatment	1.14	0.0184	0.25	1.147	-0.0173	-0.24	0.008	0.0232	1915272	CBDivE_004355	CSCCC(NC=C1C(=O)CC(C)(C)CC1=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J16	compound treatment	1.074	-0.0476	-0.64	1.147	-0.0173	-0.24	-0.6216	-0.9078	1103188	CBDivE_004356	C(CNc1ncnc2sc3CCCCc3c12)CN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J17	compound treatment	1.154	0.0324	0.44	1.095	-0.0693	-0.95	-0.3599	-0.3456	1741479	CBDivE_004357	OC(Cn1nnnc1c2ccccc2)Cn3nnnc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J18	compound treatment	1.116	-0.00564	-0.08	1.157	-0.00734	-0.1	-0.1246	-0.9909	1915273	CBDivE_004358	Cc1ccc(O)c(/C=N\NC(=O)c2ccnn2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J19	compound treatment	1.094	-0.0276	-0.37	1.136	-0.0283	-0.39	-0.5369	-0.9998	1915274	CBDivE_004359	CC(C)CC(=O)NC(NC(=S)Nc1ccc2ccccc2c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	J20	compound treatment	1.09	-0.0316	-0.43	1.16	-0.00434	-0.06	-0.3437	-0.7975	1915275	CBDivE_004360	OCCCNC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K01	compound treatment	1.106	-0.0156	-0.21	1.154	-0.0103	-0.14	-0.2489	-0.9808	1915276	CBDivE_004361	CC/C(=N\NC(=S)N)/CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K02	compound treatment	1.139	0.0174	0.23	1.162	-0.00234	-0.03	0.1431	0.6053	3106116	CBDivE_004362	Cc1cc(N)c2ccccc2n1.OC(=O)c1cc(=O)[nH]c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K03	compound treatment	1.101	-0.0206	-0.28	1.155	-0.00934	-0.13	-0.2869	-0.9371	1915277	CBDivE_004363	Cc1c(NC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)c(=O)n(c2ccccc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K04	compound treatment	1.15	0.0284	0.38	1.173	0.00866	0.12	0.3541	0.8842	1915278	CBDivE_004364	Cn1c(CNC2(CC3CC4CC(C3)C2)C4)c(c5ccccc5)c6cc(ccc16)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K05	compound treatment	1.113	-0.00864	-0.12	1.204	0.0397	0.54	0.3	0.5423	1729953	CBDivE_004365	O=C(NC1CSCC1OC(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K06	compound treatment	1.116	-0.00564	-0.08	1.123	-0.0413	-0.56	-0.4524	-0.7953	1915279	CBDivE_004366	NNc1nc2ccccc2nc1S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K07	compound treatment	1.084	-0.0376	-0.51	1.168	0.00366	0.05	-0.3238	-0.6345	1915280	CBDivE_004367	O=C1C2C(C(C=CC2c3ccccc3)c4ccccc4)C(=O)N1c5cccc(c5)N6C(=O)C7C(C(C=CC7c8ccccc8)c9ccccc9)C6=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K08	compound treatment	1.159	0.0374	0.5	1.16	-0.00434	-0.06	0.3146	0.6199	1915281	CBDivE_004368	CCOC(=O)c1c(NC(=O)CSc2nnnn2c3ccccc3)sc4CCCCc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K09	compound treatment	1.104	-0.0176	-0.24	1.178	0.0137	0.19	-0.0365	-0.1209	1915282	CBDivE_004369	CC(C)OC(=O)NCCOC(=O)Nc1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K10	compound treatment	1.116	-0.00564	-0.08	1.217	0.0527	0.72	0.454	0.6287	1167	CBDivE_004370	NCCCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K11	compound treatment	1.141	0.0194	0.26	1.162	-0.00234	-0.03	0.1621	0.6162	1915283	CBDivE_004371	Fc1ccc(N/N=C/2\CCCCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K12	compound treatment	1.146	0.0244	0.33	1.153	-0.0113	-0.15	0.1231	0.3388	1915284	CBDivE_004372	COC(=O)c1ccc(NC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K13	compound treatment	1.106	-0.0156	-0.21	1.087	-0.0773	-1.05	-0.8949	-0.8321	1915285	CBDivE_004373	NNC(=O)/C(=C\C=C\c1ccccc1)/CCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K14	compound treatment	1.163	0.0414	0.56	1.241	0.0767	1.05	1.1338	0.9568	1915286	CBDivE_004374	CC(=O)c1cccc(NC(=O)COc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K15	compound treatment	1.108	-0.0136	-0.18	1.183	0.0187	0.25	0.0498	0.1587	1915287	CBDivE_004375	COc1c(Cl)cc(Cl)cc1C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K16	compound treatment	1.19	0.0684	0.92	1.181	0.0167	0.23	0.8128	0.8557	1915288	CBDivE_004376	Oc1ccccc1/C=N/c2cccc3c(\N=C\c4ccccc4O)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K17	compound treatment	1.128	0.00636	0.09	1.169	0.00466	0.06	0.1056	0.9891	1701072	CBDivE_004377	OC(=O)CCCC(=O)N1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K18	compound treatment	1.129	0.00736	0.1	1.185	0.0207	0.28	0.2694	0.9019	1915289	CBDivE_004378	CC(C)COc1ccc(cc1)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K19	compound treatment	1.146	0.0244	0.33	1.186	0.0217	0.3	0.4413	0.9986	1177758	CBDivE_004379	CCOC(=O)c1c(NC(=O)C)sc2c(O)c(Br)cc(Br)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	K20	compound treatment	1.154	0.0324	0.44	1.224	0.0597	0.81	0.884	0.9574	1915290	CBDivE_004380	CC1(C)CC(=O)C/C(=N/NC(=O)Nc2ccccc2)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L01	compound treatment	1.111	-0.0106	-0.14	1.196	0.0317	0.43	0.2038	0.4479	1915291	CBDivE_004381	C/C(=N\O)/c1ccc(OCCOc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L02	compound treatment	1.087	-0.0346	-0.47	1.172	0.00766	0.1	-0.2566	-0.5358	790507	CBDivE_004382	OC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L03	compound treatment	1.16	0.0384	0.52	1.194	0.0297	0.4	0.6519	0.9926	1915292	CBDivE_004383	ClC(Cl)(Cl)C1=NP2(=NC(=N1)c3ccccc3)OCCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L04	compound treatment	1.173	0.0514	0.69	1.207	0.0427	0.58	0.9013	0.9962	1403595	CBDivE_004384	O=C(Nc1nc(cs1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L05	compound treatment	1.069	-0.0526	-0.71	1.174	0.00966	0.13	-0.409	-0.5662	1915293	CBDivE_004385	CC(C)CC(=O)NC(NC(=S)Nc1cc(C)ccc1C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L06	compound treatment	1.114	-0.00764	-0.1	1.18	0.0157	0.21	0.0781	0.3295	1915294	CBDivE_004386	[O-][N+](=O)c1ccccc1S(=O)(=O)Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L07	compound treatment	1.117	-0.00464	-0.06	1.132	-0.0323	-0.44	-0.3561	-0.7995	1915295	CBDivE_004387	FC(F)(F)c1cccc(N/N=C\2/C(=O)N(N=C2CSc3ccc(Cl)cc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L08	compound treatment	1.114	-0.00764	-0.1	1.098	-0.0663	-0.9	-0.7125	-0.7826	1339628	CBDivE_004388	CCc1ccccc1NC(=O)COc2ccc3c(C)cc(=O)oc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L09	compound treatment	1.139	0.0174	0.23	1.165	6.63E-4	0.01	0.172	0.7338	1915296	CBDivE_004389	C=C(S(=O)(=O)c1ccccc1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L10	compound treatment	1.13	0.00836	0.11	1.138	-0.0263	-0.36	-0.1742	-0.4628	1306410	CBDivE_004390	CC(C)c1ccc(C)cc1OCC(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L11	compound treatment	1.107	-0.0146	-0.2	1.175	0.0107	0.15	-0.0368	-0.1502	1131726	CBDivE_004391	CC(=O)n1c2c3CCCCc3[nH]c2c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L12	compound treatment	1.057	-0.0646	-0.87	1.151	-0.0133	-0.18	-0.7452	-0.8366	1915297	CBDivE_004392	COc1ccc(C(=O)/C=C/c2cc3ccccc3o2)c(OCc4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L13	compound treatment	1.106	-0.0156	-0.21	1.132	-0.0323	-0.44	-0.461	-0.9431	1526764	CBDivE_004393	N1C(=CC(c2ccccc2)n3nnnc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L14	compound treatment	1.127	0.00536	0.07	1.132	-0.0323	-0.44	-0.2607	-0.5834	1915298	CBDivE_004394	Cc1n[nH]c(Nc2ccc(cc2)C(=O)O)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L15	compound treatment	1.074	-0.0476	-0.64	1.126	-0.0383	-0.52	-0.8241	-0.9947	1915299	CBDivE_004395	COc1ccc(CN/C=C\2/C(=O)CNC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L16	compound treatment	1.103	-0.0186	-0.25	1.135	-0.0293	-0.4	-0.4607	-0.975	1645266	CBDivE_004396	Cc1ccc(Nc2ncnc3sc4CCCCc4c23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L17	compound treatment	1.086	-0.0356	-0.48	1.19	0.0257	0.35	-0.0925	-0.1556	1915300	CBDivE_004397	[O-][N+](=O)c1ccc(cc1)C2Oc3ccccc3C4CC(=NN42)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L18	compound treatment	1.079	-0.0426	-0.58	1.177	0.0127	0.17	-0.2847	-0.474	1915301	CBDivE_004398	Cn1nccc1C(=O)N/N=C\c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L19	compound treatment	1.127	0.00536	0.07	1.155	-0.00934	-0.13	-0.0389	-0.2657	1614558	CBDivE_004399	CC(C)C(=O)NC(c1ccccc1)c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	L20	compound treatment	1.039	-0.0826	-1.11	1.16	-0.00434	-0.06	-0.8302	-0.7436	1915302	CBDivE_004400	OCCNC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M01	compound treatment	1.144	0.0224	0.3	1.159	-0.00534	-0.07	0.1618	0.5215	1623858	CBDivE_004401	OC(CC(c1ccccc1)c2c(O)c3ccccc3oc2=O)c4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M02	compound treatment	1.141	0.0194	0.26	1.174	0.00966	0.13	0.2778	0.9498	1915303	CBDivE_004402	OC(=O)CCCN/C=C\1/C(=O)Nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M03	compound treatment	1.068	-0.0536	-0.72	1.207	0.0427	0.58	-0.1003	-0.1081	1915304	CBDivE_004403	CC1C=CC(=C(O)C1C(=O)O)N=Nc2ccc(cc2)c3ccc(N=Nc4ccc(C)c(C(=O)O)c4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M04	compound treatment	1.129	0.00736	0.1	1.184	0.0197	0.27	0.2598	0.9086	1137100	CBDivE_004404	CC1(C)Cc2c(cnn2c3ccccc3)-c4[nH]c5ccccc5c41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M05	compound treatment	1.116	-0.00564	-0.08	1.152	-0.0123	-0.17	-0.1728	-0.9357	1222145	CBDivE_004405	CC(C)N1CC(COc2ccccc2)OC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M06	compound treatment	1.141	0.0194	0.26	1.19	0.0257	0.35	0.4321	0.9896	1915305	CBDivE_004406	Cc1cc2/C(=N\NC(=O)C3CC3(c4ccccc4)c5ccccc5)/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M07	compound treatment	1.116	-0.00564	-0.08	1.19	0.0257	0.35	0.1936	0.5407	1634583	CBDivE_004407	CC(=O)Oc1ccc(cc1)N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M08	compound treatment	1.113	-0.00864	-0.12	1.145	-0.0193	-0.26	-0.2689	-0.9326	1618285	CBDivE_004408	COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2CN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M09	compound treatment	1.096	-0.0256	-0.35	1.114	-0.0503	-0.69	-0.73	-0.9497	1397341	CBDivE_004409	CC1ON(C(=O)NC1=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M10	compound treatment	1.092	-0.0296	-0.4	1.176	0.0117	0.16	-0.1703	-0.3957	1915306	CBDivE_004410	CCCC(=O)NC(NC(=S)Nc1ccc(OC)cc1[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M11	compound treatment	1.164	0.0424	0.57	1.165	6.63E-4	0.01	0.4105	0.7182	1774284	CBDivE_004411	OC1CCCc2c1[nH]c3ccc(cc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M12	compound treatment	1.106	-0.0156	-0.21	1.156	-0.00834	-0.11	-0.2296	-0.9579	1915307	CBDivE_004412	OC(=O)c1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M13	compound treatment	1.101	-0.0206	-0.28	1.164	-3.38E-4	0.0	-0.2002	-0.7187	1524576	CBDivE_004413	CC1(C)CCCC2(C)C(C(=O)NN)C(C)(O)CCC12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M14	compound treatment	1.092	-0.0296	-0.4	1.183	0.0187	0.25	-0.1028	-0.2169	1065779	CBDivE_004414	O=C(NCCc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M15	compound treatment	1.147	0.0254	0.34	1.149	-0.0153	-0.21	0.094	0.2345	1915308	CBDivE_004415	COc1ccc(cc1)C2CC(=NN2)C3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M16	compound treatment	1.148	0.0264	0.36	1.161	-0.00334	-0.05	0.2193	0.6116	1915309	CBDivE_004416	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C(=O)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M17	compound treatment	1.159	0.0374	0.5	1.134	-0.0303	-0.41	0.0639	0.0979	1915310	CBDivE_004417	Cc1c(C(c2c(C)n(C)n(c3ccccc3)c2=O)c4cc(ccc4O)[N+](=O)[O-])c(=O)n(c5ccccc5)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M18	compound treatment	1.154	0.0324	0.44	1.221	0.0567	0.77	0.855	0.9635	1915311	CBDivE_004418	CC(=O)c1ccc(OCCOc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M19	compound treatment	1.085	-0.0366	-0.49	1.162	-0.00234	-0.03	-0.3721	-0.7511	1915312	CBDivE_004419	NCCOC(=O)c1ccccc1C(=O)OCCN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	M20	compound treatment	1.094	-0.0276	-0.37	1.168	0.00366	0.05	-0.2284	-0.607	1915313	CBDivE_004420	CC(C)C/C(=N\NC(=O)Nc1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N01	compound treatment	1.088	-0.0336	-0.45	1.155	-0.00934	-0.13	-0.4109	-0.8718	1774543	CBDivE_004421	[O-][N+](=O)c1ccc(OCC(=O)Oc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N02	compound treatment	1.13	0.00836	0.11	1.178	0.0137	0.19	0.2115	0.9711	536	CBDivE_004422	ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N03	compound treatment	1.042	-0.0796	-1.07	1.132	-0.0323	-0.44	-1.0715	-0.9226	1915314	CBDivE_004423	CCC(=O)NC(NC(=S)Nc1ccccc1OC)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N04	compound treatment	1.133	0.0114	0.15	1.145	-0.0193	-0.26	-0.0781	-0.2561	1164067	CBDivE_004424	CCCc1ccc(OCC(O)CN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N05	compound treatment	1.189	0.0674	0.91	1.192	0.0277	0.38	0.9093	0.9242	1915315	CBDivE_004425	CC(C)CC(=O)NC(NC(=S)Nc1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N06	compound treatment	1.089	-0.0326	-0.44	1.167	0.00266	0.04	-0.2857	-0.6466	3008639	CBDivE_004426	C/C(=C/c1sc2ccccc2[n+]1C)/O.Cc1ccc(cc1)[SH](=O)(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N07	compound treatment	1.069	-0.0526	-0.71	1.128	-0.0363	-0.5	-0.8525	-0.9845	1915317	CBDivE_004427	CC/1=NN(C(=O)\C1=N\Nc2c(C)n(C)n(c3ccccc3)c2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N08	compound treatment	1.07	-0.0516	-0.7	1.161	-0.00334	-0.05	-0.5248	-0.7517	1915318	CBDivE_004428	O=C(NCCc1ccccc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N09	compound treatment	1.088	-0.0336	-0.45	1.223	0.0587	0.8	0.2447	0.2661	1915319	CBDivE_004429	Nc1ccc2oc3ccc(N)cc3c(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N10	compound treatment	1.14	0.0184	0.25	1.19	0.0257	0.35	0.4226	0.9857	1915320	CBDivE_004430	Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N11	compound treatment	1.118	-0.00364	-0.05	1.152	-0.0123	-0.17	-0.1537	-0.8769	1541103	CBDivE_004431	COc1ccc(OC)c(c1)C(O)c2coc3ccc(O)c(CN(C)C)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N12	compound treatment	1.098	-0.0236	-0.32	1.156	-0.00834	-0.11	-0.3059	-0.9035	1502519	CBDivE_004432	COC(=O)c1ccc(CC(=O)c2c(O)cc(O)cc2O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N13	compound treatment	1.143	0.0214	0.29	1.095	-0.0693	-0.95	-0.4648	-0.4703	1915321	CBDivE_004433	COc1ccc(cc1)c2n(CC(=O)OC3CC(C)CCC3C(C)C)c4ccccc4[n+]2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N14	compound treatment	1.132	0.0104	0.14	1.184	0.0197	0.27	0.2884	0.9539	1915322	CBDivE_004434	Cc1cc(C)c(OCC(=O)N/N=C/c2ccccc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N15	compound treatment	1.083	-0.0386	-0.52	1.108	-0.0563	-0.77	-0.9118	-0.9822	1915323	CBDivE_004435	Cc1ccc(NC(=O)C2=C3Nc4ccccc4N3CCC2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N16	compound treatment	1.089	-0.0326	-0.44	1.154	-0.0103	-0.14	-0.411	-0.889	1915324	CBDivE_004436	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2ccccc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N17	compound treatment	1.078	-0.0436	-0.59	1.139	-0.0253	-0.35	-0.6606	-0.9677	1637794	CBDivE_004437	CCN(CC)Cn1c(=S)n(CN(CC)CC)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N18	compound treatment	1.051	-0.0706	-0.95	1.173	0.00866	0.12	-0.5903	-0.6148	1915325	CBDivE_004438	Cc1nc2sc3CCCCc3c2c(=O)n1/N=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N19	compound treatment	1.142	0.0204	0.27	1.12	-0.0443	-0.6	-0.2333	-0.3513	1029224	CBDivE_004439	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	N20	compound treatment	1.112	-0.00964	-0.13	1.181	0.0167	0.23	0.0687	0.2624	1915326	CBDivE_004440	Brc1cnc(NC(=S)NC(=O)c2ccccc2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O01	compound treatment	1.127	0.00536	0.07	1.19	0.0257	0.35	0.2986	0.8356	1915327	CBDivE_004441	COc1ccc(cc1)C(=O)CSC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O02	compound treatment	1.134	0.0124	0.17	1.253	0.0887	1.21	0.9728	0.7971	1913265	CBDivE_004442	CCCCN1C(=N)C(CC)(CC)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O03	compound treatment	1.108	-0.0136	-0.18	1.212	0.0477	0.65	0.3295	0.4877	1915328	CBDivE_004443	CSc1cccc2cc(ccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O04	compound treatment	1.111	-0.0106	-0.14	1.145	-0.0193	-0.26	-0.288	-0.9591	1915329	CBDivE_004444	C(c1ccccc1)n2c-3c(CCc4c3cnn4c5ccccc5)c6ccccc26
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O05	compound treatment	1.064	-0.0576	-0.78	1.168	0.00366	0.05	-0.5145	-0.6603	1915330	CBDivE_004445	CCOC(=O)c1[nH]c2CCC(=C(Cl)c2c1C)C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O06	compound treatment	1.151	0.0294	0.4	1.191	0.0267	0.36	0.5372	0.9991	1915331	CBDivE_004446	Cc1cc2/C(=N\NC(=O)c3ccccc3[N+](=O)[O-])/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O07	compound treatment	1.092	-0.0296	-0.4	1.155	-0.00934	-0.13	-0.3728	-0.8883	1498022	CBDivE_004447	O=C1C2C(C(C=CC2c3ccccc3)c4ccccc4)C(=O)N1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O08	compound treatment	1.149	0.0274	0.37	1.122	-0.0423	-0.58	-0.1472	-0.2149	1915332	CBDivE_004448	COc1cccc(NC(=O)c2sc(nc2c3ccc(cc3)[N+](=O)[O-])c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O09	compound treatment	1.167	0.0454	0.61	1.169	0.00466	0.06	0.4777	0.7764	1915333	CBDivE_004449	ON(C(=O)Nc1cccc(c1)[N+](=O)[O-])c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O10	compound treatment	1.13	0.00836	0.11	1.157	-0.00734	-0.1	0.009	0.0596	1218859	CBDivE_004450	Cc1ccc(cc1)c2ccc(cc2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O11	compound treatment	1.107	-0.0146	-0.2	1.136	-0.0283	-0.39	-0.4129	-0.9514	1778167	CBDivE_004451	[O-][N+](=O)c1ccc2[nH]c3C(=O)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O12	compound treatment	1.15	0.0284	0.38	1.219	0.0547	0.75	0.7976	0.952	1167592	CBDivE_004452	CCOc1ccc(NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O13	compound treatment	1.102	-0.0196	-0.26	1.169	0.00466	0.06	-0.1424	-0.5226	1915334	CBDivE_004453	Cc1ccccc1NC(=O)C2CC=CCC2C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O14	compound treatment	1.135	0.0134	0.18	1.206	0.0417	0.57	0.5292	0.8878	1915335	CBDivE_004454	FC(F)(F)c1cccc(NC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O15	compound treatment	1.126	0.00436	0.06	1.173	0.00866	0.12	0.1251	0.9481	1915336	CBDivE_004455	COc1ccc(C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O16	compound treatment	1.143	0.0214	0.29	1.197	0.0327	0.45	0.5187	0.9778	1915337	CBDivE_004456	COc1ccccc1NC(=O)Nc2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O17	compound treatment	1.121	-6.41E-4	-0.01	1.205	0.0407	0.55	0.386	0.696	1915338	CBDivE_004457	Cc1c(C(c2c(C)n(C)n(c3ccccc3)c2=O)c4cc(Br)cc(Br)c4O)c(=O)n(c5ccccc5)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O18	compound treatment	1.131	0.00936	0.13	1.19	0.0257	0.35	0.3367	0.9051	1915339	CBDivE_004458	[O-][N+](=O)c1ccc(OCC(=O)Oc2ccc(cc2)C(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O19	compound treatment	1.129	0.00736	0.1	1.203	0.0387	0.53	0.443	0.8258	1915340	CBDivE_004459	CN(C)C(=N)NC(=N)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	O20	compound treatment	1.144	0.0224	0.3	1.203	0.0387	0.53	0.5861	0.9649	1915341	CBDivE_004460	Cc1cc2/C(=N\N=C/3\C(=O)Nc4cc(Br)c(C)cc34)/C(=O)Nc2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P01	compound treatment	1.118	-0.00364	-0.05	1.151	-0.0133	-0.18	-0.1633	-0.867	1915342	CBDivE_004461	CC(C)(C)C(=O)NNC(=O)c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P02	compound treatment	1.12	-0.00164	-0.02	1.162	-0.00234	-0.03	-0.0382	-0.9841	1915343	CBDivE_004462	O=C(CCCCCN1C(=O)c2cccc3cccc(C1=O)c23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P03	compound treatment	1.134	0.0124	0.17	1.192	0.0277	0.38	0.3846	0.9326	1915344	CBDivE_004463	CC(C)CC(=O)NC(NC(=S)Nc1ccccc1C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P04	compound treatment	1.128	0.00636	0.09	1.161	-0.00334	-0.05	0.0285	0.2933	1516084	CBDivE_004464	CCCc1ccc(OCC(O)CN2CCN(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P05	compound treatment	1.13	0.00836	0.11	1.113	-0.0513	-0.7	-0.4153	-0.5856	1915345	CBDivE_004465	CC(C)CC(=O)NC(NC(=S)Nc1cccc(c1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P06	compound treatment	1.099	-0.0226	-0.31	1.129	-0.0353	-0.48	-0.5567	-0.9758	1915346	CBDivE_004466	OC(=O)C[N+]1=C2SCCN2CC1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P07	compound treatment	1.123	0.00136	0.02	1.101	-0.0633	-0.86	-0.5978	-0.6919	1601723	CBDivE_004467	COC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P08	compound treatment	1.1	-0.0216	-0.29	1.097	-0.0673	-0.92	-0.8557	-0.8881	1116058	CBDivE_004468	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P09	compound treatment	1.123	0.00136	0.02	1.171	0.00666	0.09	0.0772	0.833	1054099	CBDivE_004469	C(CCc1nc2ccccc2o1)Cc3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P10	compound treatment	1.053	-0.0686	-0.93	1.112	-0.0523	-0.71	-1.1594	-0.9917	1915347	CBDivE_004470	Oc1ccc2ccccc2c1/C=N/NC(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P11	compound treatment	1.002	-0.12	-1.61	1.06	-0.104	-1.42	-2.1474	-0.998	1915348	CBDivE_004471	O=C1c2ccccc2C(=O)c3c1ccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P12	compound treatment	1.114	-0.00764	-0.1	1.127	-0.0373	-0.51	-0.4329	-0.8334	1915349	CBDivE_004472	Oc1cc(O)c2c(=O)c(coc2c1)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P13	compound treatment	1.082	-0.0396	-0.53	1.142	-0.0223	-0.3	-0.5935	-0.9644	1915350	CBDivE_004473	CC(C)C1CCC(C)CC1OC(=O)Cn2c(COc3ccccc3)[n+](C)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P14	compound treatment	1.13	0.00836	0.11	1.133	-0.0313	-0.43	-0.2224	-0.5033	1915351	CBDivE_004474	Cc1cccc(OCC(=O)N/N=C/c2cccc(I)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P15	compound treatment	1.081	-0.0406	-0.55	1.149	-0.0153	-0.21	-0.5356	-0.9127	1915352	CBDivE_004475	[O-][N+](=O)c1ccccc1NC(=O)C2=C3Nc4ccccc4N3CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P16	compound treatment	1.094	-0.0276	-0.37	1.119	-0.0453	-0.62	-0.7008	-0.9707	1915353	CBDivE_004476	Brc1cc2OCOc2cc1/C=N/NC(=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P17	compound treatment	1.065	-0.0566	-0.76	1.162	-0.00234	-0.03	-0.5629	-0.736	1915354	CBDivE_004477	Cc1nc2nc(cn2nc1C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P18	compound treatment	1.11	-0.0116	-0.16	1.137	-0.0273	-0.37	-0.3746	-0.9262	1915355	CBDivE_004478	Oc1cccc(c1)C(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P19	compound treatment	1.049	-0.0726	-0.98	1.133	-0.0313	-0.43	-0.9951	-0.9308	1493412	CBDivE_004479	Cc1ccc(NC(=O)c2ccc(Br)o2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.14	P20	compound treatment	1.085	-0.0366	-0.49	1.177	0.0127	0.17	-0.2274	-0.4344	1080231	CBDivE_004480	COc1ccc(cc1)C(CC(=O)c2ccccc2)Sc3ccccc3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A01	compound treatment	1.117	-0.00398	-0.05	1.209	0.0518	0.71	0.4617	0.6515	1915356	CBDivE_004481	O=C(N/N=C(/N=C/c1ccc2OCOc2c1)\c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A02	compound treatment	1.069	-0.052	-0.7	1.211	0.0538	0.73	0.0231	0.0228	1915357	CBDivE_004482	CC1(C)CC(CC(C)(C)N1)NCC(O)COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A03	compound treatment	1.142	0.021	0.28	1.226	0.0688	0.94	0.8641	0.8814	1915358	CBDivE_004483	OCCN1C(=O)c2cccc3c(Cl)ccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A04	compound treatment	1.152	0.031	0.42	1.203	0.0458	0.62	0.7378	0.981	1915359	CBDivE_004484	CCN(CC)CCNC(=O)CN1Cc2c(cnn2c3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A05	compound treatment	1.073	-0.048	-0.65	1.179	0.0218	0.3	-0.2473	-0.3471	1915360	CBDivE_004485	COc1ccccc1/C=N/NC(=O)Cc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A06	compound treatment	1.185	0.064	0.86	1.177	0.0198	0.27	0.8018	0.886	1629234	CBDivE_004486	O=C(CSc1ccccc1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A07	compound treatment	1.148	0.027	0.36	1.147	-0.0102	-0.14	0.1596	0.4092	1915361	CBDivE_004487	Cc1cc(C)nc(NS(=O)(=O)c2ccc(/N=C/c3c(O)ccc4ccccc34)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A08	compound treatment	1.184	0.063	0.85	1.151	-0.00618	-0.08	0.5416	0.6339	1915362	CBDivE_004488	CN(C)/C=C/1\CC(=O)N(Cc2ccccc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A09	compound treatment	1.082	-0.039	-0.53	1.221	0.0638	0.87	0.2436	0.2395	1915363	CBDivE_004489	Oc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A10	compound treatment	1.149	0.028	0.38	1.207	0.0498	0.68	0.7477	0.9617	1915364	CBDivE_004490	Cc1cccc(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A11	compound treatment	1.146	0.025	0.34	1.14	-0.0172	-0.23	0.073	0.1778	1556892	CBDivE_004491	O=C(CC(C1C(=O)NC(=O)NC1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A12	compound treatment	1.152	0.031	0.42	1.202	0.0448	0.61	0.7281	0.9829	1915365	CBDivE_004492	CCOC(=O)c1c(NC(=O)c2c(cnn2C)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A13	compound treatment	1.135	0.014	0.19	1.166	0.00882	0.12	0.2188	0.9761	1246433	CBDivE_004493	COc1ccc(cc1)C(=O)c2coc3c2cc(O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A14	compound treatment	1.142	0.021	0.28	1.115	-0.0422	-0.58	-0.2062	-0.3215	1915366	CBDivE_004494	[O-][N+](=O)c1cccc(/C=N/NC(=O)COc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A15	compound treatment	1.102	-0.019	-0.26	1.183	0.0258	0.35	0.0679	0.1561	1915367	CBDivE_004495	Cc1cccc2[n+]([O-])c3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A16	compound treatment	1.201	0.08	1.08	1.162	0.00482	0.07	0.8098	0.7488	1915368	CBDivE_004496	[O-][n+]1c2ccccc2nc3c(Cl)cccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A17	compound treatment	1.073	-0.048	-0.65	1.18	0.0228	0.31	-0.2376	-0.3309	1915369	CBDivE_004497	Cc1ccc(/C=C/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/c3ccccc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A18	compound treatment	1.168	0.047	0.63	1.164	0.00682	0.09	0.5143	0.8022	1915370	CBDivE_004498	NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A19	compound treatment	1.076	-0.045	-0.61	1.217	0.0598	0.82	0.1478	0.1453	1915371	CBDivE_004499	COc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(O)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	A20	compound treatment	1.093	-0.028	-0.38	1.205	0.0478	0.65	0.1942	0.2578	1383013	CBDivE_004500	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3cccnc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B01	compound treatment	1.134	0.013	0.18	1.216	0.0588	0.8	0.6914	0.842	1915372	CBDivE_004501	NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B02	compound treatment	1.155	0.034	0.46	1.171	0.0138	0.19	0.4578	0.9227	1915373	CBDivE_004502	[O-][N+](=O)c1ccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B03	compound treatment	1.131	0.01	0.14	1.118	-0.0392	-0.53	-0.2822	-0.512	1915374	CBDivE_004503	CCN(CC(O)COc1ccc(cc1)[N+](=O)[O-])S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B04	compound treatment	1.197	0.076	1.03	1.21	0.0528	0.72	1.2345	0.9851	1915375	CBDivE_004504	CCC(=O)NC(Nc1c(C)n(C)n(c2ccccc2)c1=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B05	compound treatment	1.156	0.035	0.47	1.145	-0.0122	-0.17	0.2166	0.4326	1397737	CBDivE_004505	Cc1ccc2n3CC(=O)N(Cc4ccccc4)C5CCCc(c53)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B06	compound treatment	1.13	0.00902	0.12	1.155	-0.00218	-0.03	0.065	0.5192	1915376	CBDivE_004506	O=C(N/N=C\1/C(=O)Nc2ccccc12)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B07	compound treatment	1.066	-0.055	-0.74	1.173	0.0158	0.22	-0.3719	-0.4815	1740367	CBDivE_004507	Cc1cc(C)c(OCC(O)CNC2CC(C)(C)NC(C)(C)C2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B08	compound treatment	1.149	0.028	0.38	1.096	-0.0612	-0.83	-0.3226	-0.3522	1915377	CBDivE_004508	BrCc1cn2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B09	compound treatment	1.082	-0.039	-0.53	1.115	-0.0422	-0.58	-0.7785	-0.999	1915378	CBDivE_004509	CC(C)C(=O)NC(NC(=S)Nc1ccccc1O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B10	compound treatment	1.155	0.034	0.46	1.182	0.0248	0.34	0.5639	0.9888	1915379	CBDivE_004510	Cc1ccc(cc1)C(=O)NC(Nc2ccccc2[N+](=O)[O-])C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B11	compound treatment	1.051	-0.07	-0.94	1.135	-0.0222	-0.3	-0.8814	-0.8891	1915380	CBDivE_004511	CC(C)c1ccc(C)cc1OCC(=O)Nc2cccc(c2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B12	compound treatment	1.185	0.064	0.86	1.128	-0.0292	-0.4	0.3294	0.3464	1915381	CBDivE_004512	Cc1nc2cc(NC(=O)c3ccc(cc3)[N+](=O)[O-])ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B13	compound treatment	1.158	0.037	0.5	1.145	-0.0122	-0.17	0.2357	0.4479	1284809	CBDivE_004513	COC(=O)C1C(C(C(=O)OC)S(=O)(=O)C(CCN2CCCCC2)S1(=O)=O)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B14	compound treatment	1.06	-0.061	-0.82	1.178	0.0208	0.28	-0.3809	-0.4377	1912548	CBDivE_004514	[O-][N+](=O)c1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B15	compound treatment	1.158	0.037	0.5	1.184	0.0268	0.37	0.6118	0.9883	1915382	CBDivE_004515	N=c1n(c2ccccc2)c(=N)n(c3ccccc3)c(=N)n1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B16	compound treatment	1.156	0.035	0.47	1.116	-0.0412	-0.56	-0.063	-0.0858	1351942	CBDivE_004516	CC(C)(C)c1ccc(cc1)S(=O)(=O)CCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B17	compound treatment	1.143	0.022	0.3	1.108	-0.0492	-0.67	-0.2641	-0.3601	1915383	CBDivE_004517	NCC(O)COCCN1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B18	compound treatment	1.17	0.049	0.66	1.128	-0.0292	-0.4	0.1863	0.2414	1915384	CBDivE_004518	CCOC(=O)c1c(C)c(sc1NC(=O)c2ccccc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B19	compound treatment	1.178	0.057	0.77	1.187	0.0298	0.41	0.8315	0.9556	1026284	CBDivE_004519	NC(c1ccccc1)c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	B20	compound treatment	1.171	0.05	0.67	1.142	-0.0152	-0.21	0.3308	0.4687	1915385	CBDivE_004520	CC(C)(C)C(=O)NC(NC(=S)Nc1sc2CCCCc2c1C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C01	compound treatment	1.085	-0.036	-0.49	1.163	0.00582	0.08	-0.2871	-0.5837	1915386	CBDivE_004521	Cc1n[nH]cc1/N=C\c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C02	compound treatment	1.144	0.023	0.31	1.181	0.0238	0.32	0.4493	0.9997	1671263	CBDivE_004522	COc1ccc(OCC(O)CNC2CC(C)(C)NC(C)(C)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C03	compound treatment	1.136	0.015	0.2	1.156	-0.00118	-0.02	0.1319	0.649	1774956	CBDivE_004523	COc1ccc(cc1)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C04	compound treatment	1.164	0.043	0.58	1.146	-0.0112	-0.15	0.3026	0.5043	1915387	CBDivE_004524	O=C/1CNC(=O)\C1=C\NC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C05	compound treatment	1.111	-0.00998	-0.13	1.163	0.00582	0.08	-0.0391	-0.2499	1915388	CBDivE_004525	COc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C06	compound treatment	1.168	0.047	0.63	1.175	0.0178	0.24	0.6204	0.9133	1355232	CBDivE_004526	CC1(C)CC2Oc3ccccc3C(C2C(=O)C1)C4=C(O)CC(C)(C)CC4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C07	compound treatment	1.11	-0.011	-0.15	1.107	-0.0502	-0.68	-0.5886	-0.8407	1915389	CBDivE_004527	C/C(=N\NC(=O)c1ccnn1C)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C08	compound treatment	1.121	2.19E-5	0.0	1.186	0.0288	0.39	0.2781	0.7076	1211019	CBDivE_004528	Nc1c(sc2nccc(Nc3ccccc3)c12)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C09	compound treatment	1.125	0.00402	0.05	1.102	-0.0552	-0.75	-0.4937	-0.6544	1915390	CBDivE_004529	ClCCC(=O)Nc1ccc(OCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C10	compound treatment	1.137	0.016	0.22	1.151	-0.00618	-0.08	0.0933	0.402	1915391	CBDivE_004530	COc1c(Cl)cc(Cl)cc1C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C11	compound treatment	1.139	0.018	0.24	1.141	-0.0162	-0.22	0.0159	0.0485	1492881	CBDivE_004531	CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nc(C)cc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C12	compound treatment	1.151	0.03	0.41	1.184	0.0268	0.37	0.545	0.9987	1915392	CBDivE_004532	Cn1ncc([N+](=Nc2cc(C(=O)Nc3ccc(Cl)cc3)n(C)n2)[O-])c1C(=O)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C13	compound treatment	1.063	-0.058	-0.78	1.138	-0.0192	-0.26	-0.738	-0.8948	1915393	CBDivE_004533	Cc1ccc(cc1)C(=O)c2coc3C=C(Br)C(=O)C(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C14	compound treatment	1.113	-0.00798	-0.11	1.18	0.0228	0.31	0.1439	0.4371	1915394	CBDivE_004534	CCOC(=O)CCNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C15	compound treatment	1.162	0.041	0.55	1.165	0.00782	0.11	0.4667	0.8281	1915395	CBDivE_004535	[O-][N+](=O)c1cccc(NCn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C16	compound treatment	1.18	0.059	0.8	1.146	-0.0112	-0.15	0.4552	0.5615	1915396	CBDivE_004536	CC1(C)OC2C(CO)OC(C2O1)n3cnc4c(=O)[nH]cnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C17	compound treatment	1.138	0.017	0.23	1.147	-0.0102	-0.14	0.0642	0.2394	1915397	CBDivE_004537	[O-][N+](=O)c1cccc(CN(C(=O)c2ccco2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C18	compound treatment	1.131	0.01	0.14	1.189	0.0318	0.43	0.4024	0.8854	1915398	CBDivE_004538	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(F)cc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C19	compound treatment	1.109	-0.012	-0.16	1.164	0.00682	0.09	-0.0485	-0.2601	1915399	CBDivE_004539	CCOC(=O)c1c(NC(=O)CN2CCOCC2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	C20	compound treatment	1.12	-9.78E-4	-0.01	1.167	0.00982	0.13	0.0854	0.6344	1915400	CBDivE_004540	NC(=O)c1sc2ncc(cc2c1N)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D01	compound treatment	1.13	0.00902	0.12	1.173	0.0158	0.22	0.2386	0.9633	1915401	CBDivE_004541	O=C(NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D02	compound treatment	1.149	0.028	0.38	1.124	-0.0332	-0.45	-0.0526	-0.0892	1915402	CBDivE_004542	COc1ccc(cc1)C(=O)NC(NC(=S)Nc2cccc(NC(=O)C)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D03	compound treatment	1.076	-0.045	-0.61	1.144	-0.0132	-0.18	-0.5561	-0.8788	1915403	CBDivE_004543	Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D04	compound treatment	1.086	-0.035	-0.47	1.115	-0.0422	-0.58	-0.7404	-0.9952	1915404	CBDivE_004544	FCC(=O)NC(Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D05	compound treatment	1.147	0.026	0.35	1.173	0.0158	0.22	0.4008	0.9727	1670481	CBDivE_004545	Cc1ccc2[nH]c3C(CCCc3c2c1)NC=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D06	compound treatment	1.093	-0.028	-0.38	1.115	-0.0422	-0.58	-0.6736	-0.9791	1915405	CBDivE_004546	COC(=O)c1ccc(NCN2C(=O)C(=O)c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D07	compound treatment	1.172	0.051	0.69	1.151	-0.00618	-0.08	0.4271	0.6159	1737928	CBDivE_004547	CCc1cc(C(=O)Cc2nc3ccccc3s2)c(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D08	compound treatment	1.166	0.045	0.61	1.148	-0.00918	-0.13	0.341	0.5498	1915406	CBDivE_004548	CSC(=S)N/N=C(\c1ccccc1)/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D09	compound treatment	1.096	-0.025	-0.34	1.166	0.00882	0.12	-0.1532	-0.4282	1915407	CBDivE_004549	CC(C)C(=O)NC(NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D10	compound treatment	1.161	0.04	0.54	1.148	-0.00918	-0.13	0.2933	0.5291	1915408	CBDivE_004550	Cc1ccc(cc1)C(=O)NC(Nc2cccc(c2)[N+](=O)[O-])C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D11	compound treatment	1.173	0.052	0.7	1.149	-0.00818	-0.11	0.4174	0.5874	1702532	CBDivE_004551	CC(C)c1ccc(C)cc1OCC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D12	compound treatment	1.116	-0.00498	-0.07	1.138	-0.0192	-0.26	-0.2324	-0.8608	1915409	CBDivE_004552	CN1/C(=C\C=N\c2ccc3ccccc3c2)/C(C)(C)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D13	compound treatment	1.163	0.042	0.57	1.141	-0.0162	-0.22	0.2449	0.4025	1698288	CBDivE_004553	COC(=O)C1C(NC(C(C(=O)OC)S1(=O)=O)c2ccc(OC)c(OC)c2)c3ccc(OC)c(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D14	compound treatment	1.108	-0.013	-0.18	1.162	0.00482	0.07	-0.0773	-0.4134	1912568	CBDivE_004554	Brc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D15	compound treatment	1.115	-0.00598	-0.08	1.132	-0.0252	-0.34	-0.2998	-0.8501	1025944	CBDivE_004555	Nc1ccc(Cc2ccc(N)c(c2)C(=O)O)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D16	compound treatment	1.13	0.00902	0.12	1.108	-0.0492	-0.67	-0.3881	-0.5695	1644388	CBDivE_004556	O=S(=O)(CCc1ccncc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D17	compound treatment	1.132	0.011	0.15	1.124	-0.0332	-0.45	-0.2148	-0.451	1915410	CBDivE_004557	CN(CC(O)CNS(=O)(=O)O)CC(O)COc1ccc(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D18	compound treatment	1.154	0.033	0.45	1.148	-0.00918	-0.13	0.2265	0.4895	1915411	CBDivE_004558	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C\2/C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D19	compound treatment	1.093	-0.028	-0.38	1.179	0.0218	0.3	-0.0565	-0.1175	1915412	CBDivE_004559	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	D20	compound treatment	1.127	0.00602	0.08	1.155	-0.00218	-0.03	0.0364	0.4212	1915413	CBDivE_004560	CC(C)C(=O)NC(NC(=S)Nc1sc2CCCCc2c1C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E01	compound treatment	1.122	0.00102	0.01	1.158	8.21E-4	0.01	0.0177	0.9947	1915414	CBDivE_004561	COc1ccc(/C=N\NC(=O)c2ccn[nH]2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E02	compound treatment	1.152	0.031	0.42	1.155	-0.00218	-0.03	0.2749	0.6552	1915415	CBDivE_004562	Cc1cc(C)c(OCC(O)CNC(C)(C)CC(C)(C)C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E03	compound treatment	1.138	0.017	0.23	1.123	-0.0342	-0.47	-0.1672	-0.3218	1022830	CBDivE_004563	[O-][N+](=O)c1cccc2C(=O)N(Cc3ccccc3)C(=O)c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E04	compound treatment	1.155	0.034	0.46	1.188	0.0308	0.42	0.6217	0.999	1915416	CBDivE_004564	OC(=O)c1ccc(CN/C=C\2/C(=O)CNC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E05	compound treatment	1.139	0.018	0.24	1.13	-0.0272	-0.37	-0.0902	-0.2034	1915417	CBDivE_004565	Oc1ccccc1/C=N/NC(=O)Cc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E06	compound treatment	1.171	0.05	0.67	1.179	0.0218	0.3	0.6876	0.9323	1915418	CBDivE_004566	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3ccccc3[N+](=O)[O-])C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E07	compound treatment	1.091	-0.03	-0.4	1.179	0.0218	0.3	-0.0756	-0.1505	1915419	CBDivE_004567	CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E08	compound treatment	1.149	0.028	0.38	1.15	-0.00718	-0.1	0.1981	0.5073	1915420	CBDivE_004568	COc1ccccc1NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E09	compound treatment	1.179	0.058	0.78	1.13	-0.0272	-0.37	0.2914	0.3365	1064869	CBDivE_004569	COc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E10	compound treatment	1.127	0.00602	0.08	1.174	0.0168	0.23	0.2196	0.9026	1915421	CBDivE_004570	Oc1c(CC=C)cccc1/C=N/NC(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E11	compound treatment	1.061	-0.06	-0.81	1.143	-0.0142	-0.19	-0.7089	-0.8521	1915422	CBDivE_004571	Oc1ccc(Cl)cc1/C=N\NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E12	compound treatment	1.097	-0.024	-0.32	1.176	0.0188	0.26	-0.0473	-0.1144	1777455	CBDivE_004572	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E13	compound treatment	1.077	-0.044	-0.59	1.215	0.0578	0.79	0.138	0.1399	1915423	CBDivE_004573	OCCN/C=C\1/Nc2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E14	compound treatment	1.134	0.013	0.18	1.249	0.0918	1.25	1.0096	0.7985	1915424	CBDivE_004574	CCC(=O)NC(NC(=S)Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E15	compound treatment	1.117	-0.00398	-0.05	1.162	0.00482	0.07	0.0085	0.1006	1915425	CBDivE_004575	CC(=O)Nc1cc2nc3ccccc3nc2cc1NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E16	compound treatment	1.08	-0.041	-0.55	1.156	-0.00118	-0.02	-0.4023	-0.7274	1017677	CBDivE_004576	[O-][n+]1c2ccccc2[n+]([O-])c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E17	compound treatment	1.079	-0.042	-0.57	1.178	0.0208	0.28	-0.1997	-0.3152	1533947	CBDivE_004577	OC(=O)C#Cc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E18	compound treatment	1.1	-0.021	-0.28	1.156	-0.00118	-0.02	-0.2115	-0.7461	1915426	CBDivE_004578	Fc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E19	compound treatment	1.067	-0.054	-0.73	1.144	-0.0132	-0.18	-0.642	-0.8559	1915427	CBDivE_004579	COc1cc(/C=N/Nc2ncnc3sc4CCCCc4c23)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	E20	compound treatment	1.116	-0.00498	-0.07	1.181	0.0238	0.32	0.1822	0.5493	1915428	CBDivE_004580	CCOC(=O)c1sc2ncc(cc2c1N)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F01	compound treatment	1.092	-0.029	-0.39	1.148	-0.00918	-0.13	-0.3649	-0.8891	1915429	CBDivE_004581	COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccccc3)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F02	compound treatment	1.084	-0.037	-0.5	1.126	-0.0312	-0.43	-0.6534	-0.9968	1915430	CBDivE_004582	COc1ccc(cc1)C(=O)NC(NC(=S)Nc2cccc3cccnc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F03	compound treatment	1.116	-0.00498	-0.07	1.143	-0.0142	-0.19	-0.1842	-0.9	1915431	CBDivE_004583	COc1ccc(OCC(O)CNS(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F04	compound treatment	1.103	-0.018	-0.24	1.179	0.0218	0.3	0.0389	0.1013	1915432	CBDivE_004584	FCC(=O)NC(Nc1ccc2ccccc2c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F05	compound treatment	1.197	0.076	1.03	1.143	-0.0142	-0.19	0.5885	0.5639	1261243	CBDivE_004585	Cc1ccc2n3CNCC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F06	compound treatment	1.144	0.023	0.31	1.123	-0.0342	-0.47	-0.11	-0.1963	1915433	CBDivE_004586	CC(C)(C)C(=O)NC(NC(=S)Nc1cccc(c1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F07	compound treatment	1.142	0.021	0.28	1.13	-0.0272	-0.37	-0.0615	-0.1319	1150021	CBDivE_004587	O=C(NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F08	compound treatment	1.141	0.02	0.27	1.154	-0.00318	-0.04	0.1603	0.5861	1433954	CBDivE_004588	C(Nc1ccccc1)c2cn3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F09	compound treatment	1.118	-0.00298	-0.04	1.163	0.00582	0.08	0.0277	0.3116	1915434	CBDivE_004589	CC(C)C(=O)NC(NC(=S)Nc1cc(Cl)ccc1Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F10	compound treatment	1.124	0.00302	0.04	1.135	-0.0222	-0.3	-0.185	-0.6063	1915435	CBDivE_004590	Cc1ccc(cc1)C(=O)NC(Nc2ccc3ccccc3c2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F11	compound treatment	1.127	0.00602	0.08	1.154	-0.00318	-0.04	0.0268	0.2909	1915436	CBDivE_004591	CC(C)NCC(O)COCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F12	compound treatment	1.153	0.032	0.43	1.109	-0.0482	-0.66	-0.1591	-0.2023	1915437	CBDivE_004592	CC(=O)NC(NC(=S)Nc1sc2CCCCc2c1C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F13	compound treatment	1.134	0.013	0.18	1.177	0.0198	0.27	0.3153	0.9782	1915438	CBDivE_004593	C/C(=N\NC(=O)c1ccncc1)/COc2ccccc2OCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F14	compound treatment	1.133	0.012	0.16	1.188	0.0308	0.42	0.4119	0.9143	1267778	CBDivE_004594	COc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F15	compound treatment	1.154	0.033	0.45	1.163	0.00582	0.08	0.3711	0.8202	1915439	CBDivE_004595	OC(=O)c1ccc(cc1)C2(OC(=O)c3ccccc32)c4ccc(cc4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F16	compound treatment	1.088	-0.033	-0.44	1.12	-0.0372	-0.51	-0.6731	-0.9979	1915440	CBDivE_004596	CCC(C)c1ccc(cc1)S(=O)(=O)CCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F17	compound treatment	1.135	0.014	0.19	1.142	-0.0152	-0.21	-0.0126	-0.045	1915441	CBDivE_004597	COc1ccccc1NCC(O)CN(C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F18	compound treatment	1.141	0.02	0.27	1.214	0.0568	0.77	0.7389	0.9005	1915442	CBDivE_004598	Ic1ccc(NC(=O)CCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F19	compound treatment	1.146	0.025	0.34	1.118	-0.0392	-0.53	-0.1391	-0.2201	1915443	CBDivE_004599	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	F20	compound treatment	1.164	0.043	0.58	1.168	0.0108	0.15	0.5147	0.8595	1915444	CBDivE_004600	Cc1ccc(cc1)C(=O)NC(NC(=S)Nc2sc3CCCCc3c2C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G01	compound treatment	1.092	-0.029	-0.39	1.123	-0.0342	-0.47	-0.606	-0.9962	1915445	CBDivE_004601	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2ccn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G02	compound treatment	1.153	0.032	0.43	1.133	-0.0242	-0.33	0.0723	0.1331	1915446	CBDivE_004602	COc1cc(cc(OC)c1OC)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G03	compound treatment	1.138	0.017	0.23	1.161	0.00382	0.05	0.1992	0.846	1915447	CBDivE_004603	COc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G04	compound treatment	1.127	0.00602	0.08	1.143	-0.0142	-0.19	-0.0793	-0.378	1915448	CBDivE_004604	Oc1ccc(/C=C/2\C(=O)CNC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G05	compound treatment	1.108	-0.013	-0.18	1.096	-0.0612	-0.83	-0.7137	-0.8373	1915449	CBDivE_004605	[O-][N+](=O)c1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G06	compound treatment	1.132	0.011	0.15	1.185	0.0278	0.38	0.3734	0.9164	1383585	CBDivE_004606	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3c4ccccc4cc5ccccc35)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G07	compound treatment	1.096	-0.025	-0.34	1.146	-0.0112	-0.15	-0.3461	-0.9357	1915450	CBDivE_004607	Oc1ccccc1/C=N/NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G08	compound treatment	1.137	0.016	0.22	1.18	0.0228	0.31	0.3729	0.9841	1915451	CBDivE_004608	Cc1ccc(cc1)C(=O)NC(NC(=S)Nc2ccccc2C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G09	compound treatment	1.133	0.012	0.16	1.169	0.0118	0.16	0.2287	1.0	1425603	CBDivE_004609	COC(=O)NC(O)C(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G10	compound treatment	1.064	-0.057	-0.77	1.193	0.0358	0.49	-0.1981	-0.2176	1915452	CBDivE_004610	Oc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G11	compound treatment	1.148	0.027	0.36	1.165	0.00782	0.11	0.3332	0.8772	1915453	CBDivE_004611	Oc1ccc2ccccc2c1/C=N\NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G12	compound treatment	1.075	-0.046	-0.62	1.148	-0.00918	-0.13	-0.5271	-0.833	1915454	CBDivE_004612	CCOC(=O)c1c(C)c(C)sc1NC(=O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G13	compound treatment	1.093	-0.028	-0.38	1.131	-0.0262	-0.36	-0.5193	-0.9996	1915455	CBDivE_004613	CCN1C(=O)/C(=C\2/CCCCCN2)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G14	compound treatment	1.15	0.029	0.39	1.189	0.0318	0.43	0.5837	0.9987	1915456	CBDivE_004614	OC(=O)c1ccccc1NC(=S)NC(NC(=O)c2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G15	compound treatment	1.141	0.02	0.27	1.177	0.0198	0.27	0.3821	1.0	1043750	CBDivE_004615	NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G16	compound treatment	1.177	0.056	0.76	1.146	-0.0112	-0.15	0.4266	0.5533	1915457	CBDivE_004616	O=c1[nH]nc(SCc2ccccc2)c(=S)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G17	compound treatment	1.153	0.032	0.43	1.111	-0.0462	-0.63	-0.1398	-0.1831	1915458	CBDivE_004617	OC(=O)/C=C/c1cccc(NC(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G18	compound treatment	1.133	0.012	0.16	1.18	0.0228	0.31	0.3347	0.9539	1915459	CBDivE_004618	COc1nccnc1NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(F)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G19	compound treatment	1.163	0.042	0.57	1.137	-0.0202	-0.28	0.2063	0.3274	1915460	CBDivE_004619	Cc1ccc(Cn2nc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	G20	compound treatment	1.217	0.096	1.3	1.192	0.0348	0.47	1.2517	0.9073	1915461	CBDivE_004620	Nc1c(sc2ncc(cc12)[N+](=O)[O-])C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H01	compound treatment	1.112	-0.00898	-0.12	1.153	-0.00418	-0.06	-0.1259	-0.9409	1645812	CBDivE_004621	CC(C)NCC(O)Cn1c-2c(CCc3c2cnn3c4ccccc4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H02	compound treatment	1.071	-0.05	-0.67	1.153	-0.00418	-0.06	-0.5171	-0.7642	1915462	CBDivE_004622	COc1ccc(cc1)C(=O)NC(NC(=S)Nc2ccc(cc2)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H03	compound treatment	1.141	0.02	0.27	1.098	-0.0592	-0.81	-0.3796	-0.4461	1915463	CBDivE_004623	CN(CC(O)COc1ccc2ccccc2c1Br)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H04	compound treatment	1.14	0.019	0.26	1.145	-0.0122	-0.17	0.064	0.2094	1915464	CBDivE_004624	Cc1ccc(cc1)C(=O)NC(Nc2cccc(Br)c2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H05	compound treatment	1.124	0.00302	0.04	1.17	0.0128	0.17	0.1524	0.8492	1688351	CBDivE_004625	NC(=O)c1c2N(Cc3ccccc3)CCc2cnc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H06	compound treatment	1.131	0.01	0.14	1.109	-0.0482	-0.66	-0.369	-0.5501	1915465	CBDivE_004626	NS(=O)c1ccc(NC(=S)NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H07	compound treatment	1.124	0.00302	0.04	1.15	-0.00718	-0.1	-0.0404	-0.3809	1701504	CBDivE_004627	Nc1nnc(CCN2C(=O)c3ccccc3C2=O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H08	compound treatment	1.164	0.043	0.58	1.169	0.0118	0.16	0.5244	0.8705	1189815	CBDivE_004628	O=C(Nc1nc(cs1)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H09	compound treatment	1.128	0.00702	0.09	1.074	-0.0832	-1.13	-0.7351	-0.6458	1017678	CBDivE_004629	COc1ccc2nc3ccccc3[n+]([O-])c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H10	compound treatment	1.143	0.022	0.3	1.199	0.0418	0.57	0.6133	0.9538	1915466	CBDivE_004630	Cc1ccc(cc1)C(=O)NC(Nc2ccc(cc2)S(=O)(=O)N)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H11	compound treatment	1.139	0.018	0.24	1.156	-0.00118	-0.02	0.1605	0.6589	1915467	CBDivE_004631	COC(=O)c1ccccc1NC(=O)c2cc[n+]([O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H12	compound treatment	1.112	-0.00898	-0.12	1.064	-0.0932	-1.27	-0.9841	-0.771	1915468	CBDivE_004632	Cc1c(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H13	compound treatment	1.133	0.012	0.16	1.091	-0.0662	-0.9	-0.5234	-0.5709	1915469	CBDivE_004633	FC(F)(F)c1ccc(Cl)c(NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H14	compound treatment	1.137	0.016	0.22	1.182	0.0248	0.34	0.3922	0.9765	1915470	CBDivE_004634	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H15	compound treatment	1.098	-0.023	-0.31	1.19	0.0328	0.45	0.0973	0.1787	1414896	CBDivE_004635	OC(=O)c1ccc(O)cc1n2c(=O)c3ccc4c(=O)n(c5cc(O)ccc5C(=O)O)c(=O)c6ccc(c2=O)c3c46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H16	compound treatment	1.116	-0.00498	-0.07	1.169	0.0118	0.16	0.0665	0.3808	1183843	CBDivE_004636	CCCCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H17	compound treatment	1.128	0.00702	0.09	1.143	-0.0142	-0.19	-0.0697	-0.3239	1915471	CBDivE_004637	COc1ccccc1NCC(O)CN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H18	compound treatment	1.108	-0.013	-0.18	1.113	-0.0442	-0.6	-0.5498	-0.8763	1915472	CBDivE_004638	NCC(O)CNCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H19	compound treatment	1.085	-0.036	-0.49	1.158	8.21E-4	0.01	-0.3353	-0.6906	1915473	CBDivE_004639	Clc1ccccc1C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	H20	compound treatment	1.105	-0.016	-0.22	1.152	-0.00518	-0.07	-0.2024	-0.8921	1915474	CBDivE_004640	CC(C)C(=O)NC(NC(=S)Nc1cccc(O)c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I01	compound treatment	1.073	-0.048	-0.65	1.225	0.0678	0.92	0.1963	0.1739	1915475	CBDivE_004641	COc1ccc(/C=N/NC(=O)c2ccn[nH]2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I02	compound treatment	1.12	-9.78E-4	-0.01	1.251	0.0938	1.28	0.8953	0.6998	1915476	CBDivE_004642	N=C(CCN1C(=O)c2ccccc2C1=O)NNC=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I03	compound treatment	1.12	-9.78E-4	-0.01	1.167	0.00982	0.13	0.0854	0.6344	1915477	CBDivE_004643	Clc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I04	compound treatment	1.106	-0.015	-0.2	1.138	-0.0192	-0.26	-0.3278	-0.9919	1915478	CBDivE_004644	CCN(CC)CCN/C=C\1/C(=O)CNC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I05	compound treatment	1.08	-0.041	-0.55	1.114	-0.0432	-0.59	-0.8073	-0.9995	1915479	CBDivE_004645	CCOc1ccc(/C=N/NC(=O)c2ccn[nH]2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I06	compound treatment	1.132	0.011	0.15	1.174	0.0168	0.23	0.2673	0.978	1915480	CBDivE_004646	CC(NC(=O)CCC(=O)NC(C)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I07	compound treatment	1.14	0.019	0.26	1.139	-0.0182	-0.25	0.0062	0.0173	1915481	CBDivE_004647	COc1ccc(/C=N/C(=N/NC(=O)c2ccccc2)/c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I08	compound treatment	1.044	-0.077	-1.04	1.151	-0.00618	-0.08	-0.7939	-0.762	1915482	CBDivE_004648	Cc1ccc(cc1)C(=O)NC(NC(=S)Nc2ccc(cc2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I09	compound treatment	1.183	0.062	0.84	1.133	-0.0242	-0.33	0.3585	0.3986	1046649	CBDivE_004649	O=C(CSc1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I10	compound treatment	1.1	-0.021	-0.28	1.183	0.0258	0.35	0.0489	0.1082	1915483	CBDivE_004650	Fc1cccc(c1)C(=O)Oc2ccc(Oc3c(F)c(F)c(Oc4ccc(OC(=O)c5cccc(F)c5)cc4)c(F)c3F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I11	compound treatment	1.106	-0.015	-0.2	1.145	-0.0122	-0.17	-0.2603	-0.9953	1478662	CBDivE_004651	COc1ccccc1NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I12	compound treatment	1.103	-0.018	-0.24	1.169	0.0118	0.16	-0.0575	-0.1975	1441016	CBDivE_004652	COc1c(Cl)cc(Cl)cc1C(=O)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I13	compound treatment	1.129	0.00802	0.11	1.187	0.0298	0.41	0.3641	0.8652	1915484	CBDivE_004653	CCN1C(=O)/C(=C\2/CCCN2C)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I14	compound treatment	1.121	2.19E-5	0.0	1.184	0.0268	0.37	0.2588	0.7077	1915485	CBDivE_004654	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)c2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I15	compound treatment	1.091	-0.03	-0.4	1.113	-0.0442	-0.6	-0.712	-0.9812	1915486	CBDivE_004655	Nc1nc(c(N=Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I16	compound treatment	1.123	0.00202	0.03	1.195	0.0378	0.52	0.384	0.7435	1093204	CBDivE_004656	OC(=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I17	compound treatment	1.103	-0.018	-0.24	1.182	0.0248	0.34	0.0678	0.1629	1349095	CBDivE_004657	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCC(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I18	compound treatment	1.112	-0.00898	-0.12	1.186	0.0288	0.39	0.1923	0.4675	1915487	CBDivE_004658	NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I19	compound treatment	1.101	-0.02	-0.27	1.171	0.0138	0.19	-0.0573	-0.1743	1915488	CBDivE_004659	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N/N=C\c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	I20	compound treatment	1.136	0.015	0.2	1.206	0.0488	0.67	0.614	0.8824	1915489	CBDivE_004660	Cc1oc2ccc(cc2[n+]1CCCS(=O)(=O)O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J01	compound treatment	1.106	-0.015	-0.2	1.203	0.0458	0.62	0.2989	0.4552	1915490	CBDivE_004661	[O-][N+](=O)c1ccc2[nH]c(CN3CCCCC3)c(c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J02	compound treatment	1.157	0.036	0.49	1.25	0.0928	1.27	1.2386	0.9136	1915491	CBDivE_004662	CC(=O)Nc1cccc(NC(=S)NC(NC(=O)c2ccc(C)cc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J03	compound treatment	1.081	-0.04	-0.54	1.176	0.0188	0.26	-0.1999	-0.3347	1915492	CBDivE_004663	CN(CC(O)COc1cc(Cl)ccc1Cl)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J04	compound treatment	1.117	-0.00398	-0.05	1.153	-0.00418	-0.06	-0.0782	-0.9995	1915493	CBDivE_004664	Cc1ccc(cc1)C(=O)NC(Nc2ccc(Cl)cc2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J05	compound treatment	1.125	0.00402	0.05	1.078	-0.0792	-1.08	-0.7251	-0.6707	1682363	CBDivE_004665	C(c1c[nH]c2cccnc12)c3c[nH]c4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J06	compound treatment	1.15	0.029	0.39	1.162	0.00482	0.07	0.3233	0.8144	1915494	CBDivE_004666	Cc1ccc(cc1)C(=O)NC(Nc2cccc3ccccc23)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J07	compound treatment	1.146	0.025	0.34	1.171	0.0138	0.19	0.372	0.9621	1915495	CBDivE_004667	CC(C)C(=O)N(Cc1ccccc1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J08	compound treatment	1.122	0.00102	0.01	1.126	-0.0312	-0.43	-0.2909	-0.6838	1696042	CBDivE_004668	CC1(C)C(C)(C(=O)O)C21CCC2C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J09	compound treatment	1.177	0.056	0.76	1.133	-0.0242	-0.33	0.3013	0.3654	1915496	CBDivE_004669	Oc1cccc(NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J10	compound treatment	1.162	0.041	0.55	1.152	-0.00518	-0.07	0.3414	0.6119	1915497	CBDivE_004670	Cc1ccc(cc1)C(=O)NC(NCc2ccccc2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J11	compound treatment	1.128	0.00702	0.09	1.174	0.0168	0.23	0.2292	0.9235	1775074	CBDivE_004671	COC(=O)c1ccccc1OC(=O)c2cc[n+]([O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J12	compound treatment	1.096	-0.025	-0.34	1.14	-0.0172	-0.23	-0.4039	-0.9842	1915498	CBDivE_004672	ClC(Cl)(Cl)C(NC(=O)c1ccco1)NC(=S)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J13	compound treatment	1.118	-0.00298	-0.04	1.158	8.21E-4	0.01	-0.0205	-0.4914	1277516	CBDivE_004673	Cc1ccc(NC(=O)OC2CCCCC2)cc1NC(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J14	compound treatment	1.117	-0.00398	-0.05	1.136	-0.0212	-0.29	-0.2422	-0.8244	1277548	CBDivE_004674	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2cc(C)ccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J15	compound treatment	1.144	0.023	0.31	1.128	-0.0292	-0.4	-0.0617	-0.1223	1188056	CBDivE_004675	Nc1ccc(cc1C(=O)O)c2ccc(N)c(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J16	compound treatment	1.058	-0.063	-0.85	1.142	-0.0152	-0.21	-0.7471	-0.8544	1230467	CBDivE_004676	Cc1ccc(cc1)S(=O)(=O)CCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J17	compound treatment	1.131	0.01	0.14	1.057	-0.1	-1.37	-0.8704	-0.634	1915499	CBDivE_004677	CCNCC(O)COCC(O)CNCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J18	compound treatment	1.099	-0.022	-0.3	1.148	-0.00918	-0.13	-0.2982	-0.9264	1913314	CBDivE_004678	Fc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J19	compound treatment	1.102	-0.019	-0.26	1.136	-0.0212	-0.29	-0.3853	-0.9982	1915500	CBDivE_004679	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	J20	compound treatment	1.093	-0.028	-0.38	1.161	0.00382	0.05	-0.2301	-0.6038	1915501	CBDivE_004680	CC(C)C(=O)NC(NC(=S)Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K01	compound treatment	1.073	-0.048	-0.65	1.187	0.0298	0.41	-0.1701	-0.2226	1915502	CBDivE_004681	Brc1cccc(c1)C(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K02	compound treatment	1.134	0.013	0.18	1.163	0.00582	0.08	0.1803	0.9355	1052229	CBDivE_004682	CCOC(=O)C1N2CCC(CC2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K03	compound treatment	1.109	-0.012	-0.16	1.141	-0.0162	-0.22	-0.2703	-0.9883	1915503	CBDivE_004683	Oc1ccccc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K04	compound treatment	1.156	0.035	0.47	1.175	0.0178	0.24	0.5059	0.9522	1915504	CBDivE_004684	CN(C)/C(=C/1\C(=O)N(c2ccccc12)c3c(Cl)cccc3Cl)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K05	compound treatment	1.113	-0.00798	-0.11	1.162	0.00482	0.07	-0.0296	-0.2349	1416880	CBDivE_004685	COC(=O)C1CC2(CC(CC(C(=O)OC)C2=O)(C(=O)O)C1=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K06	compound treatment	1.103	-0.018	-0.24	1.144	-0.0132	-0.18	-0.2986	-0.9891	1497056	CBDivE_004686	OC(=O)c1ccccc1N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K07	compound treatment	1.048	-0.073	-0.98	1.156	-0.00118	-0.02	-0.7075	-0.7186	1915505	CBDivE_004687	CCN(CC)c1ccc(/C=N/NC(=O)c2ccncc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K08	compound treatment	1.158	0.037	0.5	1.157	-1.79E-4	0.0	0.3514	0.7036	1915506	CBDivE_004688	Cc1ccc(cc1)C(=O)NC(NC(=S)Nc2cccc(c2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K09	compound treatment	1.085	-0.036	-0.49	1.158	8.21E-4	0.01	-0.3353	-0.6906	1915507	CBDivE_004689	Cc1nn2cc(nc2s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K10	compound treatment	1.099	-0.022	-0.3	1.198	0.0408	0.56	0.184	0.2917	1105485	CBDivE_004690	CCOC(=O)c1c(NC(=O)CN2CCCCC2)scc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K11	compound treatment	1.115	-0.00598	-0.08	1.157	-1.79E-4	0.0	-0.0588	-0.7282	1237070	CBDivE_004691	O=C(CC1Sc2ccccc2NC1=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K12	compound treatment	1.134	0.013	0.18	1.147	-0.0102	-0.14	0.0261	0.1164	1653238	CBDivE_004692	COc1ccc(NC(=O)c2cc(Cl)cc(Cl)c2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K13	compound treatment	1.067	-0.054	-0.73	1.147	-0.0102	-0.14	-0.6131	-0.827	1915508	CBDivE_004693	COc1ccc(cc1)N2C(=C(CCC2=O)C(=O)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K14	compound treatment	1.19	0.069	0.93	1.197	0.0398	0.54	1.0424	0.967	1915509	CBDivE_004694	OC(=O)c1ccc(NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K15	compound treatment	1.118	-0.00298	-0.04	1.164	0.00682	0.09	0.0374	0.3687	1915510	CBDivE_004695	CC(=O)Nc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K16	compound treatment	1.164	0.043	0.58	1.181	0.0238	0.32	0.6401	0.9624	1049311	CBDivE_004696	OC(=O)c1ccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K17	compound treatment	1.144	0.023	0.31	1.175	0.0178	0.24	0.3914	0.9926	1915511	CBDivE_004697	[O-][N+](=O)c1ccc2nc(SCC(=O)c3ccccc3)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K18	compound treatment	1.141	0.02	0.27	1.159	0.00182	0.02	0.2086	0.7689	1915512	CBDivE_004698	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K19	compound treatment	1.101	-0.02	-0.27	1.163	0.00582	0.08	-0.1345	-0.4785	1915513	CBDivE_004699	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C\c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	K20	compound treatment	1.121	2.19E-5	0.0	1.203	0.0458	0.62	0.442	0.7074	1731718	CBDivE_004700	C1CN(CCN1C(c2ccccc2)c3ccccc3)C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L01	compound treatment	1.117	-0.00398	-0.05	1.17	0.0128	0.17	0.0857	0.4685	1915514	CBDivE_004701	[O-][N+](=O)c1ccc2nc3c(cc2c1)n(CCCCN4CCOCC4)c5ccccc53
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L02	compound treatment	1.084	-0.037	-0.5	1.17	0.0128	0.17	-0.2291	-0.4334	1915515	CBDivE_004702	CC(=O)Nc1cccc(NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L03	compound treatment	1.144	0.023	0.31	1.171	0.0138	0.19	0.3529	0.9713	1303422	CBDivE_004703	Nc1ccn(c2ccc(F)cc2)c(=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L04	compound treatment	1.121	2.19E-5	0.0	1.141	-0.0162	-0.22	-0.1558	-0.7062	1915516	CBDivE_004704	BrC(Br)(Br)C(NCc1ccccc1)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L05	compound treatment	1.086	-0.035	-0.47	1.152	-0.00518	-0.07	-0.3836	-0.804	1915517	CBDivE_004705	CCOC(=O)c1c(C)sc2Sc3ccccc3N(C(=O)CCN(CC)CC)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L06	compound treatment	1.112	-0.00898	-0.12	1.15	-0.00718	-0.1	-0.1549	-0.9944	1915518	CBDivE_004706	Cc1ccc(cc1)C(=O)NC(Nc2cc(Cl)ccc2Cl)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L07	compound treatment	1.121	2.19E-5	0.0	1.13	-0.0272	-0.37	-0.2619	-0.7065	1523689	CBDivE_004707	COC(=O)C(Cc1ccccc1)NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L08	compound treatment	1.116	-0.00498	-0.07	1.103	-0.0542	-0.74	-0.5699	-0.7682	1500742	CBDivE_004708	CCc1ccc(OCC(=O)Nc2ccc(OC)c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L09	compound treatment	1.144	0.023	0.31	1.158	8.21E-4	0.01	0.2275	0.7321	1625558	CBDivE_004709	COC(=O)c1cccc(NC(=O)c2ccccc2C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L10	compound treatment	1.13	0.00902	0.12	1.115	-0.0422	-0.58	-0.3206	-0.5454	1463958	CBDivE_004710	Cc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L11	compound treatment	1.104	-0.017	-0.23	1.165	0.00782	0.11	-0.0865	-0.3426	1915519	CBDivE_004711	O=C(Oc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)C(C(=O)Oc5ccc(cc5)C6(CC7CC8CC(C7)C6)C8)C9(CC%10CC%11CC(C%10)C9)C%11
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L12	compound treatment	1.111	-0.00998	-0.13	1.161	0.00382	0.05	-0.0583	-0.4042	1915520	CBDivE_004712	ClC(Cl)(Cl)C(NC(=O)c1ccco1)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L13	compound treatment	1.109	-0.012	-0.16	1.111	-0.0462	-0.63	-0.5595	-0.8607	1075939	CBDivE_004713	OCCNC(=O)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L14	compound treatment	1.133	0.012	0.16	1.135	-0.0222	-0.3	-0.0992	-0.289	1915521	CBDivE_004714	CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L15	compound treatment	1.115	-0.00598	-0.08	1.136	-0.0212	-0.29	-0.2612	-0.8712	1368280	CBDivE_004715	Nc1ccc(cc1)C(=O)c2ccc(C(=O)O)c(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L16	compound treatment	1.156	0.035	0.47	1.166	0.00882	0.12	0.4191	0.8597	1915522	CBDivE_004716	NC(=O)c1c(NC(=S)NC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L17	compound treatment	1.025	-0.096	-1.29	1.157	-1.79E-4	0.0	-0.9173	-0.7084	1915523	CBDivE_004717	OC(CCl)CN(CCc1ccccc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L18	compound treatment	1.089	-0.032	-0.43	1.179	0.0218	0.3	-0.0946	-0.1806	3008332	CBDivE_004718	OC(C(O)C(=O)O)C(=O)O.Fc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L19	compound treatment	1.178	0.057	0.77	1.204	0.0468	0.64	0.9954	0.9957	1331147	CBDivE_004719	Oc1ccc2ccccc2c1C(NC(=O)c3ccco3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	L20	compound treatment	1.067	-0.054	-0.73	1.151	-0.00618	-0.08	-0.5745	-0.7837	1915524	CBDivE_004720	CC(C)(C)C(=O)NC(NC(=S)Nc1ccc(cc1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M01	compound treatment	1.105	-0.016	-0.22	1.172	0.0148	0.2	-0.0095	-0.0322	1913353	CBDivE_004721	CC(=O)Nc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M02	compound treatment	1.121	2.19E-5	0.0	1.188	0.0308	0.42	0.2974	0.7076	1915525	CBDivE_004722	Brc1ccc(cc1)C2Nc3ccccc3NC4=C2C(=O)NC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M03	compound treatment	1.061	-0.06	-0.81	1.171	0.0138	0.19	-0.4389	-0.5283	1217861	CBDivE_004723	Cc1ccc(cc1C)N2C(=O)c3cccc4c(ccc(C2=O)c34)C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M04	compound treatment	1.142	0.021	0.28	1.196	0.0388	0.53	0.5749	0.9572	1915526	CBDivE_004724	CCO/C=C/1\C(=O)N(c2ccccc12)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M05	compound treatment	1.201	0.08	1.08	1.179	0.0218	0.3	0.9738	0.8696	1915527	CBDivE_004725	CCc1nnc(NS(=O)(=O)c2ccc(/N=C/c3cccc(Oc4ccccc4)c3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M06	compound treatment	1.1	-0.021	-0.28	1.167	0.00982	0.13	-0.1054	-0.3367	1915528	CBDivE_004726	OC(=O)c1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)c4ccc5C(=O)N(C(=O)c5c4)c6ccc(cc6)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M07	compound treatment	1.115	-0.00598	-0.08	1.174	0.0168	0.23	0.1052	0.4325	1915529	CBDivE_004727	Cc1ccc(cc1)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M08	compound treatment	1.124	0.00302	0.04	1.147	-0.0102	-0.14	-0.0693	-0.4792	1915530	CBDivE_004728	Cc1ccc(cc1)C(=O)NC(NC(=S)Nc2ccccc2O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M09	compound treatment	1.154	0.033	0.45	1.111	-0.0462	-0.63	-0.1303	-0.1689	1006771	CBDivE_004729	CC1=CC(=Nc2ccccc2N1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M10	compound treatment	1.096	-0.025	-0.34	1.158	8.21E-4	0.01	-0.2304	-0.6832	1915531	CBDivE_004730	COc1ccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M11	compound treatment	1.101	-0.02	-0.27	1.143	-0.0142	-0.19	-0.3273	-0.9867	1915532	CBDivE_004731	CCOC(=O)c1c2CCCn2c3c(NCc4ccccc4)ncnc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M12	compound treatment	1.083	-0.038	-0.51	1.158	8.21E-4	0.01	-0.3544	-0.6915	1915533	CBDivE_004732	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M13	compound treatment	1.077	-0.044	-0.59	1.146	-0.0112	-0.15	-0.5273	-0.8608	1266695	CBDivE_004733	CC(C)N(Cc1c(oc2cccc(O)c12)C(=O)O)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M14	compound treatment	1.078	-0.043	-0.58	1.184	0.0268	0.37	-0.1514	-0.2208	1915534	CBDivE_004734	Oc1ccccc1NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M15	compound treatment	1.115	-0.00598	-0.08	1.179	0.0218	0.3	0.1534	0.4975	1279155	CBDivE_004735	O=C(Nc1ccc(cc1)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M16	compound treatment	1.156	0.035	0.47	1.149	-0.00818	-0.11	0.2552	0.5257	1606786	CBDivE_004736	COC(=O)c1ccccc1NC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M17	compound treatment	1.126	0.00502	0.07	1.169	0.0118	0.16	0.1619	0.9258	1540776	CBDivE_004737	CCCc1ccc(OCC(O)CN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M18	compound treatment	1.107	-0.014	-0.19	1.191	0.0338	0.46	0.1928	0.3869	1915535	CBDivE_004738	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M19	compound treatment	1.106	-0.015	-0.2	1.133	-0.0242	-0.33	-0.376	-0.9724	1915536	CBDivE_004739	COc1cc2ccccc2cc1C(=O)N/N=C\c3cc(Cl)cc(Cl)c3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	M20	compound treatment	1.102	-0.019	-0.26	1.178	0.0208	0.28	0.0197	0.0516	1775320	CBDivE_004740	CC(=O)Nc1cccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N01	compound treatment	1.067	-0.054	-0.73	1.148	-0.00918	-0.13	-0.6034	-0.8167	1915537	CBDivE_004741	CN(CC(O)COc1ccc(Br)cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N02	compound treatment	1.134	0.013	0.18	1.148	-0.00918	-0.13	0.0357	0.1655	1915538	CBDivE_004742	CCCC(=O)NC(Nc1c(C)n(C)n(c2ccccc2)c1=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N03	compound treatment	1.062	-0.059	-0.8	1.129	-0.0282	-0.38	-0.8343	-0.9443	1613027	CBDivE_004743	CC(N1C2CCCc3c2n(CC1=O)c4ccc(C)cc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N04	compound treatment	1.159	0.038	0.51	1.134	-0.0232	-0.32	0.1392	0.231	1915539	CBDivE_004744	[O-][N+](=O)c1ccc(OCCOC(=O)COc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N05	compound treatment	1.159	0.038	0.51	1.167	0.00982	0.13	0.4574	0.8628	1915540	CBDivE_004745	Cc1sc2Sc3ccc(Br)cc3Nc2c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N06	compound treatment	1.107	-0.014	-0.19	1.173	0.0158	0.22	0.0192	0.067	1915541	CBDivE_004746	Cc1ccc(cc1)C(=O)NC(Nc2cc(C)ccc2C)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N07	compound treatment	1.068	-0.053	-0.71	1.113	-0.0442	-0.6	-0.9314	-0.9964	1338331	CBDivE_004747	COC(=O)C(CC(C)C)NC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N08	compound treatment	1.063	-0.058	-0.78	1.16	0.00282	0.04	-0.5259	-0.6715	1432876	CBDivE_004748	CCc1ccc(OCC(=O)Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N09	compound treatment	1.061	-0.06	-0.81	1.201	0.0438	0.6	-0.1496	-0.1487	1915542	CBDivE_004749	O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N10	compound treatment	1.101	-0.02	-0.27	1.151	-0.00618	-0.08	-0.2502	-0.8859	1688525	CBDivE_004750	Cc1ccc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N11	compound treatment	1.103	-0.018	-0.24	1.15	-0.00718	-0.1	-0.2407	-0.9204	1362344	CBDivE_004751	CS(=O)(=O)C(C(=O)O)C(=C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N12	compound treatment	1.333	0.212	2.86	1.363	0.206	2.81	4.0072	1.0	1912548	CBDivE_004752	[O-][N+](=O)c1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N13	compound treatment	1.125	0.00402	0.05	1.097	-0.0602	-0.82	-0.5419	-0.6589	1915543	CBDivE_004753	[O-][N+](=O)c1ccc(OC(=O)Nc2ccc(Cl)c(Cl)c2)c(NC(=O)Nc3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N14	compound treatment	1.084	-0.037	-0.5	1.174	0.0168	0.23	-0.1906	-0.3471	1242725	CBDivE_004754	Cc1ccnc(NS(=O)(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N15	compound treatment	1.059	-0.062	-0.84	1.101	-0.0562	-0.77	-1.1329	-0.999	1915544	CBDivE_004755	CN(CC(O)COCCCN1CCOCC1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N16	compound treatment	1.071	-0.05	-0.67	1.161	0.00382	0.05	-0.4399	-0.6505	1915545	CBDivE_004756	Cc1ccccc1C(=O)NC(NC(=S)Nc2cccc3cccnc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N17	compound treatment	1.063	-0.058	-0.78	1.116	-0.0412	-0.56	-0.9501	-0.9868	1915546	CBDivE_004757	CCCCOCC(O)CN(C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N18	compound treatment	1.316	0.195	2.63	1.428	0.271	3.69	4.4717	0.9862	1913314	CBDivE_004758	Fc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N19	compound treatment	1.117	-0.00398	-0.05	1.104	-0.0532	-0.73	-0.5507	-0.7574	1657157	CBDivE_004759	CC(C)(C)C(=O)NC(c1ccccc1)c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	N20	compound treatment	1.115	-0.00598	-0.08	1.174	0.0168	0.23	0.1052	0.4325	1915547	CBDivE_004760	CC(C)(C)C(=O)NC(NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O01	compound treatment	1.118	-0.00298	-0.04	1.187	0.0298	0.41	0.2591	0.6342	1915548	CBDivE_004761	[O-][N+](=O)c1ccc(N=Nc2ccc(cc2Cl)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O02	compound treatment	1.132	0.011	0.15	1.246	0.0888	1.21	0.9616	0.788	1915549	CBDivE_004762	CN(C)c1ccc(cc1)C(O)(C2CN3CCC2CC3)c4ccc(cc4)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O03	compound treatment	1.112	-0.00898	-0.12	1.192	0.0348	0.47	0.2501	0.5104	1915550	CBDivE_004763	COc1ccccc1/C=N/NC(=O)COc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O04	compound treatment	1.108	-0.013	-0.18	1.133	-0.0242	-0.33	-0.3569	-0.9561	1915551	CBDivE_004764	C/C(=C\1/C(=O)N(c2ccccc12)c3c(Cl)cccc3Cl)/NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O05	compound treatment	1.075	-0.046	-0.62	1.162	0.00482	0.07	-0.3921	-0.6286	1915552	CBDivE_004765	Cc1cc(C)nc(NS(=O)(=O)c2ccc(/N=C/c3cc(Br)ccc3O)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O06	compound treatment	1.11	-0.011	-0.15	1.155	-0.00218	-0.03	-0.1257	-0.8324	1915553	CBDivE_004766	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)C(=O)OCC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O07	compound treatment	1.172	0.051	0.69	1.171	0.0138	0.19	0.62	0.8687	1620502	CBDivE_004767	O=C(NCCc1c[nH]c2ccc(OCc3ccccc3)cc12)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O08	compound treatment	1.148	0.027	0.36	1.192	0.0348	0.47	0.5935	0.9915	1915554	CBDivE_004768	COc1ccc(/C=N/NC(=O)COc2cccc(C)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O09	compound treatment	1.117	-0.00398	-0.05	1.141	-0.0162	-0.22	-0.194	-0.8542	1640234	CBDivE_004769	OC1CSc2nc3ccccc3n2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O10	compound treatment	1.123	0.00202	0.03	1.165	0.00782	0.11	0.0947	0.8603	1915555	CBDivE_004770	Cc1cccc(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O11	compound treatment	1.113	-0.00798	-0.11	1.172	0.0148	0.2	0.0668	0.2917	1915556	CBDivE_004771	COc1ccc(cc1OC)C(=O)c2c(C)c3ccccc3n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O12	compound treatment	1.128	0.00702	0.09	1.211	0.0538	0.73	0.5859	0.7918	1915557	CBDivE_004772	Clc1ccc(OCC(=O)N/N=C/c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O13	compound treatment	1.08	-0.041	-0.55	1.181	0.0238	0.32	-0.1612	-0.2514	1685824	CBDivE_004773	CCOC(=O)c1oc2cccc(O)c2c1CN(Cc3ccccc3)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O14	compound treatment	1.109	-0.012	-0.16	1.177	0.0198	0.27	0.0769	0.2441	1915558	CBDivE_004774	NC(=O)c1c(NC(=O)CN2CCCCC2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O15	compound treatment	1.14	0.019	0.26	1.182	0.0248	0.34	0.4208	0.9907	1915559	CBDivE_004775	CC(CC(=O)C1CC1)(C/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C3CC3)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O16	compound treatment	1.12	-9.78E-4	-0.01	1.182	0.0248	0.34	0.23	0.679	1915560	CBDivE_004776	COc1nccnc1NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O17	compound treatment	1.116	-0.00498	-0.07	1.204	0.0468	0.64	0.404	0.6293	1915561	CBDivE_004777	NC(=O)NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O18	compound treatment	1.135	0.014	0.19	1.185	0.0278	0.38	0.402	0.9483	1491180	CBDivE_004778	NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O19	compound treatment	1.111	-0.00998	-0.13	1.188	0.0308	0.42	0.202	0.4577	1915562	CBDivE_004779	Cc1ccc(O)c(/C=N/NC(=O)c2ccn[nH]2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	O20	compound treatment	1.164	0.043	0.58	1.21	0.0528	0.72	0.9197	0.9943	1915563	CBDivE_004780	COc1ccc(/C=C/C(=O)NC(=S)Nc2cc(cc(Cl)c2O)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P01	compound treatment	1.103	-0.018	-0.24	1.151	-0.00618	-0.08	-0.2311	-0.9	1915564	CBDivE_004781	CN(CC(O)CN1CCOCC1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P02	compound treatment	1.088	-0.033	-0.44	1.177	0.0198	0.27	-0.1235	-0.2372	1915565	CBDivE_004782	CCC(=O)NC(Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P03	compound treatment	1.095	-0.026	-0.35	1.188	0.0308	0.42	0.0494	0.0902	1297904	CBDivE_004783	Cc1ccc2[nH]c3C(N)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P04	compound treatment	1.099	-0.022	-0.3	1.142	-0.0152	-0.21	-0.356	-0.9846	1915566	CBDivE_004784	CC(NC(=O)COc1ccc(cc1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P05	compound treatment	1.108	-0.013	-0.18	1.089	-0.0682	-0.93	-0.7812	-0.8258	1915567	CBDivE_004785	COc1ccc(cc1)C(=O)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P06	compound treatment	1.106	-0.015	-0.2	1.108	-0.0492	-0.67	-0.6171	-0.881	1915568	CBDivE_004786	N=C1SCCN1CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P07	compound treatment	1.093	-0.028	-0.38	1.107	-0.0502	-0.68	-0.7507	-0.9607	1915569	CBDivE_004787	COc1ccc(NC(=O)COc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P08	compound treatment	1.083	-0.038	-0.51	1.084	-0.0732	-1.0	-1.0679	-0.952	1915570	CBDivE_004788	Nc1ccc(cc1)S(=O)(=O)NC2=NC(=O)C(C(=O)N2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P09	compound treatment	1.117	-0.00398	-0.05	1.177	0.0198	0.27	0.1532	0.5559	1587491	CBDivE_004789	Brc1ccc(OCC(=O)NCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P10	compound treatment	1.098	-0.023	-0.31	1.133	-0.0242	-0.33	-0.4523	-0.9995	1915571	CBDivE_004790	Oc1c(C(C/C(=N/Nc2ccccc2)/c3ccc(cc3)c4ccc(Br)cc4)c5ccccc5)c(=O)oc6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P11	compound treatment	1.041	-0.08	-1.08	1.082	-0.0752	-1.03	-1.4878	-0.9997	1774577	CBDivE_004791	COC(=O)C1C(NC(C(C(=O)OC)S1(=O)=O)c2ccc(cc2)[N+](=O)[O-])c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P12	compound treatment	1.093	-0.028	-0.38	1.116	-0.0412	-0.56	-0.664	-0.9813	1915572	CBDivE_004792	Clc1ccc(Cl)c(SCCc2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P13	compound treatment	1.028	-0.093	-1.25	1.149	-0.00818	-0.11	-0.9658	-0.767	1689468	CBDivE_004793	O=C(Nc1ccc(Cc2ccc(NC(=O)Nc3ccccn3)cc2)cc1)Nc4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P14	compound treatment	1.149	0.028	0.38	1.127	-0.0302	-0.41	-0.0237	-0.0424	1915573	CBDivE_004794	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P15	compound treatment	1.047	-0.074	-1.0	1.13	-0.0272	-0.37	-0.9678	-0.909	1915574	CBDivE_004795	CCN(CC(O)COCCCCl)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P16	compound treatment	1.1	-0.021	-0.28	1.119	-0.0382	-0.52	-0.5683	-0.959	1915575	CBDivE_004796	Cc1ccccc1C(=O)NC(NC(=S)Nc2sc3CCCCc3c2C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P17	compound treatment	1.064	-0.057	-0.77	1.158	8.21E-4	0.01	-0.5356	-0.6967	1915576	CBDivE_004797	OC(CNS(=O)(=O)O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P18	compound treatment	1.066	-0.055	-0.74	1.137	-0.0202	-0.28	-0.719	-0.9089	1267778	CBDivE_004798	COc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P19	compound treatment	1.081	-0.04	-0.54	1.134	-0.0232	-0.32	-0.6049	-0.9676	1729242	CBDivE_004799	Oc1ccc2ccccc2c1C(NC(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.15	P20	compound treatment	1.075	-0.046	-0.62	1.182	0.0248	0.34	-0.1993	-0.282	1915577	CBDivE_004800	CCC(=O)NC(NC(=S)Nc1c(C)n(C)n(c2ccccc2)c1=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A01	compound treatment	1.139	-0.00298	-0.04	1.204	0.0548	0.75	0.5004	0.6682	1630517	CBDivE_004801	Cc1ccnc(NS(=O)(=O)c2c(C)cc(C)cc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A02	compound treatment	1.109	-0.033	-0.44	1.217	0.0678	0.93	0.3395	0.3308	1561056	CBDivE_004802	CC(C)(C)c1cc(SCCc2ccccn2)cc(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A03	compound treatment	1.148	0.00602	0.08	1.211	0.0618	0.84	0.6537	0.7717	1402101	CBDivE_004803	CC(NC(=O)c1ccccc1)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A04	compound treatment	1.181	0.039	0.53	1.208	0.0588	0.8	0.9396	0.9791	1133019	CBDivE_004804	OC1CCCCC1SCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A05	compound treatment	1.138	-0.00398	-0.05	1.14	-0.00916	-0.12	-0.1263	-0.9288	1915578	CBDivE_004805	Brc1ccc(N2NC(=NC2(c3ccccc3)c4ccccc4)c5ccccc5)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A06	compound treatment	1.177	0.035	0.47	1.153	0.00384	0.05	0.3711	0.7806	1915579	CBDivE_004806	CN(C)/C=C\1/C(Cc2nc(ccc2C1=O)N(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A07	compound treatment	1.1	-0.042	-0.57	1.192	0.0428	0.58	0.0126	0.0155	1915580	CBDivE_004807	FC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(=O)N(C1CCCCC1)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A08	compound treatment	1.184	0.042	0.57	1.168	0.0188	0.26	0.5825	0.9359	1915581	CBDivE_004808	COC(=O)C1=C(C)NC(=O)NC1c2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A09	compound treatment	1.135	-0.00698	-0.09	1.192	0.0428	0.58	0.3465	0.5856	1471541	CBDivE_004809	OC(=O)CCNc1ccc(Br)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A10	compound treatment	1.157	0.015	0.2	1.207	0.0578	0.79	0.701	0.8608	1915582	CBDivE_004810	CC(=O)n1cc(C(CN)S(=O)(=O)O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A11	compound treatment	1.147	0.00502	0.07	1.164	0.0148	0.2	0.191	0.895	1915583	CBDivE_004811	CC(C)(C)N(Cc1ccccc1)C(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A12	compound treatment	1.173	0.031	0.42	1.207	0.0578	0.79	0.8536	0.9561	1915584	CBDivE_004812	CC(=N)CC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A13	compound treatment	1.171	0.029	0.39	1.186	0.0368	0.5	0.632	0.9924	1915585	CBDivE_004813	C/C(=C\C(=O)c1cccn(Cc2ccccc2)c1=O)/c3cccn(Cc4ccccc4)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A14	compound treatment	1.192	0.05	0.67	1.106	-0.0432	-0.59	0.061	0.0681	1064827	CBDivE_004814	OS(=O)(=O)c1ccc2NC(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A15	compound treatment	1.131	-0.011	-0.15	1.183	0.0338	0.46	0.2215	0.4572	1191046	CBDivE_004815	COc1ccc(SCCc2ccc(C)nc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A16	compound treatment	1.216	0.074	1.0	1.167	0.0178	0.24	0.8781	0.8544	1915586	CBDivE_004816	CC/C(=N\Nc1ccccc1)/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A17	compound treatment	1.096	-0.046	-0.62	1.169	0.0198	0.27	-0.2473	-0.3655	1452183	CBDivE_004817	CC(C)c1ccc(OCC(O)CNC2CC(C)(C)NC(C)(C)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A18	compound treatment	1.18	0.038	0.51	1.174	0.0248	0.34	0.6022	0.9797	1915587	CBDivE_004818	ClC(Cl)(Cl)C(NC(=O)NC(Nc1ccccc1)C(Cl)(Cl)Cl)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A19	compound treatment	1.134	-0.00798	-0.11	1.211	0.0618	0.84	0.5202	0.6119	1915588	CBDivE_004819	C/C(=N\Nc1ccccc1)/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	A20	compound treatment	1.124	-0.018	-0.24	1.202	0.0528	0.72	0.338	0.4446	1424257	CBDivE_004820	CC1(C)CC(=O)c2c(c3ccccc3)c4C(=O)CC(C)(C)Cc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B01	compound treatment	1.152	0.01	0.14	1.179	0.0298	0.41	0.3833	0.894	1915589	CBDivE_004821	CC1(C)N=C(N)N=C(N)N1c2ccc(Oc3ccc(Cl)cc3)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B02	compound treatment	1.163	0.021	0.28	1.129	-0.0202	-0.27	0.0061	0.0155	1483300	CBDivE_004822	COc1ccc(Cl)c(NCCC(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B03	compound treatment	1.144	0.00202	0.03	1.131	-0.0182	-0.25	-0.1558	-0.6255	1915590	CBDivE_004823	COc1ccc(/C=N/NC(=O)c2ccnn2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B04	compound treatment	1.206	0.064	0.86	1.226	0.0768	1.05	1.3516	0.9954	1915591	CBDivE_004824	C/C(=N/NC(=O)COc1ccc(Br)c2ccccc12)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B05	compound treatment	1.157	0.015	0.2	1.165	0.0158	0.22	0.296	0.9995	3008464	CBDivE_004825	CC(CC(=O)NCCc1ccccc1)[S-](=O)=O.NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B06	compound treatment	1.168	0.026	0.35	1.139	-0.0102	-0.14	0.1502	0.3981	1915593	CBDivE_004826	CCOc1cc(I)cc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B07	compound treatment	1.107	-0.035	-0.47	1.175	0.0258	0.35	-0.0845	-0.1435	1915594	CBDivE_004827	CC1CC(NNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])NC(=S)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B08	compound treatment	1.163	0.021	0.28	1.108	-0.0412	-0.56	-0.1964	-0.3123	1915595	CBDivE_004828	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)COc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B09	compound treatment	1.138	-0.00398	-0.05	1.14	-0.00916	-0.12	-0.1263	-0.9288	1915596	CBDivE_004829	OC(=O)CN(CC(=O)O)Cc1cc(O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B10	compound treatment	1.171	0.029	0.39	1.191	0.0418	0.57	0.6803	0.9831	1915597	CBDivE_004830	Nc1ccc(cc1[N+](=O)[O-])C(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B11	compound treatment	1.081	-0.061	-0.82	1.109	-0.0402	-0.55	-0.969	-0.9805	1114561	CBDivE_004831	OC(=O)CCC(=O)c1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B12	compound treatment	1.212	0.07	0.94	1.117	-0.0322	-0.44	0.3578	0.3436	1915598	CBDivE_004832	BrCS(=O)(=O)N1CCc2ccccc2C1CNC(=O)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B13	compound treatment	1.16	0.018	0.24	1.163	0.0138	0.19	0.3053	0.9921	1915599	CBDivE_004833	CC(=O)OC(C(Br)C(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B14	compound treatment	1.069	-0.073	-0.98	1.197	0.0478	0.65	-0.2349	-0.1989	1532960	CBDivE_004834	NC(=O)CCN(C1CCCCC1)S(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B15	compound treatment	1.212	0.07	0.94	1.21	0.0608	0.83	1.2546	0.9979	1125404	CBDivE_004835	OC(=O)c1cc(Br)ccc1NS(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B16	compound treatment	1.177	0.035	0.47	1.121	-0.0282	-0.38	0.0625	0.1027	1008580	CBDivE_004836	CC(C)(CO)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B17	compound treatment	1.149	0.00702	0.09	1.118	-0.0312	-0.42	-0.2335	-0.5363	1520010	CBDivE_004837	O=S(=O)(CCOc1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B18	compound treatment	1.172	0.03	0.41	1.138	-0.0112	-0.15	0.1788	0.4131	1500942	CBDivE_004838	CC1CC(C)(C)OC(O1)C(C)(C)CN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B19	compound treatment	1.197	0.055	0.74	1.209	0.0598	0.82	1.1018	0.9989	1198940	CBDivE_004839	Clc1ccc(cc1)S(=O)(=O)N2CC(=O)N(CCc3ccccc3)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	B20	compound treatment	1.144	0.00202	0.03	1.13	-0.0192	-0.26	-0.1655	-0.6299	1915600	CBDivE_004840	COP(=O)(OC)O/C(=C/C(=O)N1CCCCC1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C01	compound treatment	1.127	-0.015	-0.2	1.147	-0.00216	-0.03	-0.1637	-0.8018	1915601	CBDivE_004841	OC(=O)/C=C/c1ccc2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C02	compound treatment	1.135	-0.00698	-0.09	1.179	0.0298	0.41	0.2211	0.5295	1915602	CBDivE_004842	CC(C)c1ccc(cc1)S(=O)(=O)CCc2ccc(C)[n+](C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C03	compound treatment	1.147	0.00502	0.07	1.136	-0.0132	-0.18	-0.079	-0.4119	1915603	CBDivE_004843	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C04	compound treatment	1.17	0.028	0.38	1.152	0.00284	0.04	0.2947	0.7754	1915604	CBDivE_004844	Brc1ccc(/C=C\2/S\C(=N/c3ccccc3)\N(C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C05	compound treatment	1.131	-0.011	-0.15	1.172	0.0228	0.31	0.1155	0.3349	1313044	CBDivE_004845	Clc1ccc(OCC(=O)Nc2ccc(Br)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C06	compound treatment	1.184	0.042	0.57	1.163	0.0138	0.19	0.5343	0.8942	1915605	CBDivE_004846	[O-][N+](=O)c1ccc2nc3c(cc2c1)n(Cc4ccccc4)c5ccccc53
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C07	compound treatment	1.131	-0.011	-0.15	1.097	-0.0522	-0.71	-0.6077	-0.8364	1656054	CBDivE_004847	CN(C)c1nc2ccc(OCCN3CCCCC3)cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C08	compound treatment	1.147	0.00502	0.07	1.188	0.0388	0.53	0.4224	0.7911	1375859	CBDivE_004848	CC1=C(C(NC(=O)N1)c2ccc(F)cc2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C09	compound treatment	1.099	-0.043	-0.58	1.111	-0.0382	-0.52	-0.778	-0.9985	1915606	CBDivE_004849	O=C(N/N=C\1/c2ccccc2-c3nc4ccccc4nc13)c5cccnc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C10	compound treatment	1.152	0.01	0.14	1.143	-0.00616	-0.08	0.0362	0.2272	1536826	CBDivE_004850	COc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C11	compound treatment	1.13	-0.012	-0.16	1.154	0.00484	0.07	-0.0676	-0.3874	1915607	CBDivE_004851	Cc1cc(C)nc(NS(=O)(=O)c2ccc(/N=C/c3cc(ccc3O)[N+](=O)[O-])cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C12	compound treatment	1.16	0.018	0.24	1.201	0.0518	0.71	0.6718	0.8986	1915608	CBDivE_004852	COc1ccc(cc1)N2C(=O)C3C(C4C5C(C3C=C4C(=O)Oc6ccc(Cl)cc6Cl)C(=O)N(C5=O)c7ccc(OC)cc7)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C13	compound treatment	1.104	-0.038	-0.51	1.121	-0.0282	-0.38	-0.6338	-0.9899	1488083	CBDivE_004853	Cc1cc(nc(n1)N(CCO)CCO)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C14	compound treatment	1.148	0.00602	0.08	1.166	0.0168	0.23	0.2198	0.9025	1915609	CBDivE_004854	CCCCNC(=O)OCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C15	compound treatment	1.176	0.034	0.46	1.141	-0.00816	-0.11	0.2458	0.5205	1387599	CBDivE_004855	COc1ccc(cc1)S(=O)(=O)Nc2cc(C)ccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C16	compound treatment	1.188	0.046	0.62	1.185	0.0358	0.49	0.7846	0.993	1915610	CBDivE_004856	CC(=O)CC(c1ccc(O)cc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C17	compound treatment	1.168	0.026	0.35	1.133	-0.0162	-0.22	0.0924	0.2229	1915611	CBDivE_004857	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCC(=O)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C18	compound treatment	1.111	-0.031	-0.42	1.175	0.0258	0.35	-0.0464	-0.0848	1915612	CBDivE_004858	CCOc1ccc(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C19	compound treatment	1.169	0.027	0.36	1.189	0.0398	0.54	0.6419	0.9812	1915613	CBDivE_004859	Oc1ccc(cc1/C=N\NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	C20	compound treatment	1.148	0.00602	0.08	1.176	0.0268	0.37	0.3162	0.8435	1915614	CBDivE_004860	C/C(=N\Nc1ccccc1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D01	compound treatment	1.149	0.00702	0.09	1.132	-0.0172	-0.23	-0.0985	-0.3902	1915615	CBDivE_004861	CCN(CC)CCCC(C)Nc1ccnc2cc3ccccc3cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D02	compound treatment	1.171	0.029	0.39	1.139	-0.0102	-0.14	0.1789	0.4306	1915616	CBDivE_004862	[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc2ccc(Br)cc2C(=O)Nc3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D03	compound treatment	1.128	-0.014	-0.19	1.141	-0.00816	-0.11	-0.2121	-0.9684	1915617	CBDivE_004863	Cc1nn(C)c(NN2C(=O)c3cccc4c(Cl)ccc(C2=O)c34)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D04	compound treatment	1.126	-0.016	-0.22	1.121	-0.0282	-0.38	-0.424	-0.9627	1915618	CBDivE_004864	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)Cc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D05	compound treatment	1.198	0.056	0.76	1.168	0.0188	0.26	0.716	0.897	1446898	CBDivE_004865	O=C(Nc1ccc(NC(=O)c2ccco2)cc1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D06	compound treatment	1.097	-0.045	-0.61	1.102	-0.0472	-0.64	-0.8838	-0.9996	1915619	CBDivE_004866	C/C(=N/NC(=O)COc1cc(C)c(Cl)c(C)c1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D07	compound treatment	1.154	0.012	0.16	1.135	-0.0142	-0.19	-0.0219	-0.0868	1915620	CBDivE_004867	Oc1ccccc1/C=N/CCNC(=O)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D08	compound treatment	1.181	0.039	0.53	1.154	0.00484	0.07	0.4189	0.7895	1915621	CBDivE_004868	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)COc3ccc(Br)cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D09	compound treatment	1.124	-0.018	-0.24	1.154	0.00484	0.07	-0.1249	-0.4968	1915622	CBDivE_004869	OC(=O)CN(CC(=O)O)Cc1c(O)cccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D10	compound treatment	1.212	0.07	0.94	1.151	0.00184	0.03	0.6857	0.7256	1915623	CBDivE_004870	[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc2ccc(Cl)cc2C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D11	compound treatment	1.183	0.041	0.55	1.118	-0.0312	-0.42	0.0908	0.1302	1283955	CBDivE_004871	CC(=O)Nc1ccc(cc1)c2cc(N)[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D12	compound treatment	1.136	-0.00598	-0.08	1.109	-0.0402	-0.55	-0.4443	-0.8026	1642741	CBDivE_004872	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D13	compound treatment	1.146	0.00402	0.05	1.115	-0.0342	-0.47	-0.291	-0.6206	1234002	CBDivE_004873	CCN1CCCC(C1)Nc2ccnc3cc4ccccc4cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D14	compound treatment	1.108	-0.034	-0.46	1.134	-0.0152	-0.21	-0.4703	-0.9353	1915624	CBDivE_004874	C(COc1ccc(Nc2ccnc3cc4ccccc4cc23)cc1)Oc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D15	compound treatment	1.159	0.017	0.23	1.124	-0.0252	-0.34	-0.0803	-0.1944	1915625	CBDivE_004875	CCOc1cc(I)cc(/C=N/NC(=O)COc2cccc(C)c2C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D16	compound treatment	1.122	-0.02	-0.27	1.134	-0.0152	-0.21	-0.3368	-0.9914	1915626	CBDivE_004876	Cc1ccc(cc1)S(=O)(=O)OCC(F)(F)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D17	compound treatment	1.139	-0.00298	-0.04	1.134	-0.0152	-0.21	-0.1746	-0.829	1776437	CBDivE_004877	Clc1ccc(cc1)C(=O)c2ccc(NC(=O)c3cc(Cl)ccc3NS(=O)(=O)c4cccc5nsnc45)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D18	compound treatment	1.15	0.00802	0.11	1.139	-0.0102	-0.14	-0.0215	-0.1221	1015121	CBDivE_004878	CCOC(=O)CNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D19	compound treatment	1.126	-0.016	-0.22	1.212	0.0628	0.86	0.4535	0.5132	1729729	CBDivE_004879	Clc1ccc(cc1)S(=O)(=O)n2c(COc3ccc(Cl)cc3Cl)nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	D20	compound treatment	1.171	0.029	0.39	1.151	0.00184	0.03	0.2946	0.7508	1670181	CBDivE_004880	CC(C)(C)c1ccc(CCC2OCC(CN3CCCCC3)O2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E01	compound treatment	1.16	0.018	0.24	1.147	-0.00216	-0.03	0.1511	0.6168	1915627	CBDivE_004881	Oc1ccccc1C=C2C(=O)NC3=C(NC2=O)C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E02	compound treatment	1.202	0.06	0.81	1.134	-0.0152	-0.21	0.4264	0.5102	1613281	CBDivE_004882	Cc1ccnc(NS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E03	compound treatment	1.149	0.00702	0.09	1.116	-0.0332	-0.45	-0.2528	-0.5471	1915628	CBDivE_004883	CSC(=S)N/N=C/c1ccc(O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E04	compound treatment	1.174	0.032	0.43	1.191	0.0418	0.57	0.7089	0.9906	1915629	CBDivE_004884	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E05	compound treatment	1.144	0.00202	0.03	1.133	-0.0162	-0.22	-0.1366	-0.6149	1915630	CBDivE_004885	COC(=O)c1ccccc1NC(=S)NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E06	compound treatment	1.19	0.048	0.65	1.166	0.0168	0.23	0.6204	0.9027	1915631	CBDivE_004886	COc1ccc(C/C(=N/n2cnnc2)/c3ccc(OC)c(OC)c3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E07	compound treatment	1.092	-0.05	-0.67	1.172	0.0228	0.31	-0.2566	-0.3454	1915632	CBDivE_004887	C/C(=N\Nc1ccccc1)/c2no[n+]([O-])c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E08	compound treatment	1.173	0.031	0.42	1.144	-0.00516	-0.07	0.2461	0.58	1915633	CBDivE_004888	COc1ccc(CC/N=C/c2ccccc2[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E09	compound treatment	1.21	0.068	0.92	1.123	-0.0262	-0.36	0.3966	0.4028	1915634	CBDivE_004889	CCOC(=O)c1c(NC(=O)c2ccc(N)c(c2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E10	compound treatment	1.142	2.19E-5	0.0	1.175	0.0258	0.35	0.2493	0.7077	1679092	CBDivE_004890	Cc1ccc(cc1)c2nc(CN3CCCCC3)cc(CN4CCCCC4)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E11	compound treatment	1.084	-0.058	-0.78	1.098	-0.0512	-0.7	-1.0464	-0.9984	1915635	CBDivE_004891	O=C(Cc1ccccc1)N/N=C\2/c3ccccc3-c4nc5ccccc5nc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E12	compound treatment	1.137	-0.00498	-0.07	1.195	0.0458	0.63	0.3945	0.6275	1204020	CBDivE_004892	OC(=O)CCCC(=O)Nc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E13	compound treatment	1.042	-0.1	-1.35	1.175	0.0258	0.35	-0.7046	-0.5054	1648703	CBDivE_004893	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E14	compound treatment	1.148	0.00602	0.08	1.218	0.0688	0.94	0.7212	0.7654	1915636	CBDivE_004894	CNN=C1c2nn(/N=C/c3ccc(O)cc3O)nc2C(=NNC)c4nn(/N=C/c5ccc(O)cc5O)nc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E15	compound treatment	1.121	-0.021	-0.28	1.18	0.0308	0.42	0.0972	0.1918	1283823	CBDivE_004895	OC1(COc2ccccc2O1)c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E16	compound treatment	1.114	-0.028	-0.38	1.193	0.0438	0.6	0.1558	0.2204	1915637	CBDivE_004896	CC/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/CC(c2ccc(cc2)[N+](=O)[O-])c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E17	compound treatment	1.118	-0.024	-0.32	1.11	-0.0392	-0.53	-0.6064	-0.9712	1183449	CBDivE_004897	COc1ccc(C=c2[nH]c(=O)c(=Cc3ccc(OC)cc3OC)[nH]c2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E18	compound treatment	1.117	-0.025	-0.34	1.153	0.00384	0.05	-0.2013	-0.5902	1915638	CBDivE_004898	CCCc1ccc(OCC(O)CNC2CC(C)(C)NC(C)(C)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E19	compound treatment	1.124	-0.018	-0.24	1.128	-0.0212	-0.29	-0.3756	-0.9963	1515859	CBDivE_004899	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCC(=O)NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	E20	compound treatment	1.123	-0.019	-0.26	1.158	0.00884	0.12	-0.0958	-0.3387	1915639	CBDivE_004900	CCOc1ccc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F01	compound treatment	1.126	-0.016	-0.22	1.115	-0.0342	-0.47	-0.4818	-0.9387	1733514	CBDivE_004901	CCOC(=O)C1(O)CN2CCC1CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F02	compound treatment	1.134	-0.00798	-0.11	1.153	0.00384	0.05	-0.0391	-0.3268	1309233	CBDivE_004902	Clc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F03	compound treatment	1.138	-0.00398	-0.05	1.132	-0.0172	-0.23	-0.2034	-0.8473	1915640	CBDivE_004903	CCN(CC)c1ccc(N=Nc2nc3ccc(OC)cc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F04	compound treatment	1.129	-0.013	-0.18	1.145	-0.00416	-0.06	-0.1639	-0.8907	1915641	CBDivE_004904	COc1ccc(OCC(=O)N/N=C(/C)\C=C\c2ccco2)c(I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F05	compound treatment	1.19	0.048	0.65	1.161	0.0118	0.16	0.5722	0.8571	1915642	CBDivE_004905	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4cc(Cl)cc(Cl)c4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F06	compound treatment	1.156	0.014	0.19	1.126	-0.0232	-0.32	-0.0896	-0.2433	1915643	CBDivE_004906	[O-][N+](=O)c1cccc(/C=C/C=N/NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F07	compound treatment	1.156	0.014	0.19	1.109	-0.0402	-0.55	-0.2535	-0.4375	1915644	CBDivE_004907	Nc1nc(CCCCc2n[nH]c(N)n2)n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F08	compound treatment	1.177	0.035	0.47	1.174	0.0248	0.34	0.5736	0.9867	1915645	CBDivE_004908	OC(=O)c1cc(Br)ccc1NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F09	compound treatment	1.171	0.029	0.39	1.165	0.0158	0.22	0.4296	0.9607	1488907	CBDivE_004909	OC(=O)CN1CC(=O)Oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F10	compound treatment	1.095	-0.047	-0.63	1.139	-0.0102	-0.14	-0.5461	-0.8418	1915646	CBDivE_004910	Cc1ccc(cc1)S(=O)(=O)NCCCCCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F11	compound treatment	1.146	0.00402	0.05	1.128	-0.0212	-0.29	-0.1657	-0.5643	1221278	CBDivE_004911	CC1C(N(C)CCC21NC(=O)NC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F12	compound treatment	1.141	-9.78E-4	-0.01	1.101	-0.0482	-0.66	-0.4737	-0.7212	1915647	CBDivE_004912	Nc1c(cnn1c2ccccc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F13	compound treatment	1.146	0.00402	0.05	1.164	0.0148	0.2	0.1814	0.8661	1776442	CBDivE_004913	[O-][N+](=O)c1ccc(cc1)c2ccc(cc2)S(=O)(=O)NCCN3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F14	compound treatment	1.153	0.011	0.15	1.172	0.0228	0.31	0.3253	0.9428	1915648	CBDivE_004914	COc1ccc(CCN2C(=O)CN(CCc3ccccc3)CC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F15	compound treatment	1.171	0.029	0.39	1.116	-0.0332	-0.45	-0.0429	-0.0718	1915649	CBDivE_004915	Cc1ccc(cn1)C(=O)N/N=C/c2ccc(o2)c3ccc(C)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F16	compound treatment	1.115	-0.027	-0.36	1.122	-0.0272	-0.37	-0.5193	-1.0	1915650	CBDivE_004916	OC(=O)/C=C/C(=O)N1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F17	compound treatment	1.145	0.00302	0.04	1.142	-0.00716	-0.1	-0.0402	-0.3802	1915651	CBDivE_004917	OC(=O)c1cc(nc2C(=O)C=C(O)C(=O)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F18	compound treatment	1.174	0.032	0.43	1.167	0.0178	0.24	0.4775	0.9631	1915652	CBDivE_004918	[O-][N+](=O)c1ccccc1NC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F19	compound treatment	1.143	0.00102	0.01	1.12	-0.0292	-0.4	-0.2715	-0.6822	1915653	CBDivE_004919	Clc1ccc(cc1)C(=O)c2cc(Cl)ccc2NC(=O)c3cc(Br)ccc3NS(=O)(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	F20	compound treatment	1.12	-0.022	-0.3	1.145	-0.00416	-0.06	-0.2498	-0.8275	1433427	CBDivE_004920	CC(CC1OCC(CN2CCCCC2)O1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G01	compound treatment	1.109	-0.033	-0.44	1.151	0.00184	0.03	-0.2969	-0.6662	1915654	CBDivE_004921	Fc1c(F)c(F)c(C(=O)Nc2ccc(cc2)C(=O)Nc3cccc4ccccc34)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G02	compound treatment	1.227	0.085	1.15	1.13	-0.0192	-0.26	0.6263	0.5324	1214810	CBDivE_004922	CC(C)c1ccc(SCCc2ccc(C)nc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G03	compound treatment	1.196	0.054	0.73	1.145	-0.00416	-0.06	0.4752	0.6501	1915655	CBDivE_004923	FC1CC(OC1CC(=O)Oc2ccccc2)n3cnc4c(NC(=O)c5ccccc5)ncnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G04	compound treatment	1.126	-0.016	-0.22	1.147	-0.00216	-0.03	-0.1733	-0.7964	1774544	CBDivE_004924	Cc1ccc(NC(=O)COc2ccc(cc2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G05	compound treatment	1.11	-0.032	-0.43	1.072	-0.0772	-1.05	-1.0491	-0.9225	1915656	CBDivE_004925	Cc1ccccc1NC(=S)NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G06	compound treatment	1.117	-0.025	-0.34	1.18	0.0308	0.42	0.0591	0.1096	1915657	CBDivE_004926	OC(=O)/C(=N\NC(=O)c1cccc(c1)[N+](=O)[O-])/Cc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G07	compound treatment	1.104	-0.038	-0.51	1.129	-0.0202	-0.27	-0.5567	-0.9574	1915658	CBDivE_004927	CC(C)(C)OC(=O)N/N=C\c1ccc2OCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G08	compound treatment	1.131	-0.011	-0.15	1.18	0.0308	0.42	0.1926	0.4321	1915659	CBDivE_004928	COc1cc2CCNC(c3ccccc3[N+](=O)[O-])c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G09	compound treatment	1.158	0.016	0.22	1.143	-0.00616	-0.08	0.0934	0.4028	1915660	CBDivE_004929	CC1=C(/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(C)(C)CCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G10	compound treatment	1.106	-0.036	-0.49	1.178	0.0288	0.39	-0.0651	-0.1043	1915661	CBDivE_004930	Cc1c(cc(cc1[N+](=O)[O-])C(=O)NNc2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G11	compound treatment	1.16	0.018	0.24	1.129	-0.0202	-0.27	-0.0225	-0.0613	1915662	CBDivE_004931	CCN(CC)CCn1c(/C=C/c2ccc(Cl)cc2)nc3cc4ccccc4cc3c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G12	compound treatment	1.088	-0.054	-0.73	1.175	0.0258	0.35	-0.2658	-0.3286	1915663	CBDivE_004932	O=C1C=CC(=O)N1c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G13	compound treatment	1.127	-0.015	-0.2	1.125	-0.0242	-0.33	-0.3759	-0.9724	1112189	CBDivE_004933	FC(F)(F)c1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G14	compound treatment	1.155	0.013	0.18	1.171	0.0218	0.3	0.3348	0.9683	1915664	CBDivE_004934	Oc1ccc(/C=N/n2nc3C(=NNc4ccccc4)c5nn(\N=C\c6ccc(O)cc6O)nc5C(=NNc7ccccc7)c3n2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G15	compound treatment	1.15	0.00802	0.11	1.135	-0.0142	-0.19	-0.06	-0.2712	1155309	CBDivE_004935	CCOc1ccc(C=c2[nH]c(=O)c(=Cc3ccc(OCC)cc3)[nH]c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G16	compound treatment	1.179	0.037	0.5	1.122	-0.0272	-0.37	0.0912	0.1467	1271150	CBDivE_004936	Oc1cc2cc(O)nc(O)c2c(O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G17	compound treatment	1.177	0.035	0.47	1.106	-0.0432	-0.59	-0.0821	-0.1088	1274703	CBDivE_004937	CCc1ccc(cc1)C(=O)CC(C2CCCC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G18	compound treatment	1.145	0.00302	0.04	1.172	0.0228	0.31	0.249	0.7929	1689649	CBDivE_004938	COC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G19	compound treatment	1.176	0.034	0.46	1.189	0.0398	0.54	0.7087	0.9965	1915665	CBDivE_004939	NC(=O)c1c(sc2CCCCc12)C(=O)Nc3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	G20	compound treatment	1.241	0.099	1.34	1.113	-0.0362	-0.49	0.5959	0.4185	1915666	CBDivE_004940	Oc1ccc2ccccc2c1/C=N/Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H01	compound treatment	1.132	-0.00998	-0.13	1.173	0.0238	0.33	0.1347	0.3828	1915667	CBDivE_004941	CCOC(=O)C/1N2CCC(CC2)\C1=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H02	compound treatment	1.102	-0.04	-0.54	1.087	-0.0622	-0.85	-0.9808	-0.9762	1523976	CBDivE_004942	COc1ccc2nc(nc(NCCN3CCCC3)c2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H03	compound treatment	1.159	0.017	0.23	1.088	-0.0612	-0.83	-0.4274	-0.494	1584996	CBDivE_004943	COc1ccc(cc1)C(=O)CSc2ccc(cc2)c3ccc(SCC(=O)c4ccc(OC)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H04	compound treatment	1.165	0.023	0.31	1.139	-0.0102	-0.14	0.1216	0.3576	1915668	CBDivE_004944	COCCOC(=O)Nc1nc2ccc(OC)cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H05	compound treatment	1.144	0.00202	0.03	1.162	0.0128	0.18	0.1431	0.8075	1915669	CBDivE_004945	O=CNC1CCCc2c1sc3nc[nH]c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H06	compound treatment	1.16	0.018	0.24	1.159	0.00984	0.13	0.2668	0.9607	1915670	CBDivE_004946	Clc1cccc(c1)c2ccc(/C=N/NC(=O)C3COc4ccccc4O3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H07	compound treatment	1.199	0.057	0.77	1.114	-0.0352	-0.48	0.2049	0.226	1915671	CBDivE_004947	N1C(=CC(c2ccccc2)n3c1nc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H08	compound treatment	1.171	0.029	0.39	1.147	-0.00216	-0.03	0.256	0.652	1302032	CBDivE_004948	O=C1CN(CC(=O)N1CCc2ccccc2)S(=O)(=O)CCOc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H09	compound treatment	1.152	0.01	0.14	1.109	-0.0402	-0.55	-0.2917	-0.517	1776237	CBDivE_004949	Clc1ccc(NC(=O)c2cc(Br)ccc2NS(=O)(=O)c3ccc(Br)c4nsnc34)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H10	compound treatment	1.159	0.017	0.23	1.139	-0.0102	-0.14	0.0644	0.24	1072661	CBDivE_004950	Oc1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H11	compound treatment	1.156	0.014	0.19	1.135	-0.0142	-0.19	-0.0028	-0.0104	1915672	CBDivE_004951	Oc1ccc2[n+](CC#C)cccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H12	compound treatment	1.136	-0.00598	-0.08	1.099	-0.0502	-0.68	-0.5407	-0.785	1266873	CBDivE_004952	O=C1NCCc2c1[nH]c3ccc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H13	compound treatment	1.124	-0.018	-0.24	1.079	-0.0702	-0.96	-0.848	-0.8592	1462727	CBDivE_004953	Clc1ccc(cc1)S(=O)(=O)Nc2ccc(Br)cc2C(=O)Nc3cccc4nsnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H14	compound treatment	1.154	0.012	0.16	1.157	0.00784	0.11	0.1902	0.9795	1597037	CBDivE_004954	NS(=O)(=O)c1ccc(CNc2ccnc3cc4ccccc4cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H15	compound treatment	1.139	-0.00298	-0.04	1.163	0.0138	0.19	0.105	0.5443	1915673	CBDivE_004955	[O-][N+](=O)c1cccc(/C=C/C=N/NC(=O)COc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H16	compound treatment	1.159	0.017	0.23	1.12	-0.0292	-0.4	-0.1188	-0.2588	1556051	CBDivE_004956	C(C1COC(O1)c2ccc3OCOc3c2)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H17	compound treatment	1.133	-0.00898	-0.12	1.141	-0.00816	-0.11	-0.1644	-0.9991	1280699	CBDivE_004957	Cc1ccc(c2nsnc12)S(=O)(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H18	compound treatment	1.127	-0.015	-0.2	1.141	-0.00816	-0.11	-0.2216	-0.9605	1915674	CBDivE_004958	C(OCc1ccccc1)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H19	compound treatment	1.03	-0.112	-1.51	1.179	0.0298	0.41	-0.7805	-0.4989	1606324	CBDivE_004959	CN(C)c1nc2ccc(OCCN3CCOCC3)cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	H20	compound treatment	1.115	-0.027	-0.36	1.142	-0.00716	-0.1	-0.3264	-0.8662	1654499	CBDivE_004960	COC(=O)CCC(=O)Oc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I01	compound treatment	1.089	-0.053	-0.71	1.191	0.0418	0.57	-0.102	-0.1115	1375364	CBDivE_004961	O=C1CC(Nc2ccc(cc2)N3CCOCC3)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I02	compound treatment	1.17	0.028	0.38	1.237	0.0878	1.2	1.1143	0.8871	1129853	CBDivE_004962	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I03	compound treatment	1.15	0.00802	0.11	1.171	0.0218	0.3	0.2871	0.9061	1915675	CBDivE_004963	OC(=O)CC/C(=N\NC(=O)c1cccnc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I04	compound treatment	1.123	-0.019	-0.26	1.132	-0.0172	-0.23	-0.3465	-0.999	1915676	CBDivE_004964	CC(=O)c1ccc(OCCOc2ccc(cc2)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I05	compound treatment	1.129	-0.013	-0.18	1.075	-0.0742	-1.01	-0.8389	-0.8174	1915677	CBDivE_004965	CC(C)(C)C(=O)NC(NC(=S)Nc1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I06	compound treatment	1.128	-0.014	-0.19	1.187	0.0378	0.52	0.2315	0.4214	1915678	CBDivE_004966	COc1ccc(cc1)C(=O)N/N=C(/Cc2ccccc2[N+](=O)[O-])\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I07	compound treatment	1.169	0.027	0.36	1.12	-0.0292	-0.4	-0.0234	-0.0434	1915679	CBDivE_004967	Clc1cccc(c1)C(=O)N/N=C\c2c(Br)sc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I08	compound treatment	1.104	-0.038	-0.51	1.106	-0.0432	-0.59	-0.7785	-0.9976	1915680	CBDivE_004968	COc1cc(/C=N/NC(=O)CCC(C)O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I09	compound treatment	1.148	0.00602	0.08	1.175	0.0258	0.35	0.3066	0.8479	1915681	CBDivE_004969	FC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(=O)Nc1ccc(Br)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I10	compound treatment	1.11	-0.032	-0.43	1.177	0.0278	0.38	-0.0366	-0.0638	1915682	CBDivE_004970	COc1ccc(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I11	compound treatment	1.14	-0.00198	-0.03	1.128	-0.0212	-0.29	-0.2229	-0.7692	323041	CBDivE_004971	COC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I12	compound treatment	1.093	-0.049	-0.66	1.207	0.0578	0.79	0.0905	0.0879	1915683	CBDivE_004972	O=C1C2C(C(C=CC2c3ccccc3)c4ccccc4)C(=O)N1c5ccc(cc5)N6C(=O)C7C(C(C=CC7c8ccccc8)c9ccccc9)C6=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I13	compound treatment	1.184	0.042	0.57	1.209	0.0598	0.82	0.9778	0.9842	1915684	CBDivE_004973	FC(F)(F)c1cccc(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I14	compound treatment	1.126	-0.016	-0.22	1.151	0.00184	0.03	-0.1347	-0.6208	1915685	CBDivE_004974	OC(=O)CCN(CC(=O)O)C(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I15	compound treatment	1.143	0.00102	0.01	1.171	0.0218	0.3	0.2203	0.7391	1915686	CBDivE_004975	O=C(CSc1nnnn1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I16	compound treatment	1.141	-9.78E-4	-0.01	1.162	0.0128	0.18	0.1144	0.652	1915687	CBDivE_004976	OC(=O)/C=C/C(=O)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I17	compound treatment	1.131	-0.011	-0.15	1.192	0.0428	0.58	0.3083	0.5116	1915688	CBDivE_004977	Cc1ccc(cc1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I18	compound treatment	1.107	-0.035	-0.47	1.201	0.0518	0.71	0.1662	0.1955	1049798	CBDivE_004978	S=c1sc2ccccc2n1CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I19	compound treatment	1.123	-0.019	-0.26	1.18	0.0308	0.42	0.1163	0.2362	1915689	CBDivE_004979	O/N=C\1/c2ccccc2-c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	I20	compound treatment	1.147	0.00502	0.07	1.188	0.0388	0.53	0.4224	0.7911	1915690	CBDivE_004980	O=C/1Nc2ccccc2\C1=N/c3ccccc3\N=C/4\C(=O)Nc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J01	compound treatment	1.127	-0.015	-0.2	1.166	0.0168	0.23	0.0195	0.0637	1915691	CBDivE_004981	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)COc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J02	compound treatment	1.187	0.045	0.61	1.248	0.0988	1.35	1.3825	0.9352	1497482	CBDivE_004982	CN1c2ccccc2Oc3nnc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J03	compound treatment	1.105	-0.037	-0.5	1.174	0.0248	0.34	-0.1133	-0.1878	1915692	CBDivE_004983	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=C(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)F)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J04	compound treatment	1.136	-0.00598	-0.08	1.138	-0.0112	-0.15	-0.1647	-0.9559	1915693	CBDivE_004984	Cc1cc([nH]n1)C(=O)N/N=C/c2ccc(o2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J05	compound treatment	1.172	0.03	0.41	1.079	-0.0702	-0.96	-0.3902	-0.3755	1915694	CBDivE_004985	CCOC(=O)c1c(NC=O)sc2C(=O)CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J06	compound treatment	1.186	0.044	0.59	1.152	0.00284	0.04	0.4473	0.7516	1915695	CBDivE_004986	Cc1ccc(cc1Cl)c2ccc(/C=N/NC(=O)Cc3ccccc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J07	compound treatment	1.183	0.041	0.55	1.157	0.00784	0.11	0.4669	0.8284	1915696	CBDivE_004987	Cc1nn(c2ccc(cc2)[N+](=O)[O-])c3nc(C)cc(C)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J08	compound treatment	1.133	-0.00898	-0.12	1.136	-0.0132	-0.18	-0.2126	-0.9817	1778181	CBDivE_004988	O=C1N(CC2N(CCc3ccccc23)S(=O)(=O)c4cccc5nsnc45)C(=O)c6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J09	compound treatment	1.148	0.00602	0.08	1.109	-0.0402	-0.55	-0.3298	-0.5957	1915697	CBDivE_004989	CN1CCN(CC1)c2ccc(Nc3c4ccccc4nc5ccccc35)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J10	compound treatment	1.173	0.031	0.42	1.12	-0.0292	-0.4	0.0147	0.0255	1915698	CBDivE_004990	COc1ccc(CCN2C(=O)CNCC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J11	compound treatment	1.137	-0.00498	-0.07	1.133	-0.0162	-0.22	-0.2033	-0.8825	1915699	CBDivE_004991	OC1(CC(NO1)C(Cl)(Cl)Cl)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J12	compound treatment	1.109	-0.033	-0.44	1.112	-0.0372	-0.51	-0.6729	-0.9979	1233273	CBDivE_004992	CCN1CCN(CC1)c2ccc(Nc3ccnc4cc5ccccc5cc34)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J13	compound treatment	1.164	0.022	0.3	1.118	-0.0312	-0.42	-0.0904	-0.1744	1635573	CBDivE_004993	COc1ccc(cc1CN2CCOCC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J14	compound treatment	1.103	-0.039	-0.53	1.124	-0.0252	-0.34	-0.6145	-0.9786	1012014	CBDivE_004994	CCN(CC)Cc1cc(NC(=O)C)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J15	compound treatment	1.169	0.027	0.36	1.101	-0.0482	-0.66	-0.2066	-0.2751	1915700	CBDivE_004995	C/C(=N\NC(=O)COc1ccc(cc1)C(C)(C)C)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J16	compound treatment	1.091	-0.051	-0.69	1.127	-0.0222	-0.3	-0.7	-0.9318	1915701	CBDivE_004996	CC(OC(=O)C1CC=CCC1C(=O)NCc2ccccc2)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J17	compound treatment	1.148	0.00602	0.08	1.091	-0.0582	-0.79	-0.5034	-0.6314	1143985	CBDivE_004997	O=C1CCNc2cc3ccccc3cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J18	compound treatment	1.108	-0.034	-0.46	1.135	-0.0142	-0.19	-0.4607	-0.9262	1480082	CBDivE_004998	COc1ccccc1NC(=O)C2CC=CCC2C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J19	compound treatment	1.147	0.00502	0.07	1.184	0.0348	0.48	0.3838	0.7999	1915702	CBDivE_004999	Oc1c(I)cc(I)cc1C(=O)Nc2cc(ccc2Cl)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	J20	compound treatment	1.103	-0.039	-0.53	1.158	0.00884	0.12	-0.2866	-0.5313	1915703	CBDivE_005000	COc1ccccc1NC(=O)CCc2ccc(C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K01	compound treatment	1.145	0.00302	0.04	1.14	-0.00916	-0.12	-0.0595	-0.4529	1915704	CBDivE_005001	CC(C)c1ccc(Nc2c(cc([N+](=O)[O-])c3ccccc23)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K02	compound treatment	1.156	0.014	0.19	1.157	0.00784	0.11	0.2093	0.9635	1915705	CBDivE_005002	CC1(C)C/C(=N\O)/c2c(c3cccc(c3)[N+](=O)[O-])c4\C(=N\O)\CC(C)(C)Cc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K03	compound treatment	1.13	-0.012	-0.16	1.133	-0.0162	-0.22	-0.2701	-0.9884	1915706	CBDivE_005003	N/N=C(\CCC(=O)O)/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K04	compound treatment	1.243	0.101	1.36	1.147	-0.00216	-0.03	0.9428	0.6916	1915707	CBDivE_005004	[O-][N+](=O)c1ccc(OCC(=O)Oc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K05	compound treatment	1.18	0.038	0.51	1.189	0.0398	0.54	0.7468	0.9996	1625941	CBDivE_005005	OC(=O)CC1C(C(=O)O)C(=O)C2CCCC1C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K06	compound treatment	1.126	-0.016	-0.22	1.142	-0.00716	-0.1	-0.2215	-0.9359	1915708	CBDivE_005006	NC(=S)N/N=C(/Cc1ccccc1[N+](=O)[O-])\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K07	compound treatment	1.108	-0.034	-0.46	1.098	-0.0512	-0.7	-0.8175	-0.9792	1915709	CBDivE_005007	Cc1ccc(NC(=S)NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K08	compound treatment	1.177	0.035	0.47	1.142	-0.00716	-0.1	0.265	0.5493	1915710	CBDivE_005008	[O-][N+](=O)c1ccc(NNC(=O)C2CC2(c3ccccc3)c4ccccc4)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K09	compound treatment	1.141	-9.78E-4	-0.01	1.16	0.0108	0.15	0.0952	0.6414	1915711	CBDivE_005009	FC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(=O)Nc1nccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K10	compound treatment	1.127	-0.015	-0.2	1.185	0.0358	0.49	0.2027	0.3833	1165622	CBDivE_005010	CCOC(=O)c1c(NC(=O)C)sc2C(=C(CCc12)C=O)Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K11	compound treatment	1.179	0.037	0.5	1.127	-0.0222	-0.3	0.1395	0.2389	1915712	CBDivE_005011	OC(=O)Cn1c2ccccc2c(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K12	compound treatment	1.146	0.00402	0.05	1.1	-0.0492	-0.67	-0.4357	-0.6478	1915713	CBDivE_005012	CCOc1ccccc1N2C(=O)C3C(C2=O)C4(Br)c5ccccc5C3(Br)c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K13	compound treatment	1.122	-0.02	-0.27	1.152	0.00284	0.04	-0.1632	-0.5995	1419083	CBDivE_005013	OC(=O)c1ccccc1C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K14	compound treatment	1.17	0.028	0.38	1.169	0.0198	0.27	0.4586	0.9865	1915714	CBDivE_005014	Nc1cc(N)n(n1)c2ccc3nn(nc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K15	compound treatment	1.475	0.333	4.49	1.489	0.34	4.63	6.4537	0.9999	1912566	CBDivE_005015	Fc1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K16	compound treatment	1.192	0.05	0.67	1.156	0.00684	0.09	0.5431	0.7972	1915715	CBDivE_005016	CC(=O)c1cccc(/N=C/c2ccc(O)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K17	compound treatment	1.155	0.013	0.18	1.158	0.00884	0.12	0.2094	0.9831	1915716	CBDivE_005017	CC(=O)OCCNC(=O)c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K18	compound treatment	1.141	-9.78E-4	-0.01	1.165	0.0158	0.22	0.1434	0.6627	1915717	CBDivE_005018	[O-][N+](=O)c1ccc(Nc2ccccn2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K19	compound treatment	1.146	0.00402	0.05	1.136	-0.0132	-0.18	-0.0886	-0.4723	1915718	CBDivE_005019	CC(C)c1nnc(NC(=O)c2cccc(c2)[N+](=O)[O-])s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	K20	compound treatment	1.157	0.015	0.2	1.189	0.0398	0.54	0.5274	0.9097	1296763	CBDivE_005020	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3ccc(Cl)cc3)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L01	compound treatment	1.17	0.028	0.38	1.163	0.0138	0.19	0.4007	0.9485	1915719	CBDivE_005021	[O-][N+](=O)c1cccc(/C=C/C=N/NC(=O)COc2ccc(Cl)cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L02	compound treatment	1.13	-0.012	-0.16	1.162	0.0128	0.18	0.0095	0.0399	1915720	CBDivE_005022	[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc2ccc(Cl)cc2C(=O)Nc3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L03	compound treatment	1.17	0.028	0.38	1.143	-0.00616	-0.08	0.2079	0.5368	1915721	CBDivE_005023	CC(=O)ON=c1[nH]c2cc3nn[nH]c3cc2[nH]c1=NOC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L04	compound treatment	1.159	0.017	0.23	1.128	-0.0212	-0.29	-0.0417	-0.113	1915722	CBDivE_005024	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)CNc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L05	compound treatment	1.095	-0.047	-0.63	1.17	0.0208	0.28	-0.2472	-0.3559	1915723	CBDivE_005025	COc1ccc2oc(/C=C/Nc3ccccc3)[n+](CCCS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L06	compound treatment	1.118	-0.024	-0.32	1.148	-0.00116	-0.02	-0.2399	-0.7409	1915724	CBDivE_005026	Cc1ccc(OCC(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-])cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L07	compound treatment	1.136	-0.00598	-0.08	1.139	-0.0102	-0.14	-0.155	-0.9668	1915725	CBDivE_005027	CN(C1CCS(=O)(=O)C1)C(=S)SNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L08	compound treatment	1.101	-0.041	-0.55	1.064	-0.0852	-1.16	-1.2121	-0.9424	1915726	CBDivE_005028	CCN1CCN(CC1)c2ccc(Nc3c4ccccc4nc5ccccc35)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L09	compound treatment	1.154	0.012	0.16	1.159	0.00984	0.13	0.2095	0.9956	1915727	CBDivE_005029	CCN(CC)CCNc1nc(/C=C/c2ccc(Cl)cc2)nc3cc4ccccc4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L10	compound treatment	1.145	0.00302	0.04	1.115	-0.0342	-0.47	-0.3006	-0.6428	1170304	CBDivE_005030	OC(=O)CCNc1cc(Cl)ccc1Oc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L11	compound treatment	1.124	-0.018	-0.24	1.141	-0.00816	-0.11	-0.2502	-0.9376	1915728	CBDivE_005031	CNC(CC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L12	compound treatment	1.085	-0.057	-0.77	1.129	-0.0202	-0.27	-0.738	-0.9039	1709481	CBDivE_005032	Cc1ccc(cc1)S(=O)(=O)Nc2cc(C(=O)O)c(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L13	compound treatment	1.144	0.00202	0.03	1.12	-0.0292	-0.4	-0.2619	-0.6571	1729085	CBDivE_005033	O=S(=O)(N(CCOc1ccccc1)C2CCCCC2)c3cccc4nsnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L14	compound treatment	1.094	-0.048	-0.65	1.097	-0.0522	-0.71	-0.9607	-0.9989	1915729	CBDivE_005034	CC1CC(=CC(C)C1C2OCCN2CC3COC4(CCCCC4)O3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L15	compound treatment	1.124	-0.018	-0.24	1.094	-0.0552	-0.75	-0.7034	-0.89	1915730	CBDivE_005035	Cc1cccc(OCC(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L16	compound treatment	1.134	-0.00798	-0.11	1.128	-0.0212	-0.29	-0.2802	-0.9096	1915731	CBDivE_005036	CC(O)CCOC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L17	compound treatment	1.093	-0.049	-0.66	1.16	0.0108	0.15	-0.3627	-0.5357	1915732	CBDivE_005037	COCCOC(=O)Nc1nc2sc3CCCCc3c2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L18	compound treatment	1.071	-0.071	-0.96	1.143	-0.00616	-0.08	-0.7365	-0.7662	1915733	CBDivE_005038	COc1ccccc1NC(=O)C2CC=CCC2C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L19	compound treatment	1.158	0.016	0.22	1.167	0.0178	0.24	0.3248	0.9983	1915734	CBDivE_005039	O=C1CN(Cc2ccccc2)CC(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	L20	compound treatment	1.065	-0.077	-1.04	1.149	-1.63E-4	0.0	-0.7359	-0.7086	1915735	CBDivE_005040	Cc1ccc(CCC(=O)NCCc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M01	compound treatment	1.095	-0.047	-0.63	1.186	0.0368	0.5	-0.0929	-0.1149	1915736	CBDivE_005041	CSC(=S)N/N=C/c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M02	compound treatment	1.147	0.00502	0.07	1.173	0.0238	0.33	0.2778	0.8365	1404939	CBDivE_005042	COc1ccccc1NC(=O)CC2Nc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M03	compound treatment	1.098	-0.044	-0.59	1.159	0.00984	0.13	-0.3247	-0.5338	1915737	CBDivE_005043	Cc1ccc(NC(=O)/C=C/C(=O)O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M04	compound treatment	1.177	0.035	0.47	1.167	0.0178	0.24	0.5061	0.9523	1915738	CBDivE_005044	CC(=O)n1c2c(n(Cc3ccccc3)c4ccccc24)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M05	compound treatment	1.121	-0.021	-0.28	1.146	-0.00316	-0.04	-0.2306	-0.8056	1915739	CBDivE_005045	FC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(=O)Nc1ccc(Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M06	compound treatment	1.157	0.015	0.2	1.164	0.0148	0.2	0.2864	1.0	1625198	CBDivE_005046	COc1ccc(cc1OC)c2cnn(c2N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M07	compound treatment	1.154	0.012	0.16	1.189	0.0398	0.54	0.4988	0.8798	1148202	CBDivE_005047	OC(=O)C(c1c(O)c2ccccc2oc1=O)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M08	compound treatment	1.189	0.047	0.63	1.147	-0.00216	-0.03	0.4277	0.6735	1174882	CBDivE_005048	CCC(=O)CC(c1ccccc1)c2c(O)c3ccccc3sc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M09	compound treatment	1.186	0.044	0.59	1.088	-0.0612	-0.83	-0.1698	-0.1659	1401319	CBDivE_005049	Fc1ccc(cc1)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M10	compound treatment	1.121	-0.021	-0.28	1.144	-0.00516	-0.07	-0.2499	-0.8569	1915740	CBDivE_005050	COc1ccc(cc1)c2nc(CN(C)C)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M11	compound treatment	1.148	0.00602	0.08	1.169	0.0198	0.27	0.2487	0.8806	1471361	CBDivE_005051	O=C(Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)c3cccc(Oc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M12	compound treatment	1.103	-0.039	-0.53	1.134	-0.0152	-0.21	-0.518	-0.9168	1915741	CBDivE_005052	OC(=O)/C=C/C(=O)Nc1ccccc1c2ccccc2NC(=O)\C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M13	compound treatment	1.124	-0.018	-0.24	1.147	-0.00216	-0.03	-0.1924	-0.7873	1594641	CBDivE_005053	COC(=O)c1ccc(NC(=O)c2cc(O)cc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M14	compound treatment	1.102	-0.04	-0.54	1.161	0.0118	0.16	-0.2672	-0.4747	1707072	CBDivE_005054	Cc1cc(C)n(c2ccc(CC(=O)O)cc2)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M15	compound treatment	1.151	0.00902	0.12	1.159	0.00984	0.13	0.1809	0.9988	1467244	CBDivE_005055	CC(C)(C)c1cc(cc(c1)S(=O)(=O)CCc2ccccn2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M16	compound treatment	1.295	0.153	2.06	1.194	0.0448	0.61	1.8921	0.8788	1012952	CBDivE_005056	O=C1C=CC(=O)N1c2ccc(cc2)c3ccc(cc3)N4C(=O)C=CC4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M17	compound treatment	1.166	0.024	0.32	1.144	-0.00516	-0.07	0.1794	0.5409	1459850	CBDivE_005057	CCc1ccc(OCC(O)CNC2CC(C)(C)NC(C)(C)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M18	compound treatment	1.171	0.029	0.39	1.197	0.0478	0.65	0.7381	0.9702	1722183	CBDivE_005058	C(N1CCOCC1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M19	compound treatment	1.1	-0.042	-0.57	1.148	-0.00116	-0.02	-0.4117	-0.7266	1915742	CBDivE_005059	O=C(N/N=C/c1cccs1)C(NC(=O)c2ccccc2)c3n[nH]c(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	M20	compound treatment	1.097	-0.045	-0.61	1.164	0.0148	0.2	-0.286	-0.4471	1279657	CBDivE_005060	O=S(=O)(NCCN1CCCC1)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N01	compound treatment	1.122	-0.02	-0.27	1.128	-0.0212	-0.29	-0.3946	-0.9994	1915743	CBDivE_005061	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N02	compound treatment	1.143	0.00102	0.01	1.172	0.0228	0.31	0.23	0.7377	1310345	CBDivE_005062	Clc1ccc(cc1Cl)S(=O)(=O)NCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N03	compound treatment	1.053	-0.089	-1.2	1.107	-0.0422	-0.57	-1.2553	-0.9432	1504958	CBDivE_005063	CC(=O)Nc1c(Cl)c(Cl)c(NC(=O)C)c2[nH]nnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N04	compound treatment	1.151	0.00902	0.12	1.125	-0.0242	-0.33	-0.1469	-0.4183	1915744	CBDivE_005064	C/C(=N\NC(=O)COc1cc(C)cc(C)c1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N05	compound treatment	1.189	0.047	0.63	1.153	0.00384	0.05	0.4856	0.7628	1915745	CBDivE_005065	CCN1/C(=C/C(=C/c2sc3ccccc3[n+]2CCCS(=O)(=O)O)/N)/Sc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N06	compound treatment	1.118	-0.024	-0.32	1.148	-0.00116	-0.02	-0.2399	-0.7409	1915746	CBDivE_005066	C/C(=N/NC(=O)COc1ccc(Cl)cc1I)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N07	compound treatment	1.081	-0.061	-0.82	1.097	-0.0522	-0.71	-1.0847	-0.9974	1915747	CBDivE_005067	COc1ccccc1NC(=O)CN2C(=O)c3cccc4cccc(C2=O)c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N08	compound treatment	1.088	-0.054	-0.73	1.103	-0.0462	-0.63	-0.96	-0.9974	1639136	CBDivE_005068	Oc1c(Cc2ccccc2)cnc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N09	compound treatment	1.109	-0.033	-0.44	1.112	-0.0372	-0.51	-0.6729	-0.9979	1915748	CBDivE_005069	CCN(CC)CCCC(C)Nc1nc(C)nc2cc(Cl)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N10	compound treatment	1.148	0.00602	0.08	1.15	8.37E-4	0.01	0.0655	0.7986	1382101	CBDivE_005070	OC(=O)CCNc1cc(ccc1C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N11	compound treatment	1.133	-0.00898	-0.12	1.16	0.0108	0.15	0.0189	0.0987	1915749	CBDivE_005071	Oc1ccc(/N=C/c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N12	compound treatment	1.134	-0.00798	-0.11	1.124	-0.0252	-0.34	-0.3187	-0.8863	1159607	CBDivE_005072	O=C(NCC1NCCc2ccccc12)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N13	compound treatment	1.153	0.011	0.15	1.055	-0.0942	-1.28	-0.8028	-0.6211	1915750	CBDivE_005073	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)CNc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N14	compound treatment	1.133	-0.00898	-0.12	1.154	0.00484	0.07	-0.039	-0.2828	1915751	CBDivE_005074	COC(=O)[C@@H]1OC(C)(C)O[C@H]1C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N15	compound treatment	1.128	-0.014	-0.19	1.087	-0.0622	-0.85	-0.7327	-0.8438	1372756	CBDivE_005075	O=S(=O)(NCCc1ccccc1)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N16	compound treatment	1.109	-0.033	-0.44	1.143	-0.00616	-0.08	-0.374	-0.8261	1915752	CBDivE_005076	CC(OC(=O)C1CC=CCC1C(=O)Nc2ccccc2)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N17	compound treatment	1.106	-0.036	-0.49	1.133	-0.0162	-0.22	-0.4991	-0.9362	1915753	CBDivE_005077	Nc1cc(C(=O)O)c(Cl)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N18	compound treatment	1.094	-0.048	-0.65	1.142	-0.00716	-0.1	-0.5267	-0.8047	1915754	CBDivE_005078	CCOP(=O)(OCC)C(C)(C)NC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N19	compound treatment	1.14	-0.00198	-0.03	1.079	-0.0702	-0.96	-0.6954	-0.7265	1915755	CBDivE_005079	COc1ccc(CCN2C(=O)CN(Cc3ccccc3)CC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	N20	compound treatment	1.182	0.04	0.54	1.192	0.0428	0.58	0.7948	0.9992	1915756	CBDivE_005080	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1NC(=O)COc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O01	compound treatment	1.152	0.01	0.14	1.198	0.0488	0.67	0.5665	0.8337	1090041	CBDivE_005081	COc1ccc(cc1)C2CC(=Nc3ccccc3S2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O02	compound treatment	1.148	0.00602	0.08	1.244	0.0948	1.29	0.9719	0.75	1915757	CBDivE_005082	COc1cc(NS(=O)(=O)c2ccc(/N=C/c3cc(ccc3O)[N+](=O)[O-])cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O03	compound treatment	1.143	0.00102	0.01	1.19	0.0408	0.56	0.4035	0.7244	1915758	CBDivE_005083	Cn1c2ccccc2c3nc4ccc(cc4cc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O04	compound treatment	1.13	-0.012	-0.16	1.137	-0.0122	-0.17	-0.2315	-0.9999	1915759	CBDivE_005084	CCN(CC)CCNC1=Nc2ccccc2CCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O05	compound treatment	1.074	-0.068	-0.92	1.143	-0.00616	-0.08	-0.7079	-0.7687	1915760	CBDivE_005085	Fc1ccc(NC(=O)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O06	compound treatment	1.15	0.00802	0.11	1.141	-0.00816	-0.11	-0.0022	-0.0141	1469772	CBDivE_005086	COc1ccc(cc1OC)c2cn[nH]c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O07	compound treatment	1.142	2.19E-5	0.0	1.131	-0.0182	-0.25	-0.1749	-0.7063	1425556	CBDivE_005087	Oc1ccnc2c3nsnc3ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O08	compound treatment	1.16	0.018	0.24	1.209	0.0598	0.82	0.7489	0.8796	1914446	CBDivE_005088	CCC(=O)CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3sc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O09	compound treatment	1.182	0.04	0.54	1.134	-0.0152	-0.21	0.2356	0.4075	1915761	CBDivE_005089	FC(F)(C(=O)Nc1nc[nH]n1)C2(F)OC(F)(F)C(F)(F)C2(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O10	compound treatment	1.176	0.034	0.46	1.161	0.0118	0.16	0.4387	0.9017	1055459	CBDivE_005090	OC(=O)C1Cc2c(CN1)[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O11	compound treatment	1.093	-0.049	-0.66	1.128	-0.0212	-0.29	-0.6713	-0.931	1915762	CBDivE_005091	Oc1ccc2ccccc2c1/C=N/c3ccc(cc3)S(=O)(=O)Nc4nccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O12	compound treatment	1.147	0.00502	0.07	1.165	0.0158	0.22	0.2006	0.8863	1915763	CBDivE_005092	OC(=O)CN(CCN(CC(=O)O)c1ccc(c2ccccc12)S(=O)(=O)O)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O13	compound treatment	1.13	-0.012	-0.16	1.179	0.0298	0.41	0.1734	0.3962	1915764	CBDivE_005093	O=C(N/N=C/c1cccc2ccccc12)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O14	compound treatment	1.14	-0.00198	-0.03	1.15	8.37E-4	0.01	-0.0108	-0.3721	1915765	CBDivE_005094	CC(=O)ON=C1c2nn(CC(=O)N)nc2C(=NOC(=O)C)c3nn(CC(=O)N)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O15	compound treatment	1.202	0.06	0.81	1.182	0.0328	0.45	0.8892	0.961	1160132	CBDivE_005095	Cc1ccc(CCS(=O)(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O16	compound treatment	1.155	0.013	0.18	1.182	0.0328	0.45	0.4408	0.9165	1160190	CBDivE_005096	CCc1ccc(OCC(O)CNC(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O17	compound treatment	1.153	0.011	0.15	1.179	0.0298	0.41	0.3928	0.9069	1695459	CBDivE_005097	CC(C)c1ccc(OCC(O)CNC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O18	compound treatment	1.176	0.034	0.46	1.216	0.0668	0.91	0.969	0.9496	1915766	CBDivE_005098	Oc1ccccc1C2CC(=NN2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O19	compound treatment	1.163	0.021	0.28	1.192	0.0428	0.58	0.6136	0.9449	1915767	CBDivE_005099	CCCCCCCC(=O)N/N=C\1/c2ccccc2-c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	O20	compound treatment	1.182	0.04	0.54	1.221	0.0718	0.98	1.0745	0.9606	1915768	CBDivE_005100	Clc1ccc(cc1)S(=O)(=O)NCCc2nc3ccccc3n2S(=O)(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P01	compound treatment	1.152	0.01	0.14	1.146	-0.00316	-0.04	0.0651	0.4587	1915769	CBDivE_005101	[O-][N+](=O)c1ccc(cc1)n2cccc2/C=N/NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P02	compound treatment	1.12	-0.022	-0.3	1.139	-0.0102	-0.14	-0.3077	-0.94	1915770	CBDivE_005102	Cc1ccc(CC(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P03	compound treatment	1.168	0.026	0.35	1.181	0.0318	0.43	0.5552	0.9944	1915771	CBDivE_005103	c1c2[nH]s[nH]c2cc3[nH]c4nonc4[nH]c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P04	compound treatment	1.138	-0.00398	-0.05	1.159	0.00984	0.13	0.0569	0.3939	1915772	CBDivE_005104	CCOc1cc(I)cc(/C=N/NC(=O)COc2ccccc2Cl)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P05	compound treatment	1.143	0.00102	0.01	1.111	-0.0382	-0.52	-0.3582	-0.6881	1011222	CBDivE_005105	CC(C)c1ccc(C(C)C)c(c1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P06	compound treatment	1.141	-9.78E-4	-0.01	1.118	-0.0312	-0.42	-0.3098	-0.7287	1915773	CBDivE_005106	CCOc1cc(I)cc(/C=N/NC(=O)COc2cccc3ccccc23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P07	compound treatment	1.13	-0.012	-0.16	1.072	-0.0772	-1.05	-0.8583	-0.8062	1915774	CBDivE_005107	OS(=O)(=O)Oc1ccc2cc(ccc2c1)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P08	compound treatment	1.218	0.076	1.03	1.15	8.37E-4	0.01	0.7333	0.7149	1647017	CBDivE_005108	Oc1ccc(Cl)cc1C(=O)Nc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P09	compound treatment	1.125	-0.017	-0.23	1.17	0.0208	0.28	0.039	0.1067	1136461	CBDivE_005109	Clc1ccc(NS(=O)(=O)c2cccc3nsnc23)c(c1)C(=O)Nc4cccc5nsnc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P10	compound treatment	1.08	-0.062	-0.84	1.128	-0.0212	-0.29	-0.7953	-0.8991	1915775	CBDivE_005110	OC(=O)CN(CCCc1ccccc1)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P11	compound treatment	1.044	-0.098	-1.32	1.067	-0.0822	-1.12	-1.7269	-0.9966	1915776	CBDivE_005111	Oc1ccc(/C=N/CC\N=C\c2ccc(O)cc2O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P12	compound treatment	1.099	-0.043	-0.58	1.103	-0.0462	-0.63	-0.8551	-0.9992	1270150	CBDivE_005112	Clc1ccc(cc1)c2nnc(NCCN3CCCC3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P13	compound treatment	1.097	-0.045	-0.61	1.128	-0.0212	-0.29	-0.6331	-0.9423	1915777	CBDivE_005113	O=C(CN1CCOCC1)N2CCc3ccccc3C2CNC(=O)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P14	compound treatment	1.154	0.012	0.16	1.099	-0.0502	-0.68	-0.369	-0.5249	1915778	CBDivE_005114	CCCN1C/C(=C\c2ccc(O)c(OC)c2)/C(=O)\C(=C\c3ccc(O)c(OC)c3)\C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P15	compound treatment	1.089	-0.053	-0.71	1.116	-0.0332	-0.45	-0.8251	-0.9756	1659159	CBDivE_005115	O=C(C1CCCCC1)N2CC(=O)N(CCc3ccccc3)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P16	compound treatment	1.08	-0.062	-0.84	1.101	-0.0482	-0.66	-1.0556	-0.9929	1915779	CBDivE_005116	COC(F)(C(=O)SCCNC(=O)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P17	compound treatment	1.077	-0.065	-0.88	1.169	0.0198	0.27	-0.4286	-0.4672	1255982	CBDivE_005117	COc1cc(OC)c(cc1OC)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P18	compound treatment	1.15	0.00802	0.11	1.102	-0.0472	-0.64	-0.3782	-0.58	1135857	CBDivE_005118	C=CCNC(=O)C1CC=CCC1C(=O)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P19	compound treatment	1.098	-0.044	-0.59	1.116	-0.0332	-0.45	-0.7393	-0.991	1915780	CBDivE_005119	COc1ccc2nccnc2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.16	P20	compound treatment	1.112	-0.03	-0.4	1.174	0.0248	0.34	-0.0465	-0.0881	1915781	CBDivE_005120	Fc1ccc(cc1)C(=O)Oc2c(Br)cc(Br)cc2CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A01	compound treatment	1.147	0.0146	0.2	1.146	-0.0041	-0.06	0.0993	0.4863	1915782	CBDivE_005121	Brc1cc(Br)c(OC(=O)COc2ccc3ccccc3c2)c(CNC(=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A02	compound treatment	1.126	-0.00644	-0.09	1.18	0.0299	0.41	0.2268	0.5441	1915783	CBDivE_005122	COCP(=O)(OC(C)C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A03	compound treatment	1.179	0.0466	0.63	1.171	0.0209	0.28	0.6456	0.9361	1915784	CBDivE_005123	NC(CCS)C(=O)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A04	compound treatment	1.168	0.0356	0.48	1.164	0.0139	0.19	0.4732	0.9175	1915785	CBDivE_005124	O=C/1Nc2ccccc2\C1=N\c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A05	compound treatment	1.114	-0.0184	-0.25	1.192	0.0419	0.57	0.228	0.366	1915786	CBDivE_005125	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1OC(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A06	compound treatment	1.173	0.0406	0.55	1.169	0.0189	0.26	0.5691	0.941	1915787	CBDivE_005126	CCCN1C/C(=C\c2ccc(cc2)N(C)C)/C(=O)\C(=C\c3ccc(cc3)N(C)C)\C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A07	compound treatment	1.158	0.0256	0.34	1.146	-0.0041	-0.06	0.2042	0.5847	1915788	CBDivE_005127	S=C(NNc1ccccc1)NC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A08	compound treatment	1.223	0.0906	1.22	1.166	0.0159	0.22	1.0171	0.8198	1915789	CBDivE_005128	COc1ccc2CCC3C(N(N=C3c2c1)/C(=C/C(=O)C)/C)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A09	compound treatment	1.087	-0.0454	-0.61	1.15	-1.03E-4	0.0	-0.4345	-0.7087	1080020	CBDivE_005129	CC(=O)NCCSSCCNC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A10	compound treatment	1.16	0.0276	0.37	1.137	-0.0131	-0.18	0.1365	0.331	1224421	CBDivE_005130	CC1(C)CC(=O)C(C(=O)C1)C2(O)C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A11	compound treatment	1.047	-0.0854	-1.15	1.198	0.0479	0.65	-0.3532	-0.2666	1373997	CBDivE_005131	COc1ccc(CCc2nc(C)ccc2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A12	compound treatment	1.176	0.0436	0.59	1.157	0.0069	0.09	0.482	0.81	1915790	CBDivE_005132	CC(=O)N/N=C(\C)/c1ccc(cc1)n2cnnn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A13	compound treatment	1.174	0.0416	0.56	1.181	0.0309	0.42	0.6943	0.9901	1723710	CBDivE_005133	C(C1COC2(CCCCC2)O1)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A14	compound treatment	1.186	0.0536	0.72	1.164	0.0139	0.19	0.6449	0.8634	1400347	CBDivE_005134	Oc1ccc(O)c(c1)S(=O)(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A15	compound treatment	1.133	5.56E-4	0.01	1.165	0.0149	0.2	0.1489	0.7327	1915791	CBDivE_005135	CC(C)(c1ccc(Oc2cccc(c2)[N+](=O)[O-])cc1)c3ccc(Oc4cccc(c4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A16	compound treatment	1.214	0.0816	1.1	1.159	0.0089	0.12	0.8638	0.7803	1915792	CBDivE_005136	[O-][N+](=O)c1ccc(cc1)c2csc(=Nc3cccc(Br)c3)n2CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A17	compound treatment	1.115	-0.0174	-0.24	1.165	0.0149	0.2	-0.0228	-0.0732	1915793	CBDivE_005137	CO/C=C(\NCC(=O)c1ccc(N)cc1)/c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A18	compound treatment	1.193	0.0606	0.82	1.19	0.0399	0.54	0.9624	0.9805	1915794	CBDivE_005138	OC(=O)c1cc(ccc1O)S(=O)(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A19	compound treatment	1.113	-0.0194	-0.26	1.116	-0.0341	-0.47	-0.5143	-0.9633	1915795	CBDivE_005139	CCOC(=O)CNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	A20	compound treatment	1.132	-4.44E-4	-0.01	1.148	-0.0021	-0.03	-0.0245	-0.8367	1915796	CBDivE_005140	Cc1ccc(cc1)S(=O)(=O)Nc2cccc(/C=C/C(=O)O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B01	compound treatment	1.146	0.0136	0.18	1.097	-0.0531	-0.72	-0.3827	-0.5124	1915797	CBDivE_005141	[O-][N+](=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B02	compound treatment	1.125	-0.00744	-0.1	1.179	0.0289	0.39	0.2076	0.5106	1643879	CBDivE_005142	CCOC(=O)Cc1nnc2c(Nc3ccccc3F)nc4nonc4n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B03	compound treatment	1.128	-0.00444	-0.06	1.161	0.0109	0.15	0.0627	0.3912	1020464	CBDivE_005143	Nc1cc2nc3ccccc3nc2cc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B04	compound treatment	1.208	0.0756	1.02	1.15	-1.03E-4	0.0	0.7198	0.7061	1639660	CBDivE_005144	CC(C)c1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B05	compound treatment	1.163	0.0306	0.41	1.077	-0.0731	-1.0	-0.4134	-0.3832	1915798	CBDivE_005145	COc1ccc(/C=C\2/NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B06	compound treatment	1.153	0.0206	0.28	1.143	-0.0071	-0.1	0.1276	0.4344	1634178	CBDivE_005146	Oc1cc(=O)n(c2ccccc2)c(=N)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B07	compound treatment	1.084	-0.0484	-0.65	1.165	0.0149	0.2	-0.3185	-0.4654	1915799	CBDivE_005147	CN(C)c1nc(N/N=C/c2c(C)[nH]c3ccccc23)nc(Nc4ccc(F)cc4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B08	compound treatment	1.141	0.00856	0.12	1.108	-0.0421	-0.57	-0.3244	-0.5539	1915800	CBDivE_005148	OCCCN1C(=O)NC(=O)/C(=N/Nc2ccc(cc2)[N+](=O)[O-])/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B09	compound treatment	1.102	-0.0304	-0.41	1.17	0.0199	0.27	-0.0986	-0.2002	1915801	CBDivE_005149	COc1cc(Cl)cc(/C=N/c2ccc3[nH]c(=O)[nH]c3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B10	compound treatment	1.134	0.00156	0.02	1.145	-0.0051	-0.07	-0.0344	-0.4727	1915802	CBDivE_005150	O/N=C(/CC(C\C(=N\O)\c1ccccc1)c2ccccc2)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B11	compound treatment	1.056	-0.0764	-1.03	1.152	0.0019	0.03	-0.7109	-0.6892	1915803	CBDivE_005151	C/C(=N\NC(=O)COc1ccc(cc1C)C(C)(C)C)/CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B12	compound treatment	1.183	0.0506	0.68	1.187	0.0369	0.5	0.838	0.9888	1915804	CBDivE_005152	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)c4ccc(cc4)N5C(=O)c6ccc(cc6C5=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B13	compound treatment	1.191	0.0586	0.79	1.097	-0.0531	-0.72	0.0465	0.0434	1915805	CBDivE_005153	Oc1c(Br)cc(Br)cc1/C=C/2\C(=O)NN(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B14	compound treatment	1.076	-0.0564	-0.76	1.091	-0.0591	-0.81	-1.1083	-0.9996	1774831	CBDivE_005154	Cc1c(NC(=O)c2ccc(Br)c(c2)[N+](=O)[O-])c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B15	compound treatment	1.178	0.0456	0.61	1.147	-0.0031	-0.04	0.4047	0.6569	1915806	CBDivE_005155	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B16	compound treatment	1.171	0.0386	0.52	1.118	-0.0321	-0.44	0.0582	0.0857	1671998	CBDivE_005156	COc1ccc(cc1)N(CN2C(=O)c3ccccc3C2=O)C(=O)c4cccc(OC)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B17	compound treatment	1.15	0.0176	0.24	1.101	-0.0491	-0.67	-0.306	-0.4308	1915807	CBDivE_005157	CC(C)c1cc(Br)c(C)c(Br)c1OCC(=O)N/N=C\2/C(=O)N(C)c3ccc(cc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B18	compound treatment	1.163	0.0306	0.41	1.113	-0.0371	-0.51	-0.0663	-0.1016	1774389	CBDivE_005158	Cc1cccc(c1)N(CN2C(=O)c3ccccc3C2=O)C(=O)c4cc(cc(c4)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B19	compound treatment	1.201	0.0686	0.92	1.151	8.97E-4	0.01	0.6626	0.7164	1915808	CBDivE_005159	CN1C(=O)/C(=N/NC(=O)COc2c(Cl)cc(Cl)cc2Cl)/c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	B20	compound treatment	1.157	0.0246	0.33	1.123	-0.0271	-0.37	-0.0271	-0.0546	1915809	CBDivE_005160	CC(=O)NCCSc1nnnn1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C01	compound treatment	1.103	-0.0294	-0.4	1.121	-0.0291	-0.4	-0.5615	-1.0	1191941	CBDivE_005161	Brc1cc(Br)c(OC(=O)COc2ccccc2)c(CNC(=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C02	compound treatment	1.165	0.0326	0.44	1.182	0.0319	0.43	0.6181	1.0	1915810	CBDivE_005162	CC1(C)CC1C(=O)Oc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C03	compound treatment	1.125	-0.00744	-0.1	1.174	0.0239	0.33	0.1594	0.4675	3106541	CBDivE_005163	CC(C[S-](=O)=O)C(=O)NCCc1ccccc1.NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C04	compound treatment	1.18	0.0476	0.64	1.115	-0.0351	-0.48	0.1152	0.1439	1915812	CBDivE_005164	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4cccc(O)c4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C05	compound treatment	1.121	-0.0114	-0.15	1.097	-0.0531	-0.72	-0.6212	-0.839	1915813	CBDivE_005165	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1OC(=O)COc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C06	compound treatment	1.179	0.0466	0.63	1.202	0.0519	0.71	0.9445	0.9982	1915814	CBDivE_005166	COc1ccc(/C=C/2\CCc3ccc(OC)cc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C07	compound treatment	1.131	-0.00144	-0.02	1.216	0.0659	0.9	0.6216	0.6916	1915815	CBDivE_005167	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Oc2ccc3ccccc3c2CNC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C08	compound treatment	1.142	0.00956	0.13	1.198	0.0479	0.65	0.553	0.8307	1915816	CBDivE_005168	COc1ccc2CCC3C(N(N=C3c2c1)/C(=C/C(=O)C)/C)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C09	compound treatment	1.098	-0.0344	-0.46	1.172	0.0219	0.3	-0.1174	-0.2126	1915817	CBDivE_005169	CCc1nc(C)cc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1OC(=O)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C10	compound treatment	1.152	0.0196	0.26	1.152	0.0019	0.03	0.2048	0.7727	1122972	CBDivE_005170	COc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C11	compound treatment	1.129	-0.00344	-0.05	1.09	-0.0601	-0.82	-0.6124	-0.746	1915818	CBDivE_005171	Cc1cc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c(OC(=O)C5(CC6CC7CC(C6)C5)C7)c(C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C12	compound treatment	1.18	0.0476	0.64	1.172	0.0219	0.3	0.6648	0.9394	1915819	CBDivE_005172	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(cc2)n3cnnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C13	compound treatment	1.102	-0.0304	-0.41	1.116	-0.0341	-0.47	-0.6192	-0.9981	1167585	CBDivE_005173	COc1ccc(cc1)C2OCC(CN3CCCCC3)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C14	compound treatment	1.141	0.00856	0.12	1.176	0.0259	0.35	0.3313	0.8918	1554608	CBDivE_005174	Cc1ccc(cc1C)S(=O)(=O)c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C15	compound treatment	1.173	0.0406	0.55	1.132	-0.0181	-0.25	0.2123	0.3537	1915820	CBDivE_005175	CC(=O)N=c1scc(c2ccccc2)n1c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C16	compound treatment	1.185	0.0526	0.71	1.178	0.0279	0.38	0.7703	0.9574	1546906	CBDivE_005176	COc1ccc(cc1)c2csc(=Nc3ccccc3)n2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C17	compound treatment	1.132	-4.44E-4	-0.01	1.142	-0.0081	-0.11	-0.0824	-0.7443	1915821	CBDivE_005177	CCOC(=O)/N=C(/Nc1c(Cl)cc(Cl)cc1Cl)\C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C18	compound treatment	1.128	-0.00444	-0.06	1.128	-0.0221	-0.3	-0.2555	-0.8315	1915822	CBDivE_005178	COc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C19	compound treatment	1.123	-0.00944	-0.13	1.192	0.0419	0.57	0.3139	0.5363	1915823	CBDivE_005179	OC(=O)/C=C/c1cccc(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	C20	compound treatment	1.133	5.56E-4	0.01	1.115	-0.0351	-0.48	-0.3332	-0.6959	1915824	CBDivE_005180	OC(=O)CCCCc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D01	compound treatment	1.136	0.00356	0.05	1.172	0.0219	0.3	0.2451	0.8103	1915825	CBDivE_005181	O=C(Nc1ccc2ccccc2c1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D02	compound treatment	1.141	0.00856	0.12	1.196	0.0459	0.63	0.5242	0.8236	1915826	CBDivE_005182	C/C(=N\NC(=O)COc1ccc2ccccc2c1)/CC3(O)C(=O)Nc4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D03	compound treatment	1.099	-0.0334	-0.45	1.145	-0.0051	-0.07	-0.3682	-0.8066	1565221	CBDivE_005183	S=C(NC1c2ccccc2Oc3ccccc13)NC4c5ccccc5Oc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D04	compound treatment	1.102	-0.0304	-0.41	1.137	-0.0131	-0.18	-0.4168	-0.9305	1496029	CBDivE_005184	Clc1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D05	compound treatment	1.137	0.00456	0.06	1.156	0.0059	0.08	0.1003	0.9912	1915827	CBDivE_005185	CN(/N=C/c1ccco1)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D06	compound treatment	1.092	-0.0404	-0.55	1.172	0.0219	0.3	-0.1747	-0.2808	1043819	CBDivE_005186	[O-][N+](=O)c1ccc(NN=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D07	compound treatment	1.152	0.0196	0.26	1.113	-0.0371	-0.51	-0.1712	-0.3	1915828	CBDivE_005187	COc1ccccc1/C=N/NC(=O)COc2cc(C)c(Br)cc2C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D08	compound treatment	1.159	0.0266	0.36	1.197	0.0469	0.64	0.7055	0.9625	1915829	CBDivE_005188	Oc1nc(SC(c2ccccc2)c3ccccc3)[nH]c(=O)c1C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D09	compound treatment	1.108	-0.0244	-0.33	1.149	-0.0011	-0.02	-0.2438	-0.7386	1915830	CBDivE_005189	Oc1c(/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4)cc(Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D10	compound treatment	1.151	0.0186	0.25	1.157	0.0069	0.09	0.2435	0.9106	1915831	CBDivE_005190	C/C(=N\NC(=O)CC(=O)O)/C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D11	compound treatment	1.207	0.0746	1.01	1.157	0.0069	0.09	0.7777	0.7699	1915832	CBDivE_005191	CC(=O)Nc1ccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(C)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D12	compound treatment	1.144	0.0116	0.16	1.184	0.0339	0.46	0.4371	0.896	1915833	CBDivE_005192	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)c4ccnc(n4)c5ccc(cc5)N6C(=O)c7ccc(cc7C6=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D13	compound treatment	1.172	0.0396	0.53	1.173	0.0229	0.31	0.5981	0.9674	1915834	CBDivE_005193	Oc1c(Cl)cc(Br)cc1/C=N/c2ccc3[nH]c(=O)[nH]c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D14	compound treatment	1.121	-0.0114	-0.15	1.167	0.0169	0.23	0.0538	0.1938	1264396	CBDivE_005194	O=C(Nc1ccc2c(c1)oc3ccccc32)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D15	compound treatment	1.145	0.0126	0.17	1.175	0.0249	0.34	0.3598	0.9484	1136362	CBDivE_005195	O=C(CSc1nc2ccccc2o1)OCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D16	compound treatment	1.13	-0.00244	-0.03	1.095	-0.0551	-0.75	-0.5546	-0.7374	1915835	CBDivE_005196	CN(C(=O)COc1ccccc1C)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D17	compound treatment	1.159	0.0266	0.36	1.15	-1.03E-4	0.0	0.2523	0.7043	1915836	CBDivE_005197	CN1C(=O)/C(=N\NC(=O)COc2ccc(cc2C)C(C)(C)C)/c3cc(Br)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D18	compound treatment	1.152	0.0196	0.26	1.141	-0.0091	-0.12	0.0988	0.3388	1915837	CBDivE_005198	CCCCCc1ccc(cc1)c2ccc(cc2)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D19	compound treatment	1.105	-0.0274	-0.37	1.175	0.0249	0.34	-0.0217	-0.0433	1915838	CBDivE_005199	COc1ccc(OCC(=O)N/N=C(\C)/CC2(O)C(=O)Nc3ccccc32)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	D20	compound treatment	1.142	0.00956	0.13	1.148	-0.0021	-0.03	0.0709	0.5367	1915839	CBDivE_005200	Oc1c(Br)cc(Br)cc1/C=C/2\C(=O)NN(C2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E01	compound treatment	1.162	0.0296	0.4	1.102	-0.0481	-0.66	-0.1819	-0.2369	1514179	CBDivE_005201	O=C(COc1ccc2ccccc2c1)Oc3ccc4ccccc4c3CNC(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E02	compound treatment	1.159	0.0266	0.36	1.156	0.0059	0.08	0.3102	0.8448	1915840	CBDivE_005202	CCOC(=O)c1c(NC(=O)CN2CCCCC2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E03	compound treatment	1.147	0.0146	0.2	1.118	-0.0321	-0.44	-0.1707	-0.3558	1620415	CBDivE_005203	O=C(COC(=O)C1CC1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E04	compound treatment	1.159	0.0266	0.36	1.111	-0.0391	-0.53	-0.1237	-0.1926	1915841	CBDivE_005204	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccccc4O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E05	compound treatment	1.139	0.00656	0.09	1.138	-0.0121	-0.17	-0.0542	-0.2892	1915842	CBDivE_005205	CC(O)CCC(=O)NCCNC(=O)CCC(C)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E06	compound treatment	1.189	0.0566	0.76	1.183	0.0329	0.45	0.8567	0.9679	1675993	CBDivE_005206	COc1ccc(cc1)C2C3CCc4cc(OC)ccc4C3=NN2C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E07	compound treatment	1.13	-0.00244	-0.03	1.131	-0.0191	-0.26	-0.2075	-0.7903	1261762	CBDivE_005207	O=C(COc1ccccc1)Oc2ccc3ccccc3c2CNC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E08	compound treatment	1.152	0.0196	0.26	1.153	0.0029	0.04	0.2145	0.804	1915843	CBDivE_005208	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E09	compound treatment	1.174	0.0416	0.56	1.172	0.0219	0.3	0.6076	0.9565	1915844	CBDivE_005209	Cc1cc(C)nc(NC(=O)NS(=O)(=O)N(Cc2ccccc2)Cc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E10	compound treatment	1.143	0.0106	0.14	1.19	0.0399	0.54	0.4854	0.8631	1915845	CBDivE_005210	CN(/N=C/c1ccccc1O)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E11	compound treatment	1.054	-0.0784	-1.06	1.207	0.0569	0.78	-0.1997	-0.1522	1513417	CBDivE_005211	CCOc1c(C)cc(cc1C)c2ncccc2OC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E12	compound treatment	1.11	-0.0224	-0.3	1.128	-0.0221	-0.3	-0.4272	-1.0	1873871	CBDivE_005212	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)c2csc(Nc3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E13	compound treatment	1.095	-0.0374	-0.51	1.162	0.0119	0.16	-0.2425	-0.457	1915846	CBDivE_005213	CC(C)(C)C1CCC(CC1)OC(=O)C2CC(=O)OC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E14	compound treatment	1.131	-0.00144	-0.02	1.142	-0.0081	-0.11	-0.0919	-0.8191	1687514	CBDivE_005214	CC(O)(CC(=O)O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E15	compound treatment	1.134	0.00156	0.02	1.132	-0.0181	-0.25	-0.1597	-0.6446	1915847	CBDivE_005215	OC(Cn1ccnc1[N+](=O)[O-])c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E16	compound treatment	1.1	-0.0324	-0.44	1.124	-0.0261	-0.36	-0.5612	-0.9947	1673139	CBDivE_005216	ON=c1ncn(Cc2ccncc2Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E17	compound treatment	1.085	-0.0474	-0.64	1.203	0.0529	0.72	0.0575	0.0596	1915848	CBDivE_005217	CCOc1cc(cc2oc(C)c([N+](=O)[O-])c(=O)c12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E18	compound treatment	1.113	-0.0194	-0.26	1.129	-0.0211	-0.29	-0.389	-0.9989	1309876	CBDivE_005218	OC(=O)c1ccccc1SCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E19	compound treatment	1.136	0.00356	0.05	1.213	0.0629	0.86	0.6404	0.7455	1915849	CBDivE_005219	Clc1ccc(OCC(=O)ON=C2CCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	E20	compound treatment	1.212	0.0796	1.07	1.181	0.0309	0.42	1.0568	0.9166	1486911	CBDivE_005220	OC(=O)c1cccc(NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F01	compound treatment	1.074	-0.0584	-0.79	1.145	-0.0051	-0.07	-0.6067	-0.7665	1720302	CBDivE_005221	Cc1cccc(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F02	compound treatment	1.111	-0.0214	-0.29	1.128	-0.0221	-0.3	-0.4177	-0.9998	1915850	CBDivE_005222	CN1C(=O)/C(=N/NC(=O)COc2cccc(Br)c2)/c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F03	compound treatment	1.1	-0.0324	-0.44	1.138	-0.0121	-0.17	-0.4262	-0.9111	1335995	CBDivE_005223	COc1ccccc1NCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F04	compound treatment	1.097	-0.0354	-0.48	1.144	-0.0061	-0.08	-0.397	-0.8179	1431675	CBDivE_005224	Clc1ccccc1C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F05	compound treatment	1.209	0.0766	1.03	1.14	-0.0101	-0.14	0.6329	0.6074	1239543	CBDivE_005225	O=C(CSc1nc2ccccc2o1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F06	compound treatment	1.15	0.0176	0.24	1.151	8.97E-4	0.01	0.1761	0.7426	1915851	CBDivE_005226	O=C1NC(=S)NC(=O)C1=NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F07	compound treatment	1.144	0.0116	0.16	1.153	0.0029	0.04	0.1382	0.8591	1915852	CBDivE_005227	COc1ccc(Br)cc1/C=N/NC(=O)COc2ccc3ccccc3c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F08	compound treatment	1.165	0.0326	0.44	1.156	0.0059	0.08	0.3674	0.8229	1915853	CBDivE_005228	CN1C(=O)N(C)C(=O)C(=CNCCc2c[nH]c3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F09	compound treatment	1.136	0.00356	0.05	1.168	0.0179	0.24	0.2065	0.8302	1915854	CBDivE_005229	OC(=O)c1ccc(O)c(/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F10	compound treatment	1.102	-0.0304	-0.41	1.114	-0.0361	-0.49	-0.6385	-0.9959	1565043	CBDivE_005230	Nc1nonc1n2nnc(CNc3ccccc3)c2CNc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F11	compound treatment	1.149	0.0166	0.22	1.163	0.0129	0.18	0.2823	0.993	1669002	CBDivE_005231	Cc1c(Nc2nc3nonc3nc2Nc4ccccc4F)c(=O)n(c5ccccc5)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F12	compound treatment	1.17	0.0376	0.51	1.201	0.0509	0.69	0.849	0.988	1915855	CBDivE_005232	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(Cc4ccc(cc4)N5C(=O)c6ccc(cc6C5=O)C(=O)O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F13	compound treatment	1.138	0.00556	0.07	1.161	0.0109	0.15	0.1581	0.9498	1776371	CBDivE_005233	[O-][N+](=O)c1ccc(cc1)c2ccc(o2)c3nc(c([nH]3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F14	compound treatment	1.15	0.0176	0.24	1.126	-0.0241	-0.33	-0.0649	-0.1603	1448601	CBDivE_005234	COc1ccccc1C(=O)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F15	compound treatment	1.14	0.00756	0.1	1.152	0.0019	0.03	0.0904	0.8593	1177938	CBDivE_005235	Cc1ccc(C)c(Nc2nc(Nc3ccc(O)cc3)nc(n2)N4CCOCC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F16	compound treatment	1.111	-0.0214	-0.29	1.137	-0.0131	-0.18	-0.3309	-0.9732	1915856	CBDivE_005236	CN1CCN(CC1)C(=O)C2=COCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F17	compound treatment	1.13	-0.00244	-0.03	1.178	0.0279	0.38	0.2457	0.6434	1331814	CBDivE_005237	CCOC(=O)C1=C(C)NC(=O)NC1c2cc(Cl)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F18	compound treatment	1.168	0.0356	0.48	1.189	0.0389	0.53	0.7142	0.9987	1437742	CBDivE_005238	CC(C)(C)c1ccc(cc1)C(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F19	compound treatment	1.146	0.0136	0.18	1.133	-0.0171	-0.23	-0.0356	-0.1201	1915857	CBDivE_005239	Oc1ccc(/C=N/c2c(nc3ccccn23)c4ccco4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	F20	compound treatment	1.143	0.0106	0.14	1.107	-0.0431	-0.59	-0.3149	-0.5207	1915858	CBDivE_005240	CCOC(=O)c1c(N/C(=N\CC=C)/S)sc2CCCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G01	compound treatment	1.148	0.0156	0.21	1.066	-0.0841	-1.15	-0.6626	-0.5683	1003319	CBDivE_005241	CCOC(=O)CC(C(=O)C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G02	compound treatment	1.194	0.0616	0.83	1.156	0.0059	0.08	0.6441	0.772	1915859	CBDivE_005242	[O-][N+](=O)c1ccc(NC(=O)Cn2nc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G03	compound treatment	1.185	0.0526	0.71	1.153	0.0029	0.04	0.5293	0.7453	1915860	CBDivE_005243	CCC(=S)/C=C/1\Sc2ccc(C)cc2N1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G04	compound treatment	1.14	0.00756	0.1	1.164	0.0139	0.19	0.2061	0.9577	1915861	CBDivE_005244	COc1cc(ccc1O)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G05	compound treatment	1.05	-0.0824	-1.11	1.14	-0.0101	-0.14	-0.8839	-0.7887	1915862	CBDivE_005245	NC(=S)N/N=C/1\C(=O)N(CN2CCOCC2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G06	compound treatment	1.144	0.0116	0.16	1.143	-0.0071	-0.1	0.0417	0.2275	1915863	CBDivE_005246	COc1ccc2C(=O)/C(=C/c3cccc(c3)[N+](=O)[O-])/CCc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G07	compound treatment	1.104	-0.0284	-0.38	1.198	0.0479	0.65	0.1905	0.2515	1508248	CBDivE_005247	COc1ccc(cc1OC)c2ncccc2OC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G08	compound treatment	1.127	-0.00544	-0.07	1.17	0.0199	0.27	0.1399	0.4978	1915864	CBDivE_005248	CC(=O)NC/C(=N/NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G09	compound treatment	1.13	-0.00244	-0.03	1.146	-0.0041	-0.06	-0.0629	-0.9682	1915865	CBDivE_005249	Cc1cc(C)nc(NC(=O)NS(=O)(=O)Nc2ccc(cc2)c3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G10	compound treatment	1.099	-0.0334	-0.45	1.14	-0.0101	-0.14	-0.4164	-0.8828	1915866	CBDivE_005250	COc1ccc(/C=N/N(C)S(=O)(=O)c2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G11	compound treatment	1.153	0.0206	0.28	1.164	0.0139	0.19	0.3301	0.9828	1535606	CBDivE_005251	OC(=O)c1ccc(Oc2cccc(Oc3ccc(C(=O)O)c(c3)C(=O)O)c2)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G12	compound treatment	1.103	-0.0294	-0.4	1.152	0.0019	0.03	-0.2626	-0.6597	1476067	CBDivE_005252	O=S(=O)(N1CCOCC1)c2cccc(c2)S(=O)(=O)c3cccc(c3)S(=O)(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G13	compound treatment	1.117	-0.0154	-0.21	1.158	0.0079	0.11	-0.0712	-0.3035	1492948	CBDivE_005253	CC1CC(=CC(C)C1C2OCC(CN3CCCCC3)O2)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G14	compound treatment	1.137	0.00456	0.06	1.141	-0.0091	-0.12	-0.0443	-0.3199	1719120	CBDivE_005254	Cc1ncsc1CCOC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G15	compound treatment	1.169	0.0366	0.49	1.172	0.0219	0.3	0.5599	0.9711	1915867	CBDivE_005255	ON=c1ncn(Cc2ccncc2Br)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G16	compound treatment	1.171	0.0386	0.52	1.124	-0.0261	-0.36	0.1161	0.1842	1915868	CBDivE_005256	COC(=O)N/C(=C\1/Nc2ccccc2C(NC1=O)c3ccc(OC)cc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G17	compound treatment	1.172	0.0396	0.53	1.181	0.0309	0.42	0.6753	0.9932	1915869	CBDivE_005257	CCOC1=C(C)C(=O)NC(=S)NC1c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G18	compound treatment	1.137	0.00456	0.06	1.149	-0.0011	-0.02	0.0328	0.5187	1050488	CBDivE_005258	OC(=O)CCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G19	compound treatment	1.148	0.0156	0.21	1.095	-0.0551	-0.75	-0.3829	-0.4908	1915870	CBDivE_005259	CCCCCCOC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	G20	compound treatment	1.226	0.0936	1.26	1.186	0.0359	0.49	1.2386	0.9149	1650908	CBDivE_005260	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H01	compound treatment	1.134	0.00156	0.02	1.136	-0.0141	-0.19	-0.1211	-0.6262	1457329	CBDivE_005261	Cc1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H02	compound treatment	1.066	-0.0664	-0.9	1.175	0.0249	0.34	-0.3938	-0.4108	1915871	CBDivE_005262	COc1ccc(OCC(=O)N/N=C\2/C(=O)N(C)c3ccc(cc23)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H03	compound treatment	1.137	0.00456	0.06	1.107	-0.0431	-0.59	-0.3722	-0.6297	1915872	CBDivE_005263	Cc1ccc(NCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H04	compound treatment	1.137	0.00456	0.06	1.136	-0.0141	-0.19	-0.0925	-0.4583	1083867	CBDivE_005264	CNC(=O)Nc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H05	compound treatment	1.13	-0.00244	-0.03	1.153	0.0029	0.04	0.0046	0.0898	1915873	CBDivE_005265	O=C(NCCOC(=O)C1=COCCO1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H06	compound treatment	1.141	0.00856	0.12	1.107	-0.0431	-0.59	-0.334	-0.5576	1915874	CBDivE_005266	CN1C(=O)NC(=O)/C(=C/c2c[nH]c3ccccc23)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H07	compound treatment	1.154	0.0216	0.29	1.122	-0.0281	-0.38	-0.0653	-0.1358	1915875	CBDivE_005267	CC(C)c1cc(Br)c(C)cc1OCC(=O)N/N=C/c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H08	compound treatment	1.133	5.56E-4	0.01	1.135	-0.0151	-0.21	-0.1403	-0.6809	1915876	CBDivE_005268	O=C1NC(=S)NC(=O)C1=CNCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H09	compound treatment	1.141	0.00856	0.12	1.16	0.0099	0.13	0.1771	0.997	1915877	CBDivE_005269	CN(c1ccccc1)c2nc(Nc3ccccc3)nc(/C=C\c4ccccc4)c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H10	compound treatment	1.116	-0.0164	-0.22	1.174	0.0239	0.33	0.0736	0.1866	1135336	CBDivE_005270	Nc1nonc1n2nnc(CNC3CCCCC3)c2CNC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H11	compound treatment	1.156	0.0236	0.32	1.16	0.0099	0.13	0.3201	0.9272	1915878	CBDivE_005271	CCOc1cccc(/C=N/c2ccc3oc(nc3c2)c4ccc(OC)cc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H12	compound treatment	1.12	-0.0124	-0.17	1.131	-0.0191	-0.26	-0.3029	-0.9774	1915879	CBDivE_005272	O=C1N(C(=O)c2ccccc12)n3c(=O)c4ccc5c(=O)n(N6C(=O)c7ccccc7C6=O)c(=O)c8ccc(c3=O)c4c58
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H13	compound treatment	1.134	0.00156	0.02	1.101	-0.0491	-0.67	-0.4586	-0.6846	1915880	CBDivE_005273	Cc1cccc2oc(nc12)c3cccc(/N=C/C=C/c4ccc(cc4)[N+](=O)[O-])c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H14	compound treatment	1.135	0.00256	0.03	1.135	-0.0151	-0.21	-0.1212	-0.5806	1508479	CBDivE_005274	COc1ccccc1C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H15	compound treatment	1.109	-0.0234	-0.32	1.145	-0.0051	-0.07	-0.2728	-0.8425	1915881	CBDivE_005275	Cc1cc(Br)cc2/C(=N/NC(=S)N)/C(=O)Nc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H16	compound treatment	1.139	0.00656	0.09	1.16	0.0099	0.13	0.158	0.979	1727140	CBDivE_005276	Cc1cccc(NC(=O)COc2ccc(C)c(C)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H17	compound treatment	1.127	-0.00544	-0.07	1.072	-0.0781	-1.07	-0.805	-0.7541	1915882	CBDivE_005277	Clc1ccc(cc1)C(=O)Oc2ccc(/C=N/c3ccc4oc(nc4c3)c5ccncc5)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H18	compound treatment	1.112	-0.0204	-0.28	1.131	-0.0191	-0.26	-0.3792	-0.9996	1725965	CBDivE_005278	O=C(Nc1ccc2c(c1)oc3ccccc32)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H19	compound treatment	1.084	-0.0484	-0.65	1.197	0.0469	0.64	-0.0099	-0.0109	1915883	CBDivE_005279	CN(C)c1nc(N/N=C/c2cc(ccc2O)[N+](=O)[O-])nc(Nc3ccc(F)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	H20	compound treatment	1.184	0.0516	0.7	1.142	-0.0081	-0.11	0.4137	0.5874	1321188	CBDivE_005280	Cc1ccc2nc(Cc3nnn[nH]3)[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I01	compound treatment	1.091	-0.0414	-0.56	1.172	0.0219	0.3	-0.1842	-0.2906	1915884	CBDivE_005281	Oc1ccccc1OCCOCCOCCOc2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I02	compound treatment	1.159	0.0266	0.36	1.125	-0.0251	-0.34	0.0113	0.0228	1915885	CBDivE_005282	COCc1c(C)cc(C)c(/C=N/O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I03	compound treatment	1.122	-0.0104	-0.14	1.099	-0.0511	-0.7	-0.5924	-0.8332	1915886	CBDivE_005283	CCOC(=O)c1ccc2n(CC)c(C)[n+](CCCCS(=O)(=O)N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I04	compound treatment	1.185	0.0526	0.71	1.154	0.0039	0.05	0.5389	0.758	1915887	CBDivE_005284	C/C(=N\NC(=O)Nc1ccccc1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I05	compound treatment	1.081	-0.0514	-0.69	1.194	0.0439	0.6	-0.0675	-0.0736	1915888	CBDivE_005285	CCCN1CC2C(N(N=C2/C(=C/c3cccc(OC)c3OC)/C1)C(=O)C)c4cccc(OC)c4OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I06	compound treatment	1.133	5.56E-4	0.01	1.139	-0.0111	-0.15	-0.1018	-0.6712	1915889	CBDivE_005286	COc1ccc2CCC3C(NN=C3c2c1)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I07	compound treatment	1.144	0.0116	0.16	1.167	0.0169	0.23	0.2732	0.9819	1915890	CBDivE_005287	NC(CCS)C(=O)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I08	compound treatment	1.093	-0.0394	-0.53	1.241	0.0909	1.24	0.5002	0.3708	1915891	CBDivE_005288	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/CN2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I09	compound treatment	1.088	-0.0444	-0.6	1.195	0.0449	0.61	0.009	0.0104	1457506	CBDivE_005289	Cc1ccc(NS(=O)(=O)NC(=O)Nc2nc(C)cc(C)n2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I10	compound treatment	1.093	-0.0394	-0.53	1.192	0.0419	0.57	0.0277	0.0355	1915892	CBDivE_005290	CN(/N=C/c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I11	compound treatment	1.181	0.0486	0.66	1.139	-0.0111	-0.15	0.3561	0.5297	1915893	CBDivE_005291	CCC(C)(NC(C)C)P1(=O)OCCC(C)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I12	compound treatment	1.161	0.0286	0.39	1.15	-1.03E-4	0.0	0.2714	0.7045	1915894	CBDivE_005292	Clc1ccc(cc1S(=O)(=O)Nc2ccccc2)S(=O)(=O)c3ccc(Cl)c(c3)S(=O)(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I13	compound treatment	1.147	0.0146	0.2	1.197	0.0469	0.64	0.5911	0.8835	1915895	CBDivE_005293	C/C(=N/OC(=O)COc1ccc(Cl)cc1Cl)/C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I14	compound treatment	1.109	-0.0234	-0.32	1.111	-0.0391	-0.53	-0.6007	-0.9689	1915896	CBDivE_005294	[O-][N+](=O)c1ccc(cc1)c2csc(=Nc3cccc4ccccc34)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I15	compound treatment	1.099	-0.0334	-0.45	1.085	-0.0651	-0.89	-0.9468	-0.9507	1915897	CBDivE_005295	Cc1cccc(N=c2[nH]c(cs2)c3ccc(cc3)[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I16	compound treatment	1.132	-4.44E-4	-0.01	1.164	0.0139	0.19	0.1298	0.6844	1915898	CBDivE_005296	CCOC(=O)C1NC(=O)/C(=C(\C)/Cl)/Nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I17	compound treatment	1.141	0.00856	0.12	1.155	0.0049	0.07	0.1288	0.9661	1915899	CBDivE_005297	CN(C)CCCC(=C1C=C(N(C(=C1)[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])CCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I18	compound treatment	1.12	-0.0124	-0.17	1.131	-0.0191	-0.26	-0.3029	-0.9774	1915900	CBDivE_005298	OC(=O)CCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I19	compound treatment	1.132	-4.44E-4	-0.01	1.161	0.0109	0.15	0.1008	0.6781	1279852	CBDivE_005299	CC1(C)C(CC2OCC(CN3CCCCC3)O2)C4CCC1C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	I20	compound treatment	1.153	0.0206	0.28	1.138	-0.0121	-0.17	0.0794	0.246	1402115	CBDivE_005300	Cc1cccc(NC(=O)COc2ccccc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J01	compound treatment	1.122	-0.0104	-0.14	1.138	-0.0121	-0.17	-0.2163	-0.9969	1915901	CBDivE_005301	O=C(Nc1cccc2ccccc12)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J02	compound treatment	1.154	0.0216	0.29	1.154	0.0039	0.05	0.2432	0.8227	1915902	CBDivE_005302	Oc1c(Cl)cccc1/C=N/c2ccc3oc(nc3c2)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J03	compound treatment	1.09	-0.0424	-0.57	1.126	-0.0241	-0.33	-0.6373	-0.9653	1913246	CBDivE_005303	O=C1N(CNc2ccc3ccccc3c2)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J04	compound treatment	1.105	-0.0274	-0.37	1.159	0.0089	0.12	-0.176	-0.4518	1915903	CBDivE_005304	Nc1ccc(cc1)C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J05	compound treatment	1.135	0.00256	0.03	1.188	0.0379	0.52	0.3898	0.7526	1396825	CBDivE_005305	OC(=O)c1ccc(CNS(=O)(=O)c2ccc(cc2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J06	compound treatment	1.137	0.00456	0.06	1.141	-0.0091	-0.12	-0.0443	-0.3199	1915904	CBDivE_005306	O=C1NC(=O)/C(=C\c2ccco2)/C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J07	compound treatment	1.169	0.0366	0.49	1.203	0.0529	0.72	0.8588	0.9828	1915905	CBDivE_005307	CC(C)c1ccc(C)c(OCC(=O)N/N=C/c2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J08	compound treatment	1.125	-0.00744	-0.1	1.2	0.0499	0.68	0.4101	0.5963	1915906	CBDivE_005308	Oc1[nH]c(=S)[nH]c(=O)c1C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J09	compound treatment	1.17	0.0376	0.51	1.128	-0.0221	-0.3	0.1451	0.2462	1915907	CBDivE_005309	OC(=O)COc1ccccc1/C=C/2\SC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J10	compound treatment	1.157	0.0246	0.33	1.155	0.0049	0.07	0.2815	0.8329	1491077	CBDivE_005310	Nc1ccccc1c2n[nH]c(=S)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J11	compound treatment	1.123	-0.00944	-0.13	1.135	-0.0151	-0.21	-0.2357	-0.9733	1915908	CBDivE_005311	CCOc1cccc(/C=N/c2ccc3oc(nc3c2)c4cccc(OC)c4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J12	compound treatment	1.106	-0.0264	-0.36	1.123	-0.0271	-0.37	-0.5136	-0.9998	1915909	CBDivE_005312	O/N=C(\c1ccc(CCCC(=O)O)s1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J13	compound treatment	1.134	0.00156	0.02	1.152	0.0019	0.03	0.0331	0.9946	1915910	CBDivE_005313	Cc1ccccc1c2nc3cc(/N=C/C=C/c4ccc(cc4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J14	compound treatment	1.117	-0.0154	-0.21	1.126	-0.0241	-0.33	-0.3797	-0.9758	1913269	CBDivE_005314	Cc1ccc(C)n1c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J15	compound treatment	1.175	0.0426	0.57	1.205	0.0549	0.75	0.9353	0.9914	1915911	CBDivE_005315	CN(C)c1nc(N/N=C/c2cc(Br)c(O)c(Br)c2O)nc(Nc3ccc(F)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J16	compound treatment	1.061	-0.0714	-0.96	1.166	0.0159	0.22	-0.5282	-0.5347	1075921	CBDivE_005316	COc1ccc(NC(=O)c2cccc(c2)C(=O)Nc3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J17	compound treatment	1.172	0.0396	0.53	1.16	0.0099	0.13	0.4728	0.8589	1915912	CBDivE_005317	O=C(Oc1ccc(/C=C/2\SC(=S)NC2=O)cc1OC(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J18	compound treatment	1.136	0.00356	0.05	1.133	-0.0171	-0.23	-0.131	-0.5501	1394580	CBDivE_005318	COc1ccc(cc1)N(C(=O)c2ccccc2F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J19	compound treatment	1.138	0.00556	0.07	1.096	-0.0541	-0.74	-0.4687	-0.632	1915913	CBDivE_005319	Oc1ccc(Cl)cc1/C=N/Nc2nc3nonc3nc2Nc4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	J20	compound treatment	1.112	-0.0204	-0.28	1.169	0.0189	0.26	-0.0128	-0.0339	1605626	CBDivE_005320	Oc1ccc(Nc2nc3nonc3nc2Nc4ccc(O)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K01	compound treatment	1.123	-0.00944	-0.13	1.157	0.0069	0.09	-0.0236	-0.1489	1302374	CBDivE_005321	COC(=O)CCC(=O)Oc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K02	compound treatment	1.151	0.0186	0.25	1.117	-0.0331	-0.45	-0.1422	-0.2754	1915914	CBDivE_005322	Clc1ccc(NC(=O)CCCC(=O)OCC#C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K03	compound treatment	1.143	0.0106	0.14	1.148	-0.0021	-0.03	0.0804	0.5536	1915915	CBDivE_005323	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1OC(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K04	compound treatment	1.195	0.0626	0.84	1.145	-0.0051	-0.07	0.5475	0.6466	1915916	CBDivE_005324	CC(NC(=O)/C(=C/c1ccccc1)/NC(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K05	compound treatment	1.107	-0.0254	-0.34	1.147	-0.0031	-0.04	-0.2726	-0.7883	1915917	CBDivE_005325	C=CCOC(=O)CCC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K06	compound treatment	1.139	0.00656	0.09	1.15	-1.03E-4	0.0	0.0615	0.6958	1915918	CBDivE_005326	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3cc(OC)ccc23)C1c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K07	compound treatment	1.084	-0.0484	-0.65	1.171	0.0209	0.28	-0.2606	-0.3656	1915919	CBDivE_005327	NC(CCS)C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K08	compound treatment	1.146	0.0136	0.18	1.173	0.0229	0.31	0.3501	0.9675	1915920	CBDivE_005328	C/C(=N\NC(=N)N)/CN1C(=O)CCC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K09	compound treatment	1.08	-0.0524	-0.71	1.181	0.0309	0.42	-0.2024	-0.2457	1915921	CBDivE_005329	COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc2nc(N)nc(n2)c3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K10	compound treatment	1.106	-0.0264	-0.36	1.185	0.0349	0.48	0.0842	0.1416	1915922	CBDivE_005330	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K11	compound treatment	1.11	-0.0224	-0.3	1.156	0.0059	0.08	-0.1572	-0.5019	1915923	CBDivE_005331	CCOC(=O)CP(=O)(OC(C)C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K12	compound treatment	1.148	0.0156	0.21	1.184	0.0339	0.46	0.4752	0.9362	1303692	CBDivE_005332	O=S(=O)(N1CCOCC1)c2ccc(Cc3ccc(cc3)S(=O)(=O)N4CCOCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K13	compound treatment	1.081	-0.0514	-0.69	1.178	0.0279	0.38	-0.2217	-0.2802	1915924	CBDivE_005333	CCOC(=O)CC(O)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K14	compound treatment	1.163	0.0306	0.41	1.141	-0.0091	-0.12	0.2037	0.4732	1914544	CBDivE_005334	COc1ccccc1Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K15	compound treatment	1.151	0.0186	0.25	1.128	-0.0221	-0.3	-0.0361	-0.0922	1457752	CBDivE_005335	Cc1cccc(N=c2[nH]c(cs2)c3ccccc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K16	compound treatment	1.173	0.0406	0.55	1.171	0.0209	0.28	0.5884	0.9538	1915925	CBDivE_005336	[O-][N+](=O)c1cn(CNc2ccccn2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K17	compound treatment	1.135	0.00256	0.03	1.113	-0.0371	-0.51	-0.3334	-0.6574	1915926	CBDivE_005337	Nc1sc(N=Nc2c(Cl)cc(Cl)cc2Cl)c(c1Cl)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K18	compound treatment	1.155	0.0226	0.3	1.161	0.0109	0.15	0.3202	0.9457	1776028	CBDivE_005338	OC(=O)CN(c1ccc(O)cc1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K19	compound treatment	1.131	-0.00144	-0.02	1.173	0.0229	0.31	0.207	0.6617	1915927	CBDivE_005339	CC(C)OP(=O)(CN1CCCC1=O)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	K20	compound treatment	1.152	0.0196	0.26	1.186	0.0359	0.49	0.5327	0.9579	1317701	CBDivE_005340	Cc1ccc(NC(=O)COc2ccccc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L01	compound treatment	1.146	0.0136	0.18	1.166	0.0159	0.22	0.2826	0.9964	1915928	CBDivE_005341	Cc1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L02	compound treatment	1.107	-0.0254	-0.34	1.159	0.0089	0.12	-0.1569	-0.431	1915929	CBDivE_005342	CN(C)c1nc(N/N=C/c2ccc(O)cc2)nc(Nc3ccc(F)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L03	compound treatment	1.144	0.0116	0.16	1.111	-0.0391	-0.53	-0.2668	-0.4803	1915930	CBDivE_005343	[O-][N+](=O)c1ccccc1C[n+]2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L04	compound treatment	1.14	0.00756	0.1	1.172	0.0219	0.3	0.2832	0.8976	1460205	CBDivE_005344	CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L05	compound treatment	1.088	-0.0444	-0.6	1.124	-0.0261	-0.36	-0.6757	-0.969	1630067	CBDivE_005345	OCC1OC(Oc2ccc3c(=O)c(coc3c2)c4ccc5OCCOc5c4)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L06	compound treatment	1.094	-0.0384	-0.52	1.148	-0.0021	-0.03	-0.387	-0.7451	1915931	CBDivE_005346	CN1C(=O)N(C)C(=O)C(=Cc2c(C)[nH]c3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L07	compound treatment	1.138	0.00556	0.07	1.124	-0.0261	-0.36	-0.1987	-0.5462	1915932	CBDivE_005347	CC(Oc1cccc2ccccc12)C(=O)N/N=C/c3cc(ccc3O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L08	compound treatment	1.142	0.00956	0.13	1.136	-0.0141	-0.19	-0.0448	-0.1936	1915933	CBDivE_005348	COC(=O)Nc1nc2cc(ccc2[nH]1)c3n[nH]c(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L09	compound treatment	1.144	0.0116	0.16	1.16	0.0099	0.13	0.2057	0.9974	1915934	CBDivE_005349	OC(=O)c1cc(/N=C/c2ccc(\C=C\c3[nH]c(=O)nc(O)c3[N+](=O)[O-])cc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L10	compound treatment	1.152	0.0196	0.26	1.15	-1.03E-4	0.0	0.1856	0.7033	1131518	CBDivE_005350	CCOc1ccccc1NC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L11	compound treatment	1.104	-0.0284	-0.38	1.182	0.0319	0.43	0.0362	0.0625	1915935	CBDivE_005351	CCOc1cccc(/C=N/c2ccc3oc(nc3c2)c4ccc5ccccc5c4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L12	compound treatment	1.104	-0.0284	-0.38	1.151	8.97E-4	0.01	-0.2627	-0.6842	1722719	CBDivE_005352	OC(=O)Cc1ccc(CCc2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L13	compound treatment	1.126	-0.00644	-0.09	1.123	-0.0271	-0.37	-0.3228	-0.8502	1915936	CBDivE_005353	COc1ccc(cc1Br)c2nc3cc(/N=C/c4cc(cc(Br)c4O)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L14	compound treatment	1.093	-0.0394	-0.53	1.138	-0.0121	-0.17	-0.493	-0.8848	1449711	CBDivE_005354	Cc1c(NC(=O)C(c2ccccc2)c3ccccc3)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L15	compound treatment	1.104	-0.0284	-0.38	1.183	0.0329	0.45	0.0459	0.0777	1915937	CBDivE_005355	Nn1cnnc1N/N=C/c2cc(cc([N+](=O)[O-])c2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L16	compound treatment	1.136	0.00356	0.05	1.136	-0.0141	-0.19	-0.1021	-0.5149	1208959	CBDivE_005356	COc1ccccc1NC(=O)c2ccc3C(=O)c4ccccc4-c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L17	compound treatment	1.087	-0.0454	-0.61	1.168	0.0179	0.24	-0.2609	-0.3954	1915938	CBDivE_005357	CC(C)c1ccc(OCC(=O)N/N=C(\C)/CC2(O)C(=O)Nc3ccccc32)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L18	compound treatment	1.113	-0.0194	-0.26	1.13	-0.0201	-0.27	-0.3793	-0.9998	1915939	CBDivE_005358	CC(C)COC(=O)c1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L19	compound treatment	1.168	0.0356	0.48	1.147	-0.0031	-0.04	0.3093	0.6422	1915940	CBDivE_005359	[O-][N+](=O)c1cc2OCOc2cc1/C=N/Nc3nc4nonc4nc3Nc5ccccc5F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	L20	compound treatment	1.075	-0.0574	-0.77	1.147	-0.0031	-0.04	-0.5779	-0.7446	1915941	CBDivE_005360	CC(COc1ccccc1)NC(=O)C(F)(F)C(F)(F)OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M01	compound treatment	1.135	0.00256	0.03	1.128	-0.0221	-0.3	-0.1887	-0.6221	1915942	CBDivE_005361	CCOC(=O)/C=C(/C)\Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M02	compound treatment	1.148	0.0156	0.21	1.099	-0.0511	-0.7	-0.3444	-0.4732	1915943	CBDivE_005362	CC(=O)N/C(=C\c1ccccc1)/C(=O)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M03	compound treatment	1.096	-0.0364	-0.49	1.204	0.0539	0.73	0.172	0.1946	1915944	CBDivE_005363	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1OC(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M04	compound treatment	1.153	0.0206	0.28	1.156	0.0059	0.08	0.253	0.8761	1915945	CBDivE_005364	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3cc(OC)ccc23)C1c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M05	compound treatment	1.13	-0.00244	-0.03	1.151	8.97E-4	0.01	-0.0147	-0.417	1388280	CBDivE_005365	O=C(COc1ccccc1)Nc2cccc3c(NC(=O)COc4ccccc4)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M06	compound treatment	1.152	0.0196	0.26	1.178	0.0279	0.38	0.4555	0.984	1704874	CBDivE_005366	COc1ccc2C3=NN(C(C3CCc2c1)c4ccc(F)cc4)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M07	compound treatment	1.134	0.00156	0.02	1.191	0.0409	0.56	0.4092	0.7332	1915946	CBDivE_005367	O=C(Cc1ccccc1)OC2=C(C(=O)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M08	compound treatment	1.127	-0.00544	-0.07	1.172	0.0219	0.3	0.1592	0.5178	1915947	CBDivE_005368	CC(C)(C)OC(=O)N/N=C/c1cccc(/C=N\NC(=O)OC(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M09	compound treatment	1.155	0.0226	0.3	1.134	-0.0161	-0.22	0.0599	0.1596	1382733	CBDivE_005369	Oc1ccc(I)nc1CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M10	compound treatment	1.088	-0.0444	-0.6	1.13	-0.0201	-0.27	-0.6178	-0.9371	1915948	CBDivE_005370	COc1ccc(/C=N/NC(=O)CC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M11	compound treatment	1.143	0.0106	0.14	1.163	0.0129	0.18	0.2251	0.9945	1915949	CBDivE_005371	COC(=O)CP(=O)(OC(C)C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M12	compound treatment	1.11	-0.0224	-0.3	1.15	-1.03E-4	0.0	-0.2151	-0.7104	1650838	CBDivE_005372	CC(=O)Nc1ccc(cc1)S(=O)(=O)COC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M13	compound treatment	1.113	-0.0194	-0.26	1.107	-0.0431	-0.59	-0.6011	-0.9339	1010474	CBDivE_005373	CCOC(=O)C(CC=C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M14	compound treatment	1.101	-0.0314	-0.42	1.167	0.0169	0.23	-0.137	-0.2839	1915950	CBDivE_005374	CCCCCCCC(=O)NC(O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M15	compound treatment	1.137	0.00456	0.06	1.088	-0.0621	-0.85	-0.5554	-0.6541	1915951	CBDivE_005375	COC(CI)(c1ccncc1)n2ccnc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M16	compound treatment	1.163	0.0306	0.41	1.148	-0.0021	-0.03	0.2712	0.6563	1915952	CBDivE_005376	CCOc1ccc(NCn2cnc(c2)[N+](=O)[O-])nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M17	compound treatment	1.137	0.00456	0.06	1.197	0.0469	0.64	0.4957	0.7715	1915953	CBDivE_005377	COC(=O)N/C(=C\1/Nc2ccccc2C(NC1=O)c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M18	compound treatment	1.124	-0.00844	-0.11	1.168	0.0179	0.24	0.092	0.3417	1776029	CBDivE_005378	[O-][N+](=O)c1ccc(Sc2ccccc2C(=O)N3CCOCC3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M19	compound treatment	1.105	-0.0274	-0.37	1.207	0.0569	0.78	0.2868	0.3336	1915954	CBDivE_005379	CCOP(OCC)OC(C(=O)OC(C)(C)C)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	M20	compound treatment	1.113	-0.0194	-0.26	1.136	-0.0141	-0.19	-0.3215	-0.9884	1715893	CBDivE_005380	Cc1ccccc1OCC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N01	compound treatment	1.093	-0.0394	-0.53	1.172	0.0219	0.3	-0.1651	-0.2706	1431298	CBDivE_005381	CC(C)(C)c1ccc(cc1)C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N02	compound treatment	1.148	0.0156	0.21	1.119	-0.0311	-0.42	-0.1515	-0.3202	1915955	CBDivE_005382	Clc1cccc(/C=N/c2ccc(Cc3ccc(\N=C\c4cccc(Cl)c4)cc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N03	compound treatment	1.07	-0.0624	-0.84	1.091	-0.0591	-0.81	-1.1656	-0.9998	1421331	CBDivE_005383	Cc1ccc(cc1)S(=O)(=O)NCc2nnc(N)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N04	compound treatment	1.147	0.0146	0.2	1.122	-0.0281	-0.38	-0.1321	-0.3068	1138833	CBDivE_005384	Clc1cccc(c1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N05	compound treatment	1.176	0.0436	0.59	1.104	-0.0461	-0.63	-0.029	-0.0338	1915956	CBDivE_005385	Nn1cnnc1N/N=C/c2cccc([N+](=O)[O-])c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N06	compound treatment	1.102	-0.0304	-0.41	1.147	-0.0031	-0.04	-0.3203	-0.7759	1915957	CBDivE_005386	O=C1NC(=S)NC(=O)C1=CNCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N07	compound treatment	1.062	-0.0704	-0.95	1.093	-0.0571	-0.78	-1.2226	-0.9951	1915958	CBDivE_005387	Oc1ccc(/N=C/c2cccc(Cl)c2O)cc1c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N08	compound treatment	1.11	-0.0224	-0.3	1.241	0.0909	1.24	0.6624	0.5191	1640356	CBDivE_005388	CCN(CC)CCNc1ccnc2cc3ccccc3cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N09	compound treatment	1.069	-0.0634	-0.86	1.17	0.0199	0.27	-0.4134	-0.4604	1670996	CBDivE_005389	Fc1ccc(NCc2[nH]nnc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N10	compound treatment	1.139	0.00656	0.09	1.159	0.0089	0.12	0.1483	0.9879	1915959	CBDivE_005390	O=C(Nc1c[nH]c(=O)[nH]c1=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5c[nH]c(=O)[nH]c5=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N11	compound treatment	1.172	0.0396	0.53	1.147	-0.0031	-0.04	0.3474	0.649	1915960	CBDivE_005391	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(/C=C/C(=O)O)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N12	compound treatment	1.134	0.00156	0.02	1.107	-0.0431	-0.59	-0.4008	-0.6814	1409129	CBDivE_005392	Cc1ccc(cc1)C(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N13	compound treatment	1.146	0.0136	0.18	1.171	0.0209	0.28	0.3308	0.977	1915961	CBDivE_005393	C(CCc1nc2ccccc2s1)Cc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N14	compound treatment	1.101	-0.0314	-0.42	1.134	-0.0161	-0.22	-0.4552	-0.953	1915962	CBDivE_005394	CC(C)COC(=O)c1ccc(NC(=O)c2ccc3C(=O)c4ccccc4-c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N15	compound treatment	1.109	-0.0234	-0.32	1.161	0.0109	0.15	-0.1186	-0.3393	1915963	CBDivE_005395	Oc1ccccc1/C=N/c2c(nc3ccccn23)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N16	compound treatment	1.081	-0.0514	-0.69	1.139	-0.0111	-0.15	-0.5978	-0.8416	1250881	CBDivE_005396	O=C(Nc1ccc(cc1)c2ccccc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N17	compound treatment	1.122	-0.0104	-0.14	1.156	0.0059	0.08	-0.0428	-0.2636	1915964	CBDivE_005397	Cc1nnc(N/N=C/c2cc(Cl)ccc2O)n1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N18	compound treatment	1.092	-0.0404	-0.55	1.083	-0.0671	-0.92	-1.0328	-0.9695	1913295	CBDivE_005398	Nc1ccc(cc1)C(=O)/C=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N19	compound treatment	1.118	-0.0144	-0.19	1.137	-0.0131	-0.18	-0.2641	-0.9991	1915965	CBDivE_005399	CN(C)c1ccc(cc1)c2nc3ccccn3c2/N=C/c4cc(Cl)ccc4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	N20	compound treatment	1.116	-0.0164	-0.22	1.161	0.0109	0.15	-0.0518	-0.194	1915966	CBDivE_005400	CCN(CC)CCn1c(NC(=O)CCl)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O01	compound treatment	1.138	0.00556	0.07	1.148	-0.0021	-0.03	0.0327	0.4077	1092174	CBDivE_005401	CCOC(=O)C(C(=O)C)C(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O02	compound treatment	1.159	0.0266	0.36	1.116	-0.0341	-0.47	-0.0755	-0.1286	1915967	CBDivE_005402	CC(=O)OCc1c(C)cc(C)c(/C=N/O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O03	compound treatment	1.128	-0.00444	-0.06	1.177	0.0269	0.37	0.217	0.5838	1915968	CBDivE_005403	Cc1ccccc1C(=O)Oc2c(CNC(=O)c3ccccc3)cc(Br)cc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O04	compound treatment	1.12	-0.0124	-0.17	1.222	0.0719	0.98	0.5746	0.5776	1680458	CBDivE_005404	COc1ccc(cc1)C2NC(=S)NC3=C2CCc4cc(OC)ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O05	compound treatment	1.083	-0.0494	-0.67	1.148	-0.0021	-0.03	-0.4919	-0.7368	1915969	CBDivE_005405	[O-][N+](=O)c1ccc(/C=N\Nc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O06	compound treatment	1.168	0.0356	0.48	1.183	0.0329	0.45	0.6564	0.9994	1915970	CBDivE_005406	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3ccc(OC)cc23)C1c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O07	compound treatment	1.1	-0.0324	-0.44	1.161	0.0109	0.15	-0.2044	-0.4423	1915971	CBDivE_005407	CC(=O)NC(C(=O)O)C(C)(C)SSC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O08	compound treatment	1.169	0.0366	0.49	1.125	-0.0251	-0.34	0.1067	0.1777	1915972	CBDivE_005408	NC(=N)N/N=C(\C(O)c1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O09	compound treatment	1.172	0.0396	0.53	1.146	-0.0041	-0.06	0.3378	0.6295	1131965	CBDivE_005409	Cc1ccc(Cc2cncc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O10	compound treatment	1.175	0.0426	0.57	1.119	-0.0311	-0.42	0.106	0.1486	1915973	CBDivE_005410	OC(=O)CC(=O)N/N=C/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O11	compound treatment	1.123	-0.00944	-0.13	1.159	0.0089	0.12	-0.0043	-0.0244	1915974	CBDivE_005411	CCOP(=O)(CN(C)C(=O)C)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O12	compound treatment	1.138	0.00556	0.07	1.138	-0.0121	-0.17	-0.0637	-0.3514	1088328	CBDivE_005412	CC(=O)Nc1ccc(cc1)S(=O)(=O)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O13	compound treatment	1.14	0.00756	0.1	1.18	0.0299	0.41	0.3604	0.8575	1306153	CBDivE_005413	Cc1ccc(Oc2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O14	compound treatment	1.128	-0.00444	-0.06	1.151	8.97E-4	0.01	-0.0337	-0.5515	1529499	CBDivE_005414	CC(C)(C)N=c1scc(c2ccccc2)n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O15	compound treatment	1.16	0.0276	0.37	1.135	-0.0151	-0.21	0.1172	0.2759	1613571	CBDivE_005415	O=S(=O)(Nc1ccccc1)c2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O16	compound treatment	1.135	0.00256	0.03	1.181	0.0309	0.42	0.3223	0.7624	1915975	CBDivE_005416	COc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)Nc2cccc(/C=C/C(=O)O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O17	compound treatment	1.14	0.00756	0.1	1.21	0.0599	0.82	0.6496	0.7892	1915976	CBDivE_005417	OC(=O)/C=C/c1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O18	compound treatment	1.149	0.0166	0.22	1.103	-0.0471	-0.64	-0.2963	-0.4356	1915977	CBDivE_005418	COc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O19	compound treatment	1.122	-0.0104	-0.14	1.173	0.0229	0.31	0.1212	0.3537	1163481	CBDivE_005419	OC(=O)CCC(=O)OCC1CCCO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	O20	compound treatment	1.152	0.0196	0.26	1.154	0.0039	0.05	0.2241	0.8328	1915978	CBDivE_005420	[O-][N+](=O)c1cccc(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P01	compound treatment	1.127	-0.00544	-0.07	1.173	0.0229	0.31	0.1689	0.5264	1915979	CBDivE_005421	Cc1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P02	compound treatment	1.116	-0.0164	-0.22	1.129	-0.0211	-0.29	-0.3603	-0.9917	1915980	CBDivE_005422	CC(C)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P03	compound treatment	1.127	-0.00544	-0.07	1.145	-0.0051	-0.07	-0.1011	-0.9996	1915981	CBDivE_005423	Brc1ccc(cc1)C(=O)Nn2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P04	compound treatment	1.117	-0.0154	-0.21	1.156	0.0059	0.08	-0.0905	-0.4051	1915982	CBDivE_005424	O=C1NC(=O)/C(=C/c2ccccc2)/C(=O)N1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P05	compound treatment	1.141	0.00856	0.12	1.116	-0.0341	-0.47	-0.2472	-0.5159	1915983	CBDivE_005425	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4cccc(c4)C(F)(F)F)ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P06	compound treatment	1.115	-0.0174	-0.24	1.144	-0.0061	-0.08	-0.2253	-0.9024	1915984	CBDivE_005426	CCOc1ccc(cc1)N2C(=O)NC(=O)/C(=N/Nc3ccc(cc3)[N+](=O)[O-])/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P07	compound treatment	1.103	-0.0294	-0.4	1.142	-0.0081	-0.11	-0.359	-0.8707	1915985	CBDivE_005427	C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P08	compound treatment	1.126	-0.00644	-0.09	1.189	0.0389	0.53	0.3136	0.5834	1915986	CBDivE_005428	CCN(CC)CCCNc1ccnc2cc3ccccc3cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P09	compound treatment	1.126	-0.00644	-0.09	1.145	-0.0051	-0.07	-0.1107	-0.9939	1915987	CBDivE_005429	Oc1ccc(Cl)cc1/C=N/c2ccc3[nH]c(=O)[nH]c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P10	compound treatment	1.079	-0.0534	-0.72	1.123	-0.0271	-0.37	-0.7712	-0.9518	1774921	CBDivE_005430	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc-3c(Cc4cc(NC(=O)c5ccc(cc5)[N+](=O)[O-])ccc43)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P11	compound treatment	1.048	-0.0844	-1.14	1.114	-0.0361	-0.49	-1.1537	-0.9296	1915988	CBDivE_005431	OC(=O)c1ccc(O)c(/C=N/c2ccc3[nH]c(=O)[nH]c3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P12	compound treatment	1.091	-0.0414	-0.56	1.109	-0.0411	-0.56	-0.7917	-1.0	1915989	CBDivE_005432	CC(=O)Nc1ccc(cc1)n2c(C)ccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P13	compound treatment	1.078	-0.0544	-0.73	1.142	-0.0081	-0.11	-0.5975	-0.8044	1144006	CBDivE_005433	Cc1cccc(NC(=O)C(Oc2ccccc2)C(=O)Nc3cccc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P14	compound treatment	1.156	0.0236	0.32	1.162	0.0119	0.16	0.3394	0.9513	1530686	CBDivE_005434	COc1ccccc1C(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P15	compound treatment	1.075	-0.0574	-0.77	1.138	-0.0121	-0.17	-0.6647	-0.8389	1915990	CBDivE_005435	CC(C)(C)c1ccc(/C=N/NC(=O)COc2c(Cl)cc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P16	compound treatment	1.084	-0.0484	-0.65	1.133	-0.0171	-0.23	-0.627	-0.9036	1731271	CBDivE_005436	Cc1ccc(cc1)C(=O)Nc2ccc3c(c2)oc4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P17	compound treatment	1.059	-0.0734	-0.99	1.13	-0.0201	-0.27	-0.8944	-0.8701	1915991	CBDivE_005437	COc1cccc(c1)c2nc3cc(/N=C/c4cccc(Cl)c4O)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P18	compound treatment	1.092	-0.0404	-0.55	1.099	-0.0511	-0.7	-0.8786	-0.9927	1915992	CBDivE_005438	CN(c1ccccc1)c2nc(N/N=C/c3ccccc3)nc(C)c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P19	compound treatment	1.071	-0.0614	-0.83	1.092	-0.0581	-0.79	-1.1464	-0.9997	1915993	CBDivE_005439	Clc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.17	P20	compound treatment	1.097	-0.0354	-0.48	1.145	-0.0051	-0.07	-0.3873	-0.8016	1915994	CBDivE_005440	FC(F)(F)OC(F)(F)C(F)(F)C(=O)Nc1ccc(Br)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A01	compound treatment	1.115	-0.00676	-0.09	1.139	-0.00279	-0.04	-0.0914	-0.9251	1915995	CBDivE_005441	FC1(F)C(F)(F)C(F)(F)C(F)(C(=O)N(Cc2ccccc2)Cc3ccccc3)C(F)(F)C1(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A02	compound treatment	1.067	-0.0548	-0.74	1.145	0.00321	0.04	-0.4914	-0.6641	1200184	CBDivE_005442	CC1(C)CC(CC(C)(C)N1)Nc2nc(NC3CC(C)(C)NC(C)(C)C3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A03	compound treatment	1.124	0.00224	0.03	1.151	0.00921	0.13	0.1102	0.8532	1705530	CBDivE_005443	NS(=O)(=O)c1ccc(cc1)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A04	compound treatment	1.149	0.0272	0.37	1.14	-0.00179	-0.02	0.2426	0.6586	1915996	CBDivE_005444	Cc1cccc(C)c1NC(=O)CN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A05	compound treatment	1.088	-0.0338	-0.46	1.179	0.0372	0.51	0.0367	0.0539	1915997	CBDivE_005445	OC(=O)c1ccc(NC(=O)C(=O)N/N=C\2/C(=O)Nc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A06	compound treatment	1.185	0.0632	0.85	1.139	-0.00279	-0.04	0.5764	0.6749	1083398	CBDivE_005446	Oc1c(Cl)cc(cc1Cl)S(=O)(=O)c2cc(Cl)c(O)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A07	compound treatment	1.123	0.00124	0.02	1.131	-0.0108	-0.15	-0.0922	-0.6225	1915998	CBDivE_005447	COC(=O)c1c(N=Nc2no[n+]([O-])c2C(=O)OC)no[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A08	compound treatment	1.202	0.0802	1.08	1.141	-7.94E-4	-0.01	0.7578	0.7	1915999	CBDivE_005448	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A09	compound treatment	1.094	-0.0278	-0.37	1.101	-0.0408	-0.56	-0.6581	-0.9814	1916000	CBDivE_005449	CCOC(=O)C1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A10	compound treatment	1.148	0.0262	0.35	1.116	-0.0258	-0.35	0.0016	0.0033	1423532	CBDivE_005450	Cc1ccc(cc1)S(=O)(=O)c2ccc(Sc3ccc(C)c(C)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A11	compound treatment	1.099	-0.0228	-0.31	1.164	0.0222	0.3	-0.003	-0.0069	1916001	CBDivE_005451	CC(C)CSc1nc(O)cc(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A12	compound treatment	1.241	0.119	1.61	1.142	2.06E-4	0.0	1.1395	0.7083	1916002	CBDivE_005452	O=S(=O)(Cc1ccccc1)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A13	compound treatment	1.145	0.0232	0.31	1.149	0.00721	0.1	0.2912	0.8862	1916003	CBDivE_005453	COc1cc(/C=N/c2ccc3oc(nc3c2)c4ccc(Cl)c(Cl)c4)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A14	compound treatment	1.143	0.0212	0.29	1.153	0.0112	0.15	0.3107	0.9566	1141099	CBDivE_005454	OC(=O)CCS(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A15	compound treatment	1.102	-0.0198	-0.27	1.137	-0.00479	-0.07	-0.2347	-0.8552	1916004	CBDivE_005455	FC(F)(C(=O)Nc1nccs1)C2(F)OC(F)(F)C(F)(F)C2(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A16	compound treatment	1.201	0.0792	1.07	1.127	-0.0148	-0.2	0.6133	0.5637	1204208	CBDivE_005456	CC(C)(C)C(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A17	compound treatment	1.082	-0.0398	-0.54	1.151	0.00921	0.13	-0.2905	-0.5273	1916005	CBDivE_005457	COc1cccc(/C=N/NC(=O)COc2cc(C)ccc2C(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A18	compound treatment	1.148	0.0262	0.35	1.166	0.0242	0.33	0.4838	0.9994	1916006	CBDivE_005458	[O-][N+](=O)c1cccc(/C=C/2\NC(=S)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A19	compound treatment	1.111	-0.0108	-0.15	1.103	-0.0388	-0.53	-0.4767	-0.869	1916007	CBDivE_005459	NCC(=O)N1CCOCCOCCN(CCOCCOCC1)C(=O)CN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	A20	compound treatment	1.127	0.00524	0.07	1.132	-0.00979	-0.13	-0.0444	-0.2939	1916008	CBDivE_005460	Clc1ccccc1/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B01	compound treatment	1.207	0.0852	1.15	1.105	-0.0368	-0.5	0.4584	0.3653	1193554	CBDivE_005461	COc1ccc(CCc2nc(C)ccc2OC(=O)C3(CC4CC5CC(C4)C3)C5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B02	compound treatment	1.124	0.00224	0.03	1.153	0.0112	0.15	0.1295	0.831	1680291	CBDivE_005462	Clc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccc(Cl)cc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B03	compound treatment	1.125	0.00324	0.04	1.172	0.0302	0.41	0.3222	0.7779	1345194	CBDivE_005463	CCN(CC)CCn1c(NC(=O)c2ccc(Cl)cc2Cl)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B04	compound treatment	1.187	0.0652	0.88	1.112	-0.0298	-0.41	0.3351	0.3457	1350533	CBDivE_005464	NC(=O)COc1ccc2ccccc2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B05	compound treatment	1.142	0.0202	0.27	1.064	-0.0778	-1.06	-0.557	-0.5085	1916009	CBDivE_005465	CC1CN(CCN1)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B06	compound treatment	1.145	0.0232	0.31	1.108	-0.0338	-0.46	-0.1041	-0.1868	1155660	CBDivE_005466	CCOC(=O)c1c(C)nc(C)nc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B07	compound treatment	1.063	-0.0588	-0.79	1.142	2.06E-4	0.0	-0.5585	-0.7046	1916010	CBDivE_005467	Clc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B08	compound treatment	1.138	0.0162	0.22	1.086	-0.0558	-0.76	-0.383	-0.4838	1916011	CBDivE_005468	Nc1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4ccc(N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B09	compound treatment	1.066	-0.0558	-0.75	1.151	0.00921	0.13	-0.4431	-0.5811	1916012	CBDivE_005469	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B10	compound treatment	1.132	0.0102	0.14	1.109	-0.0328	-0.45	-0.2185	-0.4668	1692197	CBDivE_005470	O=C(NCc1ccc(CNC(=O)c2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B11	compound treatment	1.048	-0.0738	-1.0	1.155	0.0132	0.18	-0.5762	-0.5699	1916013	CBDivE_005471	O=C1CC(NCc2ccco2)C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B12	compound treatment	1.165	0.0432	0.58	1.158	0.0162	0.22	0.5688	0.9117	1916014	CBDivE_005472	OC(=O)c1ccc2C(=O)N(N3C(=O)c4ccccc4C3=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B13	compound treatment	1.144	0.0222	0.3	1.097	-0.0448	-0.61	-0.2197	-0.3229	1916015	CBDivE_005473	CCN/C(=N\CC)/SC1CC(=O)N(C1=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B14	compound treatment	1.214	0.0922	1.24	1.224	0.0822	1.12	1.6726	0.9986	1423470	CBDivE_005474	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cc(cc(c3)C(=O)O)N4C(=O)c5ccc(cc5C4=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B15	compound treatment	1.142	0.0202	0.27	1.129	-0.0128	-0.17	0.0697	0.2152	1916016	CBDivE_005475	CCOC(=O)CNC1CC(=O)N(C1=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B16	compound treatment	1.144	0.0222	0.3	1.094	-0.0478	-0.65	-0.2487	-0.3466	1375146	CBDivE_005476	COC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B17	compound treatment	1.134	0.0122	0.17	1.106	-0.0358	-0.49	-0.2283	-0.4431	1916017	CBDivE_005477	Nc1ccc(cc1)c2cnc(nc2)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B18	compound treatment	1.141	0.0192	0.26	1.117	-0.0248	-0.34	-0.0555	-0.1302	1774345	CBDivE_005478	COc1cccc(/C=C/C2=NN(C(C2)c3cccc(OC)c3OC)c4ccc(Cl)c(Cl)c4)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B19	compound treatment	1.189	0.0672	0.91	1.15	0.00821	0.11	0.7206	0.7884	1916018	CBDivE_005479	Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)N(CCO)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	B20	compound treatment	1.16	0.0382	0.52	1.125	-0.0168	-0.23	0.2029	0.3594	1775214	CBDivE_005480	OC(=O)c1cc(cc(c1)n2c(=O)c3cc4c(=O)n(c5cc(cc(c5)C(=O)O)C(=O)O)c(=O)c4cc3c2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C01	compound treatment	1.073	-0.0488	-0.66	1.109	-0.0328	-0.45	-0.7813	-0.9823	1916019	CBDivE_005481	OC(=O)c1ccccc1SCCSc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C02	compound treatment	1.139	0.0172	0.23	1.144	0.00221	0.03	0.1858	0.792	1916020	CBDivE_005482	Oc1ccc(/C=N/NC(=O)c2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C03	compound treatment	1.121	-7.56E-4	-0.01	1.159	0.0172	0.23	0.1587	0.6757	1916021	CBDivE_005483	CC(=O)C1(C2C(C3c4ccccc41)C(=O)N(C2=O)c5cccc6ccccc56)c7ccccc37
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C04	compound treatment	1.149	0.0272	0.37	1.121	-0.0208	-0.28	0.0594	0.1279	1415634	CBDivE_005484	CCN(CC)c1ccc2cc(C(=O)N)c(=N)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C05	compound treatment	1.104	-0.0178	-0.24	1.091	-0.0508	-0.69	-0.6592	-0.8994	1916022	CBDivE_005485	Fc1ccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C06	compound treatment	1.147	0.0252	0.34	1.176	0.0342	0.47	0.5706	0.988	1916023	CBDivE_005486	OC(=O)c1cccc(/N=C/c2ccc(\C=N\c3cccc(c3)C(=O)O)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C07	compound treatment	1.107	-0.0148	-0.2	1.17	0.0282	0.38	0.1312	0.303	1916024	CBDivE_005487	CC(=O)Nc1cc(/C=N/Nc2ccccc2)cc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C08	compound treatment	1.172	0.0502	0.68	1.209	0.0672	0.92	1.1273	0.989	1916025	CBDivE_005488	OC(=O)c1ccc(NC(=O)C(=O)N/N=C\2/C(=O)Nc3ccc(Br)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C09	compound treatment	1.103	-0.0188	-0.25	1.157	0.0152	0.21	-0.0323	-0.0987	1916026	CBDivE_005489	O=C(N/N=C/c1ccccc1)C(NC(=O)c2ccccc2)c3n[nH]c(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C10	compound treatment	1.119	-0.00276	-0.04	1.133	-0.00879	-0.12	-0.1111	-0.8848	1774414	CBDivE_005490	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)c2ccc(Oc3ccc(cc3)S(=O)(=O)c4ccc(cc4)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C11	compound treatment	1.133	0.0112	0.15	1.147	0.00521	0.07	0.1575	0.9402	1916027	CBDivE_005491	Oc1cc(=O)[nH]c(SCC(=O)c2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C12	compound treatment	1.254	0.132	1.78	1.179	0.0372	0.51	1.6203	0.8736	1916028	CBDivE_005492	CCOC(=O)CCS(=O)(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C13	compound treatment	1.081	-0.0408	-0.55	1.11	-0.0318	-0.43	-0.6954	-0.9931	1916029	CBDivE_005493	COc1cc(/C=N/c2ccc(cc2)c3nc4ccc(C)cc4s3)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C14	compound treatment	1.133	0.0112	0.15	1.166	0.0242	0.33	0.3407	0.9378	1644254	CBDivE_005494	OC(=O)c1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C15	compound treatment	1.111	-0.0108	-0.15	1.134	-0.00779	-0.11	-0.1778	-0.9883	1916030	CBDivE_005495	COc1ccc2nc(/N=C/c3cc(ccc3O)[N+](=O)[O-])oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C16	compound treatment	1.174	0.0522	0.7	1.173	0.0312	0.43	0.7993	0.9708	1150513	CBDivE_005496	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C17	compound treatment	1.134	0.0122	0.17	1.123	-0.0188	-0.26	-0.0644	-0.2113	1916031	CBDivE_005497	CCc1ccc(OCC(=O)N/N=C/c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C18	compound treatment	1.093	-0.0288	-0.39	1.13	-0.0118	-0.16	-0.388	-0.924	1916032	CBDivE_005498	CC1=C(C)C(=NNC(=S)N)C(=C(C)C1=NNC(=S)N)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C19	compound treatment	1.105	-0.0168	-0.23	1.168	0.0262	0.36	0.0928	0.2196	1916033	CBDivE_005499	OC(=O)/C(=N/c1ccccc1C(=O)O)/Cc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	C20	compound treatment	1.116	-0.00576	-0.08	1.14	-0.00179	-0.02	-0.0722	-0.8869	1916034	CBDivE_005500	CC(C)(C)Nc1nc(NCc2ccccc2)nc(N/N=C/c3ccccc3I)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D01	compound treatment	1.117	-0.00476	-0.06	1.166	0.0242	0.33	0.188	0.5592	1916035	CBDivE_005501	Oc1ccc(cc1)C(=O)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D02	compound treatment	1.131	0.00924	0.12	1.152	0.0102	0.14	0.1866	0.9985	1916036	CBDivE_005502	CC(=O)N1[C@@H](CS[C@@H]1c2ccc(Cl)cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D03	compound treatment	1.054	-0.0678	-0.91	1.122	-0.0198	-0.27	-0.8372	-0.8784	1916037	CBDivE_005503	Cc1cc(O)c2n(CC(=O)N/N=C/c3ccc4OCOc4c3)nc[n+]2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D04	compound treatment	1.086	-0.0358	-0.48	1.124	-0.0178	-0.24	-0.5127	-0.9494	1916038	CBDivE_005504	OC(=O)/C=C/C(=O)Nc1ccccc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D05	compound treatment	1.134	0.0122	0.17	1.159	0.0172	0.23	0.2827	0.9852	1916039	CBDivE_005505	Cc1cc(O)c2n(CC(=O)N/N=C/c3ccco3)nc[n+]2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D06	compound treatment	1.079	-0.0428	-0.58	1.153	0.0112	0.15	-0.2998	-0.5024	1916040	CBDivE_005506	CCOC(=O)c1c(C)nc(nc1N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D07	compound treatment	1.137	0.0152	0.21	1.079	-0.0628	-0.86	-0.4601	-0.5224	1916041	CBDivE_005507	Brc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D08	compound treatment	1.162	0.0402	0.54	1.188	0.0462	0.63	0.8294	0.9972	1916042	CBDivE_005508	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(/C=C/C(=O)c4cccc(c4)N5C(=O)c6ccc(cc6C5=O)C(=O)O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D09	compound treatment	1.102	-0.0198	-0.27	1.135	-0.00679	-0.09	-0.254	-0.9001	1916043	CBDivE_005509	O=C1CC(N2CCN(CC2)c3ncccn3)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D10	compound treatment	1.157	0.0352	0.48	1.125	-0.0168	-0.23	0.1743	0.3302	1704919	CBDivE_005510	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D11	compound treatment	1.171	0.0492	0.66	1.131	-0.0108	-0.15	0.3657	0.5374	1916044	CBDivE_005511	Brc1ccc(cc1)N2C(=O)CC(NCc3cccnc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D12	compound treatment	1.099	-0.0228	-0.31	1.152	0.0102	0.14	-0.1187	-0.3521	1416756	CBDivE_005512	Oc1ccccc1n2c(=O)c3cc4c(=O)n(c5ccccc5O)c(=O)c4cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D13	compound treatment	1.15	0.0282	0.38	1.149	0.00721	0.1	0.3389	0.8613	1916045	CBDivE_005513	Cc1cccc(c1)N2C(=O)CC(S/C(=N\c3ccccc3)/N)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D14	compound treatment	1.136	0.0142	0.19	1.17	0.0282	0.38	0.4079	0.9486	1774918	CBDivE_005514	OC(=O)c1cc(cc(c1)N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-])N4C(=O)c5ccc(cc5C4=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D15	compound treatment	1.131	0.00924	0.12	1.146	0.00421	0.06	0.1287	0.9379	1916046	CBDivE_005515	CCN/C(=N\CC)/SC1CC(=O)N(C1=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D16	compound treatment	1.104	-0.0178	-0.24	1.096	-0.0458	-0.62	-0.6109	-0.9135	1775373	CBDivE_005516	[O-][N+](=O)c1cccc2C(=O)N(CNc3ccc(Br)cc3)C(=O)c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D17	compound treatment	1.138	0.0162	0.22	1.167	0.0252	0.34	0.398	0.9764	1558428	CBDivE_005517	OCCn1c(=O)c2cc3c(=O)n(CCO)c(=O)c3cc2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D18	compound treatment	1.156	0.0342	0.46	1.156	0.0142	0.19	0.4636	0.9255	1690665	CBDivE_005518	Oc1cc(=O)oc2c3ccccc3n(c4ccccc4)c(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D19	compound treatment	1.097	-0.0248	-0.33	1.173	0.0312	0.43	0.0647	0.1197	1916047	CBDivE_005519	CC(O)CN(CC(O)COc1ccc2ccccc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	D20	compound treatment	1.125	0.00324	0.04	1.146	0.00421	0.06	0.0715	0.9911	1916048	CBDivE_005520	Oc1cccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(n4)N5C(=O)c6ccc(cc6C5=O)C(=O)Nc7cccc(O)c7)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E01	compound treatment	1.107	-0.0148	-0.2	1.074	-0.0678	-0.92	-0.7945	-0.8401	1916049	CBDivE_005521	FC(F)(C(=N)Nc1nc2ccccc2s1)C3(F)OC(F)(F)C(F)(F)C3(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E02	compound treatment	1.159	0.0372	0.5	1.147	0.00521	0.07	0.4055	0.7991	1916050	CBDivE_005522	Brc1ccc(cc1)C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E03	compound treatment	1.129	0.00724	0.1	1.083	-0.0588	-0.8	-0.4978	-0.6164	1916051	CBDivE_005523	CC(=O)C1(C2C(C3c4ccccc41)C(=O)N(C2=O)c5ccccc5)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E04	compound treatment	1.205	0.0832	1.12	1.096	-0.0458	-0.62	0.3525	0.2743	1916052	CBDivE_005524	CCCCCCc1cc2cc(C(=O)N)c(=N)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E05	compound treatment	1.152	0.0302	0.41	1.145	0.00321	0.04	0.3194	0.7784	1916053	CBDivE_005525	OC(=O)c1cccc(NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E06	compound treatment	1.172	0.0502	0.68	1.164	0.0222	0.3	0.6934	0.934	1916054	CBDivE_005526	Cc1sc2sc3ccccc3c2[n+]1CCC[S-](=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E07	compound treatment	1.032	-0.0898	-1.21	1.097	-0.0448	-0.61	-1.2881	-0.9498	1687786	CBDivE_005527	CC(C)(C)N1CN2C3C4N(CN(CN4C(=O)N3C1)C(C)(C)C)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E08	compound treatment	1.184	0.0622	0.84	1.164	0.0222	0.3	0.8079	0.9051	1916055	CBDivE_005528	OC(=O)c1ccccc1NC(=O)C(=O)N/N=C\2/C(=O)Nc3ccc(Br)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E09	compound treatment	1.183	0.0612	0.83	1.163	0.0212	0.29	0.7887	0.901	1916056	CBDivE_005529	Oc1ccccc1/C=N/NC(=O)C(NC(=O)c2ccccc2)c3n[nH]c(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E10	compound treatment	1.156	0.0342	0.46	1.174	0.0322	0.44	0.6372	0.9997	1507865	CBDivE_005530	CC(=O)Oc1ccc(cc1Cl)S(=O)(=O)c2ccc(OC(=O)C)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E11	compound treatment	1.064	-0.0578	-0.78	1.179	0.0372	0.51	-0.1922	-0.2067	1916057	CBDivE_005531	COc1ccc(cc1)C(=O)CSc2nc(O)cc(=O)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E12	compound treatment	1.11	-0.0118	-0.16	1.113	-0.0288	-0.39	-0.3898	-0.9205	1456196	CBDivE_005532	COC(=O)CCS(=O)(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E13	compound treatment	1.07	-0.0518	-0.7	1.134	-0.00779	-0.11	-0.5689	-0.8055	1644911	CBDivE_005533	Cc1ccc(NCn2c(=S)n(CNc3ccc(C)c(C)c3)c4ccccc24)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E14	compound treatment	1.1	-0.0218	-0.29	1.16	0.0182	0.25	-0.032	-0.0832	1916058	CBDivE_005534	COC(=O)CCS(=O)(=O)c1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E15	compound treatment	1.127	0.00524	0.07	1.119	-0.0228	-0.31	-0.1698	-0.5326	1916059	CBDivE_005535	Cc1nc(NCCO)nc(NCCO)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E16	compound treatment	1.12	-0.00176	-0.02	1.109	-0.0328	-0.45	-0.333	-0.7435	1916060	CBDivE_005536	OCC(CO)(CO)NC(=O)c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E17	compound treatment	1.079	-0.0428	-0.58	1.172	0.0302	0.41	-0.1166	-0.1645	1916061	CBDivE_005537	Clc1ccccc1/C=N/NC(=O)COc2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E18	compound treatment	1.109	-0.0128	-0.17	1.126	-0.0158	-0.22	-0.274	-0.9938	1916062	CBDivE_005538	C/C(=N\NC(=S)N)/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E19	compound treatment	1.094	-0.0278	-0.37	1.174	0.0322	0.44	0.0458	0.0793	1706486	CBDivE_005539	Nc1cccc(c1)C(=O)Oc2ccc(OC(=O)c3cccc(N)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	E20	compound treatment	1.1	-0.0218	-0.29	1.16	0.0182	0.25	-0.032	-0.0832	1916063	CBDivE_005540	Ic1ccccc1/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F01	compound treatment	1.058	-0.0638	-0.86	1.145	0.00321	0.04	-0.5773	-0.6703	1916064	CBDivE_005541	C/C(=N\NC(=O)c1ccc(O)cc1)/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F02	compound treatment	1.098	-0.0238	-0.32	1.115	-0.0268	-0.37	-0.485	-0.9979	1916065	CBDivE_005542	Fc1ccccc1C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F03	compound treatment	1.093	-0.0288	-0.39	1.123	-0.0188	-0.26	-0.4555	-0.9797	1916066	CBDivE_005543	CCOC(=O)Cc1nnc2c(Nc3ccc(Br)cc3)nc4nonc4n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F04	compound treatment	1.088	-0.0338	-0.46	1.135	-0.00679	-0.09	-0.3875	-0.8339	1659383	CBDivE_005544	CC(N(CC=C)S(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F05	compound treatment	1.182	0.0602	0.81	1.132	-0.00979	-0.13	0.4802	0.5831	1916067	CBDivE_005545	CC1CN(CCN1)c2ccc([N+](=O)[O-])c(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F06	compound treatment	1.124	0.00224	0.03	1.107	-0.0348	-0.47	-0.3141	-0.6607	1916068	CBDivE_005546	[O-][N+](=O)c1cccc(c1)c2nnc(o2)c3cccc(c3)c4nnc(o4)c5cccc(c5)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F07	compound treatment	1.123	0.00124	0.02	1.15	0.00821	0.11	0.091	0.8041	1916069	CBDivE_005547	COc1ccccc1N2C(=O)CC(N3CCN(CC3)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F08	compound treatment	1.166	0.0442	0.6	1.148	0.00621	0.08	0.4819	0.7994	1777027	CBDivE_005548	OC(=O)c1cc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F09	compound treatment	1.116	-0.00576	-0.08	1.165	0.0232	0.32	0.1689	0.5182	1291123	CBDivE_005549	Fc1cccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F10	compound treatment	1.127	0.00524	0.07	1.129	-0.0128	-0.17	-0.0733	-0.3896	1466240	CBDivE_005550	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cc(cc(c3)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F11	compound treatment	1.132	0.0102	0.14	1.175	0.0332	0.45	0.4179	0.8827	1916070	CBDivE_005551	COc1ccc(cc1)N2C(=O)CC(NCc3cccnc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F12	compound treatment	1.128	0.00624	0.08	1.183	0.0412	0.56	0.4569	0.8041	1247055	CBDivE_005552	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F13	compound treatment	1.146	0.0242	0.33	1.167	0.0252	0.34	0.4743	0.9997	1916071	CBDivE_005553	N/C(=N/c1ccccc1)/SC2CC(=O)N(C2=O)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F14	compound treatment	1.174	0.0522	0.7	1.15	0.00821	0.11	0.5775	0.8092	1916072	CBDivE_005554	OC(=O)c1cc(NC(=O)/C=C/c2ccccc2)cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F15	compound treatment	1.152	0.0302	0.41	1.158	0.0162	0.22	0.4448	0.9585	1916073	CBDivE_005555	CN(Cc1ccccc1)C2CC(=O)N(C2=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F16	compound treatment	1.123	0.00124	0.02	1.153	0.0112	0.15	0.1199	0.7801	1916074	CBDivE_005556	[O-][N+](=O)c1cccc2C(=O)N(C(=O)c21)c3cccc(c3)C(=O)OCC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F17	compound treatment	1.128	0.00624	0.08	1.186	0.0442	0.6	0.4858	0.7982	1251229	CBDivE_005557	O=C(Nc1ccc(cc1)c2nc3cc(NC(=O)c4ccccc4)ccc3[nH]2)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F18	compound treatment	1.117	-0.00476	-0.06	1.165	0.0232	0.32	0.1784	0.5525	1916075	CBDivE_005558	CC(C)OP(=O)(OC(C)C)C(Nc1ccc(Br)cc1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F19	compound treatment	1.131	0.00924	0.12	1.134	-0.00779	-0.11	0.013	0.0795	1916076	CBDivE_005559	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(/C=C/C(=O)c4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	F20	compound treatment	1.154	0.0322	0.43	1.086	-0.0558	-0.76	-0.2304	-0.2629	1778001	CBDivE_005560	COC(=O)c1ccc(cc1)C(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G01	compound treatment	1.091	-0.0308	-0.41	1.067	-0.0748	-1.02	-1.0146	-0.9214	1373932	CBDivE_005561	CCN(CC)CCn1c(NC(=O)c2cccc(F)c2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G02	compound treatment	1.11	-0.0118	-0.16	1.146	0.00421	0.06	-0.0716	-0.4245	1025223	CBDivE_005562	CC(=O)NNC(=O)c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G03	compound treatment	1.176	0.0542	0.73	1.126	-0.0158	-0.22	0.3652	0.4787	1916077	CBDivE_005563	[O-][N+](=O)c1cccc(c1)N2C(=O)C3C(C2=O)C4(C=CC3C5C4C(=O)N(C5=O)c6cccc(c6)[N+](=O)[O-])c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G04	compound treatment	1.105	-0.0168	-0.23	1.129	-0.0128	-0.17	-0.2832	-0.9918	1305089	CBDivE_005564	Nc1nc2ccc(cc2s1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G05	compound treatment	1.094	-0.0278	-0.37	1.126	-0.0158	-0.22	-0.4171	-0.9655	1916078	CBDivE_005565	COc1ccc(NC(=S)NC(NC(=O)Cc2ccc(OC)c(OC)c2)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G06	compound treatment	1.101	-0.0208	-0.28	1.125	-0.0168	-0.23	-0.3599	-0.995	1916079	CBDivE_005566	COc1ccc(cc1)C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G07	compound treatment	1.067	-0.0548	-0.74	1.163	0.0212	0.29	-0.3179	-0.4007	1914281	CBDivE_005567	CCCCCC(=O)NCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G08	compound treatment	1.121	-7.56E-4	-0.01	1.175	0.0332	0.45	0.313	0.691	1916080	CBDivE_005568	Clc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)S(=O)(=O)c3ccc(OS(=O)(=O)c4ccc(Cl)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G09	compound treatment	1.121	-7.56E-4	-0.01	1.118	-0.0238	-0.32	-0.2366	-0.729	1916081	CBDivE_005569	C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c2n[nH]c(=O)c3ccccc23)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G10	compound treatment	1.06	-0.0618	-0.83	1.135	-0.00679	-0.09	-0.6546	-0.7809	1774548	CBDivE_005570	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)c2ccc(Cc3ccc(cc3)S(=O)(=O)c4ccc(cc4)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G11	compound treatment	1.137	0.0152	0.21	1.146	0.00421	0.06	0.186	0.8711	1051596	CBDivE_005571	O=C1NC(=O)C(Cc2ccccc2)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G12	compound treatment	1.072	-0.0498	-0.67	1.144	0.00221	0.03	-0.4534	-0.6747	1916082	CBDivE_005572	CC(=O)NC1=NN(C(S1)c2ccccc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G13	compound treatment	1.093	-0.0288	-0.39	1.127	-0.0148	-0.2	-0.417	-0.9536	1916083	CBDivE_005573	COc1ccc(O)c(/C=N/NC(=O)c2ccc(OCc3cccc(Br)c3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G14	compound treatment	1.11	-0.0118	-0.16	1.136	-0.00579	-0.08	-0.168	-0.9482	1502394	CBDivE_005574	COC(=O)CCS(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G15	compound treatment	1.151	0.0292	0.39	1.153	0.0112	0.15	0.387	0.9148	1916084	CBDivE_005575	Cc1ccc2nc(oc2c1)c3cccc(/N=C/c4c(C)c(Cl)c(C)c([N+](=O)[O-])c4O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G16	compound treatment	1.159	0.0372	0.5	1.139	-0.00279	-0.04	0.3283	0.6516	1916085	CBDivE_005576	N(=Nc1ccc(cc1)n2cccn2)c3ccc(cc3)n4cccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G17	compound treatment	1.152	0.0302	0.41	1.165	0.0232	0.32	0.5123	0.9921	1916086	CBDivE_005577	FC(F)(F)COP(=O)(OCC(F)(F)F)OC(c1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G18	compound treatment	1.163	0.0412	0.56	1.165	0.0232	0.32	0.6172	0.9642	1916087	CBDivE_005578	COc1ccc(Br)cc1/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G19	compound treatment	1.248	0.126	1.7	1.084	-0.0578	-0.79	0.647	0.3448	1916088	CBDivE_005579	OC(=O)c1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	G20	compound treatment	1.187	0.0652	0.88	1.153	0.0112	0.15	0.7304	0.8176	1916089	CBDivE_005580	Oc1ccc(/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H01	compound treatment	1.11	-0.0118	-0.16	1.121	-0.0208	-0.28	-0.3126	-0.9623	1916090	CBDivE_005581	Oc1ccc(cc1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H02	compound treatment	1.073	-0.0488	-0.66	1.161	0.0192	0.26	-0.2799	-0.3954	1916091	CBDivE_005582	[O-][N+](=O)c1ccc(OCC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H03	compound treatment	1.14	0.0182	0.25	1.108	-0.0338	-0.46	-0.1518	-0.2906	1916092	CBDivE_005583	Cc1cc(O)c2n(CC(=O)N/N=C/c3ccc(o3)c4ccc(cc4)[N+](=O)[O-])nc[n+]2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H04	compound treatment	1.122	2.44E-4	0.0	1.139	-0.00279	-0.04	-0.0246	-0.6437	1916093	CBDivE_005584	COc1ccc(NC(=O)/C=C\C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H05	compound treatment	1.106	-0.0158	-0.21	1.128	-0.0138	-0.19	-0.2833	-0.9981	1916094	CBDivE_005585	Cc1[nH]c2ccccc2c1/C=N/NC(=O)Cn3nc[n+]4nc(C)cc(O)c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H06	compound treatment	1.128	0.00624	0.08	1.144	0.00221	0.03	0.0808	0.9037	1102596	CBDivE_005586	OC(=O)c1cc(cc(c1)C(=O)O)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H07	compound treatment	1.126	0.00424	0.06	1.105	-0.0368	-0.5	-0.3143	-0.6224	1916095	CBDivE_005587	Cc1cccc(c1)N2C(=O)CC(N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-])C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H08	compound treatment	1.129	0.00724	0.1	1.12	-0.0218	-0.3	-0.141	-0.4508	1602083	CBDivE_005588	Brc1ccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5ccc(Br)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H09	compound treatment	1.13	0.00824	0.11	1.159	0.0172	0.23	0.2445	0.9418	1606592	CBDivE_005589	Fc1cccc(NC(=O)CSC2CC(=O)N(C2=O)c3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H10	compound treatment	1.099	-0.0228	-0.31	1.176	0.0342	0.47	0.1128	0.2019	1916096	CBDivE_005590	[O-][N+](=O)c1ccc2C(=O)N(NC(=O)c3cccc(c3)C(=O)NN4C(=O)c5ccc(cc5C4=O)[N+](=O)[O-])C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H11	compound treatment	1.143	0.0212	0.29	1.161	0.0192	0.26	0.3878	0.999	1916097	CBDivE_005591	Brc1ccc(cc1)N2C(=O)CC(NCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H12	compound treatment	1.117	-0.00476	-0.06	1.145	0.00321	0.04	-0.0145	-0.1862	1916098	CBDivE_005592	OC(=O)c1cc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H13	compound treatment	1.117	-0.00476	-0.06	1.135	-0.00679	-0.09	-0.1109	-0.9839	1916099	CBDivE_005593	O=C1CC(NCc2cccnc2)C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H14	compound treatment	1.114	-0.00776	-0.1	1.142	2.06E-4	0.0	-0.072	-0.6879	1562883	CBDivE_005594	CC(=O)N(C(=O)C)c1ccc(Cc2ccc(cc2)N(C(=O)C)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H15	compound treatment	1.115	-0.00676	-0.09	1.155	0.0132	0.18	0.0629	0.3116	1916100	CBDivE_005595	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H16	compound treatment	1.138	0.0162	0.22	1.14	-0.00179	-0.02	0.1377	0.6243	1558768	CBDivE_005596	COC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(NC(=O)C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H17	compound treatment	1.119	-0.00276	-0.04	1.075	-0.0668	-0.91	-0.6703	-0.7354	1471820	CBDivE_005597	OCCN1C(=O)c2ccc(cc2C1=O)c3ccc4C(=O)N(CCO)C(=O)c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H18	compound treatment	1.108	-0.0138	-0.19	1.149	0.00721	0.1	-0.0617	-0.294	1916101	CBDivE_005598	O=C1N(C(=O)c2ccccc12)n3c(=O)c4cc5c(=O)n(N6C(=O)c7ccccc7C6=O)c(=O)c5cc4c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H19	compound treatment	1.112	-0.00976	-0.13	1.221	0.0792	1.08	0.6707	0.6164	1684351	CBDivE_005599	Oc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(c4)C(=O)Nc5ccc(O)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	H20	compound treatment	1.177	0.0552	0.75	1.136	-0.00579	-0.08	0.4711	0.6286	1916102	CBDivE_005600	CCOC(=O)C1=C(N)Oc2[nH]nc(C)c2C1c3c(C)cc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I01	compound treatment	1.069	-0.0528	-0.71	1.145	0.00321	0.04	-0.4723	-0.6624	1916103	CBDivE_005601	CN1CCOCCOCCOCCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I02	compound treatment	1.143	0.0212	0.29	1.12	-0.0218	-0.3	-0.0075	-0.0181	1916104	CBDivE_005602	Br/C(=C\c1ccccc1)/C=N/NC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I03	compound treatment	1.137	0.0152	0.21	1.093	-0.0488	-0.67	-0.3251	-0.4668	1916105	CBDivE_005603	[O-][N+](=O)c1ccccc1N2C(=O)C3C(C2=O)C4(C=CC3C5C4C(=O)N(C5=O)c6ccccc6[N+](=O)[O-])c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I04	compound treatment	1.107	-0.0148	-0.2	1.127	-0.0148	-0.2	-0.2834	-1.0	1916106	CBDivE_005604	CC(NC(=O)NC(Oc1ccccc1)C(Cl)(Cl)Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I05	compound treatment	1.068	-0.0538	-0.73	1.172	0.0302	0.41	-0.2215	-0.2656	1916107	CBDivE_005605	CCOC(=O)/C(=N/OC(=O)Nc1ccccc1)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I06	compound treatment	1.121	-7.56E-4	-0.01	1.12	-0.0218	-0.3	-0.2174	-0.731	1916108	CBDivE_005606	Cc1cccc(c1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I07	compound treatment	1.12	-0.00176	-0.02	1.159	0.0172	0.23	0.1492	0.6325	1916109	CBDivE_005607	CCCCCC(=O)NC(CC)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I08	compound treatment	1.106	-0.0158	-0.21	1.257	0.115	1.57	0.9606	0.6059	1916110	CBDivE_005608	Cc1ccc(SCc2cccc(c2)C(=O)O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I09	compound treatment	1.269	0.147	1.99	1.165	0.0232	0.32	1.6284	0.8095	1916111	CBDivE_005609	C/C(=N\NC(=O)C(NC(=O)c1ccccc1)c2n[nH]c(=O)c3ccccc23)/c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I10	compound treatment	1.055	-0.0668	-0.9	1.165	0.0232	0.32	-0.413	-0.4327	1774454	CBDivE_005610	Cc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I11	compound treatment	1.085	-0.0368	-0.5	1.129	-0.0128	-0.17	-0.474	-0.9017	1327008	CBDivE_005611	COC(=O)CC1(CC(=O)OC)C(=O)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I12	compound treatment	1.092	-0.0298	-0.4	1.101	-0.0408	-0.56	-0.6772	-0.9872	1916112	CBDivE_005612	CN(C)c1ccc(cc1)C2SC(=NN2C(=O)C)NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I13	compound treatment	1.142	0.0202	0.27	1.171	0.0292	0.4	0.4747	0.9831	1916113	CBDivE_005613	CC(Oc1ccc(Br)cc1)C(=O)N/N=C\c2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I14	compound treatment	1.092	-0.0298	-0.4	1.106	-0.0358	-0.49	-0.629	-0.9953	1440988	CBDivE_005614	Clc1ccc(cc1)C(=O)Nc2ccc3c(c2)oc4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I15	compound treatment	1.091	-0.0308	-0.41	1.108	-0.0338	-0.46	-0.6192	-0.9986	1916114	CBDivE_005615	Oc1ccc(/N=C/c2ccc(OC(=O)c3ccccc3Cl)cc2)cc1c4nc5ccccc5s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I16	compound treatment	1.113	-0.00876	-0.12	1.158	0.0162	0.22	0.0727	0.2903	1916115	CBDivE_005616	CSc1sc2ccccc2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I17	compound treatment	1.188	0.0662	0.89	1.141	-7.94E-4	-0.01	0.6243	0.6985	1916116	CBDivE_005617	CC(C)(C)OC(=O)N1CCOCCOCCN(Cc2ccc(cc2)[N+](=O)[O-])CCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I18	compound treatment	1.093	-0.0288	-0.39	1.134	-0.00779	-0.11	-0.3495	-0.8688	1230418	CBDivE_005618	CCOC(=O)C1=C(C)NC(=O)NC1c2ccc(cc2)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I19	compound treatment	1.132	0.0102	0.14	1.144	0.00221	0.03	0.119	0.8413	1916117	CBDivE_005619	O=C(Oc1ccc(cc1)C2(c3ccccc3-c4ccccc42)c5ccc(OC(=O)c6ccco6)cc5)c7ccco7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	I20	compound treatment	1.121	-7.56E-4	-0.01	1.126	-0.0158	-0.22	-0.1595	-0.7398	1247632	CBDivE_005620	CCN(CC)c1nc(Nc2cc(C)ccc2C)[nH]c(=NN)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J01	compound treatment	1.185	0.0632	0.85	1.161	0.0192	0.26	0.7885	0.8835	1916118	CBDivE_005621	Oc1c(CC=C)cccc1/C=N/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J02	compound treatment	1.148	0.0262	0.35	1.139	-0.00279	-0.04	0.2234	0.6274	1916119	CBDivE_005622	Brc1ccc(cc1)C(=O)COC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J03	compound treatment	1.06	-0.0618	-0.83	1.107	-0.0348	-0.47	-0.9246	-0.9644	1916120	CBDivE_005623	[O-][N+](=O)c1ccccc1/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J04	compound treatment	1.111	-0.0108	-0.15	1.134	-0.00779	-0.11	-0.1778	-0.9883	1916121	CBDivE_005624	COc1ccccc1NC(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J05	compound treatment	1.126	0.00424	0.06	1.147	0.00521	0.07	0.0907	0.9943	1916122	CBDivE_005625	CCOC(=O)C1=C(C)N(C)C(=NC1c2ccco2)SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J06	compound treatment	1.142	0.0202	0.27	1.148	0.00621	0.08	0.253	0.8847	1916123	CBDivE_005626	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(N=Nc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J07	compound treatment	1.147	0.0252	0.34	1.178	0.0362	0.49	0.5899	0.9836	1916124	CBDivE_005627	COc1ccccc1N2C(=O)CC(N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-])C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J08	compound treatment	1.125	0.00324	0.04	1.165	0.0232	0.32	0.2547	0.7973	1916125	CBDivE_005628	[O-][N+](=O)c1ccc(cc1)c2nc3ccc(Cc4ccc5nc(oc(=O)c5c4)c6ccc(cc6)[N+](=O)[O-])cc3c(=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J09	compound treatment	1.145	0.0232	0.31	1.115	-0.0268	-0.37	-0.0366	-0.0761	1299699	CBDivE_005629	Fc1cccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J10	compound treatment	1.135	0.0132	0.18	1.159	0.0172	0.23	0.2922	0.991	1455698	CBDivE_005630	O=C1N(C(=O)c2cc(ccc12)c3ccc4C(=O)N(C(=O)c4c3)c5nccs5)c6nccs6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J11	compound treatment	1.113	-0.00876	-0.12	1.157	0.0152	0.21	0.0631	0.2644	1916126	CBDivE_005631	Clc1ccc(cc1)N2C(=O)CC(NCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J12	compound treatment	1.068	-0.0538	-0.73	1.117	-0.0248	-0.34	-0.7519	-0.9397	1916127	CBDivE_005632	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(c3)C(=O)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J13	compound treatment	1.108	-0.0138	-0.19	1.151	0.00921	0.13	-0.0425	-0.1895	1916128	CBDivE_005633	COc1ccccc1N2CCN(CC2)C3CC(=O)N(C3=O)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J14	compound treatment	1.087	-0.0348	-0.47	1.132	-0.00979	-0.13	-0.426	-0.8738	1561136	CBDivE_005634	Oc1ccccc1NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(c4)C(=O)Nc5ccccc5O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J15	compound treatment	1.159	0.0372	0.5	1.2	0.0582	0.79	0.9165	0.9757	1359373	CBDivE_005635	OC(=O)c1cc(NC(=O)c2ccccc2C(=O)O)cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J16	compound treatment	1.061	-0.0608	-0.82	1.139	-0.00279	-0.04	-0.6065	-0.7392	1916129	CBDivE_005636	CCCCOC(=O)c1cccc(NCN2C(=O)c3ccc(Br)cc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J17	compound treatment	1.115	-0.00676	-0.09	1.172	0.0302	0.41	0.2268	0.5376	1916130	CBDivE_005637	[O-][N+](=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)c4nc5cc(ccc5[nH]4)N6C(=O)c7ccc(cc7C6=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J18	compound treatment	1.134	0.0122	0.17	1.153	0.0112	0.15	0.2249	0.9992	1916131	CBDivE_005638	OC(=O)c1cc(cc(c1)C(=O)O)N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J19	compound treatment	1.144	0.0222	0.3	1.117	-0.0248	-0.34	-0.0269	-0.0595	1122880	CBDivE_005639	Oc1cccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(c4)C(=O)Nc5cccc(O)c5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	J20	compound treatment	1.095	-0.0268	-0.36	1.127	-0.0148	-0.2	-0.3979	-0.9622	1916132	CBDivE_005640	CN(CC(O)COCCN1CCOCC1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K01	compound treatment	1.131	0.00924	0.12	1.135	-0.00679	-0.09	0.0227	0.1459	1916133	CBDivE_005641	OCCN1CCOCCOCCN(CCO)CCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K02	compound treatment	1.123	0.00124	0.02	1.107	-0.0348	-0.47	-0.3236	-0.6817	1916134	CBDivE_005642	NC(=S)N/N=C(/C(=N/NC(=S)N)/c1ccccc1)\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K03	compound treatment	1.099	-0.0228	-0.31	1.114	-0.0278	-0.38	-0.4851	-0.9945	1916135	CBDivE_005643	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4cccc5ccccc45)C1(C)C6C2C(=O)N(C6=O)c7cccc8ccccc78
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K04	compound treatment	1.138	0.0162	0.22	1.141	-7.94E-4	-0.01	0.1473	0.6714	1916136	CBDivE_005644	CC(C)C1(C)NC(=NC1=O)c2ncccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K05	compound treatment	1.107	-0.0148	-0.2	1.147	0.00521	0.07	-0.0906	-0.4285	1916137	CBDivE_005645	COc1ccc(O)c(/C=N/OC(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K06	compound treatment	1.117	-0.00476	-0.06	1.132	-0.00979	-0.13	-0.1398	-0.9436	1104701	CBDivE_005646	Cc1ccc(cc1)S(=O)(=O)N=C2C=CC(=NS(=O)(=O)c3ccc(C)cc3)C=C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K07	compound treatment	1.051	-0.0708	-0.95	1.161	0.0192	0.26	-0.4898	-0.4948	1916138	CBDivE_005647	Cc1cccc(/N=C/2\C(C(=O)c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K08	compound treatment	1.198	0.0762	1.03	1.183	0.0412	0.56	1.1246	0.9595	1916139	CBDivE_005648	OC(=O)CSc1cccc(SCC(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K09	compound treatment	1.089	-0.0328	-0.44	1.161	0.0192	0.26	-0.1273	-0.2478	1916140	CBDivE_005649	FC(F)(F)C(=O)NC(CC(=O)Nc1ccc(Br)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K10	compound treatment	1.102	-0.0198	-0.27	1.226	0.0842	1.15	0.6235	0.5289	1600585	CBDivE_005650	OC(=O)c1ccc(cc1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)c3ccc(C(=O)O)c(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K11	compound treatment	1.121	-7.56E-4	-0.01	1.143	0.00121	0.02	0.0044	0.2282	1057093	CBDivE_005651	[O-][N+](=O)c1ccccc1C=C2C(=O)NC(=O)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K12	compound treatment	1.134	0.0122	0.17	1.127	-0.0148	-0.2	-0.0259	-0.0991	1916141	CBDivE_005652	Clc1ccc(cc1)S(=O)(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K13	compound treatment	1.06	-0.0618	-0.83	1.164	0.0222	0.3	-0.375	-0.423	1916142	CBDivE_005653	Oc1ccc(cc1/C=N/NC(=O)c2ccc(OCc3cccc(Br)c3)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K14	compound treatment	1.16	0.0382	0.52	1.139	-0.00279	-0.04	0.3379	0.6531	1316075	CBDivE_005654	Clc1ccc(cc1)C(=O)Nc2ccccc2NC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K15	compound treatment	1.135	0.0132	0.18	1.133	-0.00879	-0.12	0.0415	0.1931	1916143	CBDivE_005655	[O-][N+](=O)c1ccccc1/C=N/NC(=O)COc2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K16	compound treatment	1.137	0.0152	0.21	1.161	0.0192	0.26	0.3306	0.9928	1916144	CBDivE_005656	CCOC(=O)CCn1c(=O)n(C)c2nc3N(CCn3c2c1=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K17	compound treatment	1.137	0.0152	0.21	1.123	-0.0188	-0.26	-0.0358	-0.109	1916145	CBDivE_005657	O=C(OCc1ccccc1)N2CCOCCOCCNCCOCCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K18	compound treatment	1.139	0.0172	0.23	1.136	-0.00579	-0.08	0.1086	0.4422	1916146	CBDivE_005658	Clc1ccc(/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K19	compound treatment	1.156	0.0342	0.46	1.166	0.0242	0.33	0.5601	0.9864	1377456	CBDivE_005659	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	K20	compound treatment	1.165	0.0432	0.58	1.17	0.0282	0.38	0.6845	0.9796	1916147	CBDivE_005660	COc1ccc(/C=N/Nc2nc3nonc3nc2Nc4cccc(C)c4)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L01	compound treatment	1.141	0.0192	0.26	1.149	0.00721	0.1	0.2531	0.9116	1916148	CBDivE_005661	COc1cc(cc(c1OC)S(=O)(=O)O)c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L02	compound treatment	1.098	-0.0238	-0.32	1.139	-0.00279	-0.04	-0.2536	-0.7856	1916149	CBDivE_005662	CCOC(=O)c1ccc(NC(=O)/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L03	compound treatment	1.151	0.0292	0.39	1.137	-0.00479	-0.07	0.2327	0.582	1916150	CBDivE_005663	Cc1cc(O)c2n(CC(=O)N/N=C/c3c[nH]c4ccccc34)nc[n+]2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L04	compound treatment	1.136	0.0142	0.19	1.135	-0.00679	-0.09	0.0704	0.3299	1331391	CBDivE_005664	COc1ccccc1NC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L05	compound treatment	1.077	-0.0448	-0.6	1.123	-0.0188	-0.26	-0.6082	-0.9272	1916151	CBDivE_005665	COc1ccc(/C=N/c2c(nc3ccccn23)c4cccc(c4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L06	compound treatment	1.127	0.00524	0.07	1.132	-0.00979	-0.13	-0.0444	-0.2939	1678099	CBDivE_005666	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(n3)N4C(=O)c5ccc(cc5C4=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L07	compound treatment	1.098	-0.0238	-0.32	1.092	-0.0498	-0.68	-0.7068	-0.9413	1916152	CBDivE_005667	O=C1CC(N2CCN(CC2)c3ccccc3)C(=O)N1c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L08	compound treatment	1.128	0.00624	0.08	1.089	-0.0528	-0.72	-0.4495	-0.6201	1775919	CBDivE_005668	OC(=O)c1ccccc1NC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L09	compound treatment	1.141	0.0192	0.26	1.17	0.0282	0.38	0.4555	0.9817	1458029	CBDivE_005669	Clc1cccc(NC(=O)CSC2CC(=O)N(C2=O)c3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L10	compound treatment	1.116	-0.00576	-0.08	1.129	-0.0128	-0.17	-0.1783	-0.9335	1484923	CBDivE_005670	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4ccc(NC(=O)C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L11	compound treatment	1.104	-0.0178	-0.24	1.176	0.0342	0.47	0.1604	0.306	1916153	CBDivE_005671	CCOC(=O)CNC1CC(=O)N(C1=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L12	compound treatment	1.08	-0.0418	-0.56	1.118	-0.0238	-0.32	-0.6278	-0.9657	1090868	CBDivE_005672	OC(=O)c1ccccc1NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L13	compound treatment	1.119	-0.00276	-0.04	1.112	-0.0298	-0.41	-0.3136	-0.7686	1916154	CBDivE_005673	COc1ccccc1N2CCN(CC2)C3CC(=O)N(C3=O)c4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L14	compound treatment	1.114	-0.00776	-0.1	1.157	0.0152	0.21	0.0726	0.3127	1297480	CBDivE_005674	Oc1ccccc1NC(=O)c2cccc(c2)C(=O)Nc3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L15	compound treatment	1.06	-0.0618	-0.83	1.195	0.0532	0.73	-0.0761	-0.0689	1400863	CBDivE_005675	CC(C)(C)C(=O)Nc1cc(NC(=O)C(C)(C)C)cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L16	compound treatment	1.119	-0.00276	-0.04	1.126	-0.0158	-0.22	-0.1786	-0.8171	1916155	CBDivE_005676	O=C(COC(=O)c1cccc(c1)N2C(=O)c3ccccc3C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L17	compound treatment	1.087	-0.0348	-0.47	1.178	0.0362	0.49	0.0176	0.0258	1507315	CBDivE_005677	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc4C(=O)N(C(=O)c4c3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L18	compound treatment	1.118	-0.00376	-0.05	1.151	0.00921	0.13	0.0529	0.391	1916156	CBDivE_005678	O=C(Nc1ccc(/C=C/C(=O)c2ccccc2)cc1)\C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L19	compound treatment	1.149	0.0272	0.37	1.172	0.0302	0.41	0.5511	0.9984	1916157	CBDivE_005679	O=C1N(C(=O)c2cc(ccc12)c3nc4ccccc4c(=O)o3)c5cccc(c5)c6nc7ccccc7c(=O)o6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	L20	compound treatment	1.081	-0.0408	-0.55	1.118	-0.0238	-0.32	-0.6182	-0.9683	1916158	CBDivE_005680	CN(CC(O)COc1cc(C)cc(C)c1C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M01	compound treatment	1.134	0.0122	0.17	1.11	-0.0318	-0.43	-0.1898	-0.409	1916159	CBDivE_005681	C(N1CCOCCOCCOCCOCCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M02	compound treatment	1.145	0.0232	0.31	1.14	-0.00179	-0.02	0.2044	0.65	1914541	CBDivE_005682	CCC(=O)CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M03	compound treatment	1.062	-0.0598	-0.81	1.154	0.0122	0.17	-0.4523	-0.5495	1916160	CBDivE_005683	CCOc1ccc(cc1)N2C(=O)C3C(C2=O)C4(Br)c5ccccc5C3c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M04	compound treatment	1.152	0.0302	0.41	1.151	0.00921	0.13	0.3773	0.8838	1914233	CBDivE_005684	Oc1c(Br)cc(cc1Br)S(=O)(=O)c2cc(Br)c(OCC=C)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M05	compound treatment	1.121	-7.56E-4	-0.01	1.152	0.0102	0.14	0.0912	0.6535	1916161	CBDivE_005685	Oc1ccc(/C=N/OC(=O)c2ccccc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M06	compound treatment	1.135	0.0132	0.18	1.158	0.0162	0.22	0.2826	0.9944	1916162	CBDivE_005686	Clc1ccc(cc1)S(=O)(=O)N=C2C=CC(=NS(=O)(=O)c3ccc(Cl)cc3)C=C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M07	compound treatment	1.13	0.00824	0.11	1.149	0.00721	0.1	0.1481	0.9981	1600927	CBDivE_005687	OC(=O)C1CCCN1C(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M08	compound treatment	1.121	-7.56E-4	-0.01	1.153	0.0112	0.15	0.1008	0.6584	1554527	CBDivE_005688	OC(=O)CSc1ccc(Oc2ccc(SCC(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M09	compound treatment	1.258	0.136	1.84	1.145	0.00321	0.04	1.3306	0.7237	1916163	CBDivE_005689	Cc1ccccc1NC(=O)CC(NC(=O)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M10	compound treatment	1.134	0.0122	0.17	1.137	-0.00479	-0.07	0.0706	0.3973	1428488	CBDivE_005690	OC(=O)c1ccc(Sc2ccc(cc2)S(=O)(=O)c3ccc(C(=O)O)c(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M11	compound treatment	1.123	0.00124	0.02	1.166	0.0242	0.33	0.2453	0.7421	1916164	CBDivE_005691	Oc1cc(/N=C/C=C/c2ccc(cc2)[N+](=O)[O-])ccc1c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M12	compound treatment	1.088	-0.0338	-0.46	1.139	-0.00279	-0.04	-0.349	-0.7636	1916165	CBDivE_005692	OC(=O)CCS(=O)(=O)c1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M13	compound treatment	1.079	-0.0428	-0.58	1.113	-0.0288	-0.39	-0.6855	-0.9824	1916166	CBDivE_005693	FC(F)(F)C(F)(F)C(=O)N(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M14	compound treatment	1.087	-0.0348	-0.47	1.153	0.0112	0.15	-0.2235	-0.4532	1870170	CBDivE_005694	OC(=O)c1cccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M15	compound treatment	1.133	0.0112	0.15	1.141	-7.94E-4	-0.01	0.0996	0.655	1916167	CBDivE_005695	Brc1c(OCC(=O)N/N=C/c2ccc3OCOc3c2)ccc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M16	compound treatment	1.104	-0.0178	-0.24	1.146	0.00421	0.06	-0.1288	-0.523	1916168	CBDivE_005696	O=C(/C=C\c1ccccc1)c2ccc(cc2)C(=O)/C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M17	compound treatment	1.126	0.00424	0.06	1.157	0.0152	0.21	0.1871	0.8698	1916169	CBDivE_005697	FC(F)(F)COP(=O)(OCC(F)(F)F)OC(c1ccccc1)C(Cl)(Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M18	compound treatment	1.115	-0.00676	-0.09	1.169	0.0272	0.37	0.1979	0.518	1916170	CBDivE_005698	Fc1ccccc1/C=N/Nc2nc(NCc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M19	compound treatment	1.112	-0.00976	-0.13	1.21	0.0682	0.93	0.5646	0.6011	1370219	CBDivE_005699	Cc1ccccc1OCC(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	M20	compound treatment	1.101	-0.0208	-0.28	1.134	-0.00779	-0.11	-0.2732	-0.912	1916171	CBDivE_005700	COc1nc(N/N=C/c2c[nH]c3ccccc23)nc(n1)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N01	compound treatment	1.069	-0.0528	-0.71	1.17	0.0282	0.38	-0.2313	-0.2859	1364308	CBDivE_005701	CN(C)Cc1cc(CN(C)C)c(O)c(n1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N02	compound treatment	1.158	0.0362	0.49	1.14	-0.00179	-0.02	0.3284	0.6709	1916172	CBDivE_005702	NC(=O)COc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N03	compound treatment	1.051	-0.0708	-0.95	1.082	-0.0598	-0.82	-1.2515	-0.9969	1916173	CBDivE_005703	CC1CN(CCN1)c2ccc(Cl)cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N04	compound treatment	1.162	0.0402	0.54	1.125	-0.0168	-0.23	0.222	0.3767	1916174	CBDivE_005704	OC(=O)/C=C/c1cccc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N05	compound treatment	1.159	0.0372	0.5	1.134	-0.00779	-0.11	0.2801	0.5455	1916175	CBDivE_005705	Oc1ccc2ccccc2c1/C=C/c3cc([nH]c(=O)n3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N06	compound treatment	1.093	-0.0288	-0.39	1.141	-7.94E-4	-0.01	-0.282	-0.7266	1294551	CBDivE_005706	Oc1ccccc1NC(=O)c2ccc(cc2)C(=O)Nc3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N07	compound treatment	1.058	-0.0638	-0.86	1.086	-0.0558	-0.76	-1.1462	-0.9981	1916176	CBDivE_005707	Fc1ccc(cc1)N2CCN(CC2)C3CC(=O)N(C3=O)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N08	compound treatment	1.035	-0.0868	-1.17	1.119	-0.0228	-0.31	-1.0474	-0.8649	1916177	CBDivE_005708	O=C(/C=C/c1ccc(\C=C\C(=O)c2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N09	compound treatment	1.072	-0.0498	-0.67	1.185	0.0432	0.59	-0.058	-0.065	1645452	CBDivE_005709	Clc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3cccc(Cl)c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N10	compound treatment	1.113	-0.00876	-0.12	1.147	0.00521	0.07	-0.0333	-0.2418	1128900	CBDivE_005710	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccc(NC(=O)C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N11	compound treatment	1.106	-0.0158	-0.21	1.144	0.00221	0.03	-0.129	-0.601	1916178	CBDivE_005711	CCOC(=O)CNC1CC(=O)N(C1=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N12	compound treatment	1.131	0.00924	0.12	1.131	-0.0108	-0.15	-0.0159	-0.0824	1507783	CBDivE_005712	Oc1cccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5cccc(O)c5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N13	compound treatment	1.132	0.0102	0.14	1.157	0.0152	0.21	0.2443	0.9806	1916179	CBDivE_005713	Clc1ccc(cc1)N2C(=O)CC(NCc3ccco3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N14	compound treatment	1.097	-0.0248	-0.33	1.162	0.0202	0.28	-0.0413	-0.0954	1137776	CBDivE_005714	O=C(Nc1ccc(cc1)c2ccnc(n2)c3ccc(NC(=O)c4ccccc4)cc3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N15	compound treatment	1.081	-0.0408	-0.55	1.162	0.0202	0.28	-0.194	-0.3154	1916180	CBDivE_005715	OC(=O)c1cc(NC(=O)C(F)(F)F)cc(NC(=O)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N16	compound treatment	1.089	-0.0328	-0.44	1.163	0.0212	0.29	-0.108	-0.2045	1602059	CBDivE_005716	CC(=O)Nc1ccc(cc1)C(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N17	compound treatment	1.087	-0.0348	-0.47	1.2	0.0582	0.79	0.2297	0.2492	1428978	CBDivE_005717	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(c3)N4C(=O)c5ccc(cc5C4=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N18	compound treatment	1.101	-0.0208	-0.28	1.096	-0.0458	-0.62	-0.6396	-0.9345	1916181	CBDivE_005718	O=C(Nc1cccc(/C=C/C(=O)c2ccccc2)c1)\C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N19	compound treatment	1.109	-0.0128	-0.17	1.158	0.0162	0.22	0.0346	0.1235	1501478	CBDivE_005719	OC(=O)c1cc(cc(c1)N2C(=O)c3ccccc3C2=O)N4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	N20	compound treatment	1.105	-0.0168	-0.23	1.163	0.0212	0.29	0.0446	0.1216	1916182	CBDivE_005720	CCN(CC(O)COc1ccc(OC)cc1)CC(O)CN(C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O01	compound treatment	1.118	-0.00376	-0.05	1.129	-0.0128	-0.17	-0.1592	-0.8763	1916183	CBDivE_005721	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccc(OC)cc4)C1(C)C5C2C(=O)N(C5=O)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O02	compound treatment	1.136	0.0142	0.19	1.11	-0.0318	-0.43	-0.1707	-0.3599	1916184	CBDivE_005722	CCOC(=O)/C(=C\c1ccc(o1)c2cccc(c2)[N+](=O)[O-])/C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O03	compound treatment	1.127	0.00524	0.07	1.193	0.0512	0.7	0.5438	0.7748	1916185	CBDivE_005723	OC(=O)c1ccccc1NC(=O)C(=O)N/N=C\2/C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O04	compound treatment	1.131	0.00924	0.12	1.176	0.0342	0.47	0.418	0.8657	1914076	CBDivE_005724	Oc1c(Br)cc(cc1Br)S(=O)(=O)c2cc(Br)c(O)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O05	compound treatment	1.072	-0.0498	-0.67	1.149	0.00721	0.1	-0.4052	-0.5972	1033950	CBDivE_005725	[O-][n+]1onc(c1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O06	compound treatment	1.144	0.0222	0.3	1.18	0.0382	0.52	0.5806	0.9657	1021455	CBDivE_005726	O=S(=O)(N=C1C=CC(=NS(=O)(=O)c2ccccc2)C=C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O07	compound treatment	1.08	-0.0418	-0.56	1.16	0.0182	0.25	-0.2228	-0.3619	1913945	CBDivE_005727	OS(=O)(=O)CCNC(=O)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O08	compound treatment	1.143	0.0212	0.29	1.118	-0.0238	-0.32	-0.0268	-0.0619	1559371	CBDivE_005728	OC(=O)CS(=O)(=O)c1ccc(cc1)c2ccc(cc2)S(=O)(=O)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O09	compound treatment	1.159	0.0372	0.5	1.138	-0.00379	-0.05	0.3187	0.631	1916186	CBDivE_005729	COc1ccccc1NC(=O)CC(NC(=O)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O10	compound treatment	1.161	0.0392	0.53	1.129	-0.0128	-0.17	0.251	0.4503	1699343	CBDivE_005730	OC(=O)c1ccc(cc1)S(=O)(=O)c2cc(ccc2C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O11	compound treatment	1.117	-0.00476	-0.06	1.153	0.0112	0.15	0.0627	0.3782	1916187	CBDivE_005731	[O-][N+](=O)c1ccc(/C=C/C=N/c2ccc3oc(nc3c2)c4ccc(Cl)c(Cl)c4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O12	compound treatment	1.138	0.0162	0.22	1.152	0.0102	0.14	0.2534	0.976	1916188	CBDivE_005732	O=C(CCS(=O)(=O)c1ccc2ccccc2c1)OCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O13	compound treatment	1.083	-0.0388	-0.52	1.179	0.0372	0.51	-0.011	-0.015	1679407	CBDivE_005733	CCN(CC)CCn1c(NC(=O)c2ccc(Cl)cc2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O14	compound treatment	1.123	0.00124	0.02	1.179	0.0372	0.51	0.3706	0.7301	1708156	CBDivE_005734	COc1ccccc1N2C(=O)c3ccc(cc3C2=O)C(=O)OCC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O15	compound treatment	1.259	0.137	1.85	1.132	-0.00979	-0.13	1.2148	0.6544	1916189	CBDivE_005735	COc1cccc(/C=N/NC(=O)COc2ccc3ccccc3c2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O16	compound treatment	1.112	-0.00976	-0.13	1.154	0.0122	0.17	0.0246	0.1161	1916190	CBDivE_005736	O=C(Cc1nc(nc(n1)N2CCOCC2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O17	compound treatment	1.117	-0.00476	-0.06	1.165	0.0232	0.32	0.1784	0.5525	1916191	CBDivE_005737	OCCN1CCOCCOCCOCCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O18	compound treatment	1.131	0.00924	0.12	1.137	-0.00479	-0.07	0.042	0.298	1916192	CBDivE_005738	CC(C)(C)Nc1nc(NCc2ccccc2)nc(N/N=C/c3ccccc3F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O19	compound treatment	1.126	0.00424	0.06	1.148	0.00621	0.08	0.1003	0.9819	1732874	CBDivE_005739	Cc1ccccc1OCC(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	O20	compound treatment	1.144	0.0222	0.3	1.165	0.0232	0.32	0.436	0.9996	1916193	CBDivE_005740	Cc1cc(O)c2n(CC(=O)N/N=C/c3cccc(c3)[N+](=O)[O-])nc[n+]2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P01	compound treatment	1.113	-0.00876	-0.12	1.15	0.00821	0.11	-0.0044	-0.027	1347120	CBDivE_005741	OC(=O)CCC(=O)Nc1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P02	compound treatment	1.106	-0.0158	-0.21	1.122	-0.0198	-0.27	-0.3412	-0.993	1038040	CBDivE_005742	OC(=O)COc1ccccc1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P03	compound treatment	1.101	-0.0208	-0.28	1.131	-0.0108	-0.15	-0.3021	-0.9549	1916194	CBDivE_005743	CC1CN(CCN1)c2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P04	compound treatment	1.118	-0.00376	-0.05	1.172	0.0302	0.41	0.2554	0.6155	1202658	CBDivE_005744	Cc1cccc(c1)c2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P05	compound treatment	1.123	0.00124	0.02	1.096	-0.0458	-0.62	-0.4297	-0.6879	1660697	CBDivE_005745	O=C(NC1c2ccccc2Oc3ccccc13)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P06	compound treatment	1.108	-0.0138	-0.19	1.122	-0.0198	-0.27	-0.3221	-0.9833	1775466	CBDivE_005746	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3c[nH]c(=O)[nH]c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P07	compound treatment	1.087	-0.0348	-0.47	1.16	0.0182	0.25	-0.156	-0.294	1916195	CBDivE_005747	O=C1CC(N2CCN(Cc3ccccc3)CC2)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P08	compound treatment	1.099	-0.0228	-0.31	1.117	-0.0248	-0.34	-0.4562	-0.9988	1115643	CBDivE_005748	S=C(Cc1ccc(CC(=S)N2CCOCC2)cc1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P09	compound treatment	1.108	-0.0138	-0.19	1.152	0.0102	0.14	-0.0328	-0.1415	1916196	CBDivE_005749	Brc1ccc(cc1)N2C(=O)CC(NCc3ccco3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P10	compound treatment	1.091	-0.0308	-0.41	1.102	-0.0398	-0.54	-0.6771	-0.9912	1159162	CBDivE_005750	O=c1oc(nc2ccc(Cc3ccc4nc(oc(=O)c4c3)c5ccccc5)cc12)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P11	compound treatment	1.034	-0.0878	-1.18	1.122	-0.0198	-0.27	-1.028	-0.8466	1916197	CBDivE_005751	CCN/C(=N\CC)/SC1CC(=O)N(C1=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P12	compound treatment	1.082	-0.0398	-0.54	1.113	-0.0288	-0.39	-0.6569	-0.9882	1916198	CBDivE_005752	O=C1N(C(=O)c2cc(ccc12)c3nc4ccccc4c(=O)o3)c5ccc(cc5)c6nc7ccccc7c(=O)o6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P13	compound treatment	1.057	-0.0648	-0.87	1.132	-0.00979	-0.13	-0.7122	-0.8058	1916199	CBDivE_005753	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P14	compound treatment	1.152	0.0302	0.41	1.093	-0.0488	-0.67	-0.182	-0.2332	1120674	CBDivE_005754	OC(=O)c1cc(cc(c1)C(=O)O)N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P15	compound treatment	1.103	-0.0188	-0.25	1.183	0.0412	0.56	0.2184	0.3544	1729347	CBDivE_005755	OC(=O)c1cc(NC(=O)C(c2ccccc2)c3ccccc3)cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P16	compound treatment	1.065	-0.0568	-0.77	1.108	-0.0338	-0.46	-0.8673	-0.9705	1150413	CBDivE_005756	O=C(c1cccc(c1)S(=O)(=O)N2CCOCC2)c3cccc(c3)S(=O)(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P17	compound treatment	1.067	-0.0548	-0.74	1.148	0.00621	0.08	-0.4625	-0.622	1608386	CBDivE_005757	Oc1ccccc1NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5ccccc5O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P18	compound treatment	1.097	-0.0248	-0.33	1.139	-0.00279	-0.04	-0.2631	-0.7827	1916200	CBDivE_005758	O=C(NN1C(=O)c2ccccc2C1=O)c3ccc4C(=O)N(C(=O)c4c3)c5cccc(c5)C(=O)NN6C(=O)c7ccccc7C6=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P19	compound treatment	1.085	-0.0368	-0.5	1.096	-0.0458	-0.62	-0.7922	-0.9935	1616840	CBDivE_005759	NC(=O)COc1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.18	P20	compound treatment	1.091	-0.0308	-0.41	1.11	-0.0318	-0.43	-0.6	-0.9998	1177612	CBDivE_005760	O=C1CC(=Nc2cc3ccccc3cc2N1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A01	compound treatment	1.142	0.0225	0.3	1.148	0.0162	0.22	0.3705	0.9878	1304114	CBDivE_005761	C1CCc2c(C1)sc3ncnc(n4ccnc4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A02	compound treatment	1.093	-0.0265	-0.36	1.159	0.0272	0.37	0.0091	0.0177	1916201	CBDivE_005762	Oc1ccc2ccccc2c1/C=N\NC(=O)COc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A03	compound treatment	1.126	0.00648	0.09	1.184	0.0522	0.71	0.565	0.7881	1916202	CBDivE_005763	Oc1ccccc1/C=N/NC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A04	compound treatment	1.159	0.0395	0.53	1.151	0.0192	0.26	0.5616	0.9464	1916203	CBDivE_005764	Cc1ccccc1C(=O)N/N=C/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A05	compound treatment	1.056	-0.0635	-0.86	1.16	0.0282	0.38	-0.3342	-0.3559	1916204	CBDivE_005765	Cc1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)Nc2ccccc2/N=C/c3ccc4OCOc4c3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A06	compound treatment	1.174	0.0545	0.74	1.155	0.0232	0.32	0.7432	0.9289	1916205	CBDivE_005766	[O-][N+](=O)c1ccc(NC(=O)Cn2cnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A07	compound treatment	1.136	0.0165	0.22	1.121	-0.0108	-0.15	0.0529	0.1982	1300048	CBDivE_005767	OC(=O)c1ccc(Oc2ccc(Oc3ccc(C(=O)O)c(c3)C(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A08	compound treatment	1.196	0.0765	1.03	1.169	0.0372	0.51	1.0881	0.9465	1916206	CBDivE_005768	CC1(C)C/2CCC1(C)C(=O)\C2=C/NCCN\C=C/3\C4CCC(C)(C3=O)C4(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A09	compound treatment	1.098	-0.0215	-0.29	1.12	-0.0118	-0.16	-0.3192	-0.9615	1916207	CBDivE_005769	CCCCOC(=O)C1CCCC(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A10	compound treatment	1.138	0.0185	0.25	1.138	0.00618	0.08	0.2359	0.8962	1916208	CBDivE_005770	Clc1ccc(/C=N/NC(=O)c2ccn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A11	compound treatment	1.17	0.0505	0.68	1.188	0.0562	0.77	1.0233	0.9983	1916209	CBDivE_005771	[O-][N+](=O)c1ccc2C3c4ccccc4C(c5ccccc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A12	compound treatment	1.156	0.0365	0.49	1.133	0.00118	0.02	0.3594	0.7298	1240106	CBDivE_005772	C(Nc1ncnc2sc3CCCCc3c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A13	compound treatment	1.155	0.0355	0.48	1.16	0.0282	0.38	0.6102	0.9941	1916210	CBDivE_005773	CCCCNC(c1ccccc1)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A14	compound treatment	1.157	0.0375	0.51	1.136	0.00418	0.06	0.3979	0.7818	1916211	CBDivE_005774	CC(=O)N[N+]1=C(N)c2ccccc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A15	compound treatment	1.104	-0.0155	-0.21	1.129	-0.00282	-0.04	-0.1752	-0.8233	1916212	CBDivE_005775	OC(=O)/C=C/C(=O)OCC1CCCO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A16	compound treatment	1.186	0.0665	0.9	1.144	0.0122	0.17	0.7516	0.824	1916213	CBDivE_005776	Cc1ccc(cc1)S(=O)(=O)/N=C(/N=S(=O)(c2ccc(C)cc2)c3ccc(C)cc3)\c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A17	compound treatment	1.138	0.0185	0.25	1.153	0.0212	0.29	0.3805	0.9973	1916214	CBDivE_005777	OCC(O)C(O)C(O)C(=O)O[Ca]OC(=O)C(O)C(O)C(O)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A18	compound treatment	1.158	0.0385	0.52	1.177	0.0452	0.62	0.8027	0.9964	1166725	CBDivE_005778	COc1cc(cc(OC)c1OC)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A19	compound treatment	1.07	-0.0495	-0.67	1.101	-0.0308	-0.42	-0.7695	-0.9751	1916215	CBDivE_005779	Clc1ccc(C(=O)CC(NC(=O)Nc2cccc3ccccc23)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	A20	compound treatment	1.105	-0.0145	-0.2	1.142	0.0102	0.14	-0.0403	-0.168	1305881	CBDivE_005780	COc1ccc(NC(=O)Nc2ccc3COC(=O)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B01	compound treatment	1.132	0.0125	0.17	1.082	-0.0498	-0.68	-0.3613	-0.5162	1916216	CBDivE_005781	CCOc1ccccc1N2C(=O)C3C(C2=O)C4(C(=O)C)c5ccccc5C3c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B02	compound treatment	1.127	0.00748	0.1	1.133	0.00118	0.02	0.0828	0.8095	1916217	CBDivE_005782	ClC(Cl)(Cl)C(NC(=O)C(c1ccccc1)c2ccccc2)NC(=S)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B03	compound treatment	1.131	0.0115	0.15	1.2	0.0682	0.93	0.767	0.8137	1128955	CBDivE_005783	COc1ccc(CCc2ncccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B04	compound treatment	1.182	0.0625	0.84	1.123	-0.00882	-0.12	0.511	0.6001	1916218	CBDivE_005784	CC(C)CC(NCc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B05	compound treatment	1.157	0.0375	0.51	1.102	-0.0298	-0.41	0.07	0.1079	1916219	CBDivE_005785	FC(F)(C(OP(=O)(Oc1ccccc1)Oc2ccccc2)c3ccccc3)C4(F)OC(F)(F)C(F)(F)C4(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B06	compound treatment	1.16	0.0405	0.55	1.111	-0.0208	-0.28	0.1854	0.3012	1226756	CBDivE_005786	CCCCN(C)Cc1c(O)ccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B07	compound treatment	1.094	-0.0255	-0.34	1.13	-0.00182	-0.02	-0.261	-0.7562	1916220	CBDivE_005787	COc1ccc(cc1)C(OCC2OC(C(O[C@@H]3CCCCO3)C2O)n4ccc(=O)[nH]c4=O)(c5ccccc5)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B08	compound treatment	1.164	0.0445	0.6	1.131	-8.21E-4	-0.01	0.4164	0.6938	1916221	CBDivE_005788	NCCNCC1COC2(CCCC2)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B09	compound treatment	1.088	-0.0315	-0.43	1.147	0.0152	0.21	-0.1543	-0.3263	1916222	CBDivE_005789	CC(C)C(=O)NC(NC(=S)Nc1ccc(cc1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B10	compound treatment	1.131	0.0115	0.15	1.109	-0.0228	-0.31	-0.1105	-0.3179	1916223	CBDivE_005790	ClC(Cl)(Cl)C(NC(=O)C(c1ccccc1)c2ccccc2)NC(=S)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B11	compound treatment	1.057	-0.0625	-0.84	1.129	-0.00282	-0.04	-0.6236	-0.7386	1916224	CBDivE_005791	O=C(N/N=C(/N=C/c1cccnc1)\c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B12	compound treatment	1.188	0.0685	0.92	1.16	0.0282	0.38	0.925	0.9244	1916225	CBDivE_005792	OC(=O)CS(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B13	compound treatment	1.154	0.0345	0.47	1.111	-0.0208	-0.28	0.1282	0.2352	1916226	CBDivE_005793	NC(=N)NCCCC(NC(=O)C1=C(C(O)c2ccc(O)cc2O1)c3ccc(F)cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B14	compound treatment	1.065	-0.0545	-0.74	1.103	-0.0288	-0.39	-0.7979	-0.9569	1916227	CBDivE_005794	CC(=O)Nn1nc2C(=NNC(=O)c3ccccc3)c4nn(NC(=O)C)nc4C(=NNC(=O)c5ccccc5)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B15	compound treatment	1.17	0.0505	0.68	1.104	-0.0278	-0.38	0.2133	0.2736	1916228	CBDivE_005795	CSCCC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(=O)c(coc2c1)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B16	compound treatment	1.155	0.0355	0.48	1.099	-0.0328	-0.45	0.022	0.0336	1916229	CBDivE_005796	CNN=C1c2nn(CC(=O)N)nc2C(=NNC)c3nn(CC(=O)N)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B17	compound treatment	1.154	0.0345	0.47	1.106	-0.0258	-0.35	0.08	0.1371	1916230	CBDivE_005797	CC(C)(C)C(=O)NC(=C(Cl)Cl)Sc1nccc(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B18	compound treatment	1.156	0.0365	0.49	1.108	-0.0238	-0.32	0.1183	0.2007	1282936	CBDivE_005798	Cc1cc(=O)oc2cc(OCC(=O)O)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B19	compound treatment	1.194	0.0745	1.0	1.137	0.00518	0.07	0.7605	0.7549	1916231	CBDivE_005799	Clc1ccc(C(=O)N/C(=C\c2cc(nn2c3ccccc3)c4ccccc4)/C(=O)N5CCOCC5)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	B20	compound treatment	1.171	0.0515	0.69	1.099	-0.0328	-0.45	0.1746	0.2114	1916232	CBDivE_005800	Fc1ccccc1C2CC(=NN2c3ccccc3Cl)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C01	compound treatment	1.069	-0.0505	-0.68	1.099	-0.0328	-0.45	-0.7984	-0.9792	1774590	CBDivE_005801	[O-][N+](=O)c1ccccc1C(=O)OC2=C(C(=O)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C02	compound treatment	1.158	0.0385	0.52	1.192	0.0602	0.82	0.9474	0.9756	1916233	CBDivE_005802	Oc1cccc(c1)C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C03	compound treatment	1.124	0.00448	0.06	1.145	0.0132	0.18	0.1699	0.8958	1072643	CBDivE_005803	Nc1ncnc2oc(c(c3ccccc3)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C04	compound treatment	1.167	0.0475	0.64	1.149	0.0172	0.23	0.6186	0.9069	1916234	CBDivE_005804	Brc1ccccc1C(=O)N/N=C/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C05	compound treatment	1.115	-0.00452	-0.06	1.086	-0.0458	-0.62	-0.4849	-0.7724	1916235	CBDivE_005805	CN(C)c1ccc(/C=N/CCNS(=O)(=O)c2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C06	compound treatment	1.175	0.0555	0.75	1.179	0.0472	0.64	0.9842	0.9972	1916236	CBDivE_005806	O=C1N(Cn2nnc3ccccc23)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C07	compound treatment	1.095	-0.0245	-0.33	1.17	0.0382	0.52	0.1343	0.2177	1916237	CBDivE_005807	OC(=O)/C(=N/c1cccc(c1)[N+](=O)[O-])/Cc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C08	compound treatment	1.126	0.00648	0.09	1.212	0.0802	1.09	0.835	0.7612	1916238	CBDivE_005808	OCCCC(=O)N/N=C/c1ccc(o1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C09	compound treatment	1.128	0.00848	0.11	1.153	0.0212	0.29	0.2851	0.9179	1916239	CBDivE_005809	NC(=O)c1c(Nc2ccccc2)cc[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C10	compound treatment	1.142	0.0225	0.3	1.132	1.79E-4	0.0	0.2162	0.7128	1916240	CBDivE_005810	CCOC(=O)c1ccccc1NS(=O)(=O)NC(=O)Nc2nc(C)nc(OC)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C11	compound treatment	1.151	0.0315	0.42	1.076	-0.0558	-0.76	-0.2379	-0.2729	1916241	CBDivE_005811	Brc1cc(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C12	compound treatment	1.166	0.0465	0.63	1.184	0.0522	0.71	0.9466	0.998	1916242	CBDivE_005812	O=C(Cc1ccccc1)N/N=C/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C13	compound treatment	1.073	-0.0465	-0.63	1.106	-0.0258	-0.35	-0.6927	-0.9627	1916243	CBDivE_005813	[O-][N+](=O)c1cccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C14	compound treatment	1.153	0.0335	0.45	1.182	0.0502	0.68	0.8033	0.9797	1916244	CBDivE_005814	COc1ccccc1Nc2[nH]nc(C)c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C15	compound treatment	1.154	0.0345	0.47	1.134	0.00218	0.03	0.35	0.7507	1380406	CBDivE_005815	COC(=O)C(C(N1CCOCC1)c2ccccc2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C16	compound treatment	1.18	0.0605	0.82	1.201	0.0692	0.94	1.244	0.9974	1916245	CBDivE_005816	OC(COc1cccc(Br)c1)CN(CCc2ccccc2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C17	compound treatment	1.101	-0.0185	-0.25	1.139	0.00718	0.1	-0.1074	-0.4003	1916246	CBDivE_005817	CCOC(=O)/C(=N\Nc1cc(OC)ccc1OC)/CCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C18	compound treatment	1.097	-0.0225	-0.3	1.136	0.00418	0.06	-0.1745	-0.5646	1315798	CBDivE_005818	COc1cc(ccc1O)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C19	compound treatment	1.112	-0.00752	-0.1	1.169	0.0372	0.51	0.2868	0.5547	1268054	CBDivE_005819	Brc1ccc(NC(=O)Cn2nc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	C20	compound treatment	1.13	0.0105	0.14	1.107	-0.0248	-0.34	-0.1393	-0.3798	1916247	CBDivE_005820	CCN(CC)CCNc1ccc2nsnc2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D01	compound treatment	1.134	0.0145	0.2	1.136	0.00418	0.06	0.1785	0.8768	1916248	CBDivE_005821	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccc(OCC)cc4)C1(C)C5C2C(=O)N(C5=O)c6ccc(OCC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D02	compound treatment	1.161	0.0415	0.56	1.16	0.0282	0.38	0.6674	0.9832	1916249	CBDivE_005822	COc1ccccc1NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D03	compound treatment	1.099	-0.0205	-0.28	1.135	0.00318	0.04	-0.1651	-0.5892	1113437	CBDivE_005823	[O-][N+](=O)c1ccccc1N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D04	compound treatment	1.093	-0.0265	-0.36	1.126	-0.00582	-0.08	-0.3091	-0.8435	1916250	CBDivE_005824	Cc1ccc(cc1)C(=O)N/C(=C\c2cc(nn2c3ccccc3)c4ccccc4)/C(=O)N5CCOCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D05	compound treatment	1.126	0.00648	0.09	1.137	0.00518	0.07	0.1118	0.9944	1029177	CBDivE_005825	CC(=O)CCN1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D06	compound treatment	1.074	-0.0455	-0.61	1.165	0.0332	0.45	-0.1143	-0.1498	1391003	CBDivE_005826	O=C(NCc1ccccc1)C2CC=CCC2C(=O)OCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D07	compound treatment	1.149	0.0295	0.4	1.094	-0.0378	-0.52	-0.0834	-0.1281	1916251	CBDivE_005827	COc1ccc(cc1)C(OCC2OC(C(O)C2O)n3cnc4c(NC(=O)c5ccccc5)ncnc34)(c6ccccc6)c7ccc(OC)cc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D08	compound treatment	1.168	0.0485	0.65	1.156	0.0242	0.33	0.6956	0.9497	1916252	CBDivE_005828	FC(F)(F)COP(=O)(OCC(F)(F)F)Oc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D09	compound treatment	1.115	-0.00452	-0.06	1.126	-0.00582	-0.08	-0.0992	-0.9915	1916253	CBDivE_005829	FC(F)(F)c1ccc(Cl)c(NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D10	compound treatment	1.153	0.0335	0.45	1.111	-0.0208	-0.28	0.1187	0.2224	1916254	CBDivE_005830	CCOC(=O)C1C(CC(O)(CC1=O)c2cccc(c2)[N+](=O)[O-])C=C(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D11	compound treatment	1.171	0.0515	0.69	1.138	0.00618	0.08	0.5507	0.7871	1916255	CBDivE_005831	COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D12	compound treatment	1.106	-0.0135	-0.18	1.124	-0.00782	-0.11	-0.2043	-0.9674	1916256	CBDivE_005832	CC(C)c1ccc(/C=N/NC(=O)\C=C\c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D13	compound treatment	1.175	0.0555	0.75	1.176	0.0442	0.6	0.9553	0.9942	1916257	CBDivE_005833	O=C(NCSc1ccnc(SCNC(=O)c2ccccc2)n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D14	compound treatment	1.117	-0.00252	-0.03	1.14	0.00818	0.11	0.0549	0.4706	1413752	CBDivE_005834	OC(=O)CCNC(=O)c1ccc(O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D15	compound treatment	1.118	-0.00152	-0.02	1.111	-0.0208	-0.28	-0.2152	-0.7561	1916258	CBDivE_005835	CC(C)(C)OC(=O)NC(Cc1ccc(OC(=O)OC(C)(C)C)cc1)C(=O)Oc2ccc3c(=O)c(coc3c2)c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D16	compound treatment	1.12	4.84E-4	0.01	1.119	-0.0128	-0.17	-0.119	-0.6802	1916259	CBDivE_005836	CC(=NN=C1c2nn(CC(=O)N)nc2C(=NN=C(C)C)c3nn(CC(=O)N)nc13)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D17	compound treatment	1.136	0.0165	0.22	1.141	0.00918	0.13	0.2458	0.963	1916260	CBDivE_005837	ClC(=C(NC(=O)c1ccccc1)Sc2nccc(OC(NC(=O)c3ccccc3)C(Cl)(Cl)Cl)n2)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D18	compound treatment	1.157	0.0375	0.51	1.141	0.00918	0.13	0.4461	0.8563	1916261	CBDivE_005838	Cc1ccc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D19	compound treatment	1.128	0.00848	0.11	1.149	0.0172	0.23	0.2466	0.9457	1269183	CBDivE_005839	Fc1ccc(cc1)C(NC(=O)c2ccc(F)cc2)NC(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	D20	compound treatment	1.121	0.00148	0.02	1.127	-0.00482	-0.07	-0.0323	-0.4704	1916262	CBDivE_005840	COc1ccc(cc1)C2CC(=NN2c3ccccc3Cl)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E01	compound treatment	1.165	0.0455	0.61	1.071	-0.0608	-0.83	-0.1526	-0.1479	1912819	CBDivE_005841	COc1ccc(/C=C/2\C(=NN(C2=O)c3ccc(cc3)[N+](=O)[O-])C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E02	compound treatment	1.156	0.0365	0.49	1.146	0.0142	0.19	0.4848	0.9167	1916263	CBDivE_005842	Oc1cccc(c1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E03	compound treatment	1.128	0.00848	0.11	1.101	-0.0308	-0.42	-0.2163	-0.4965	1916264	CBDivE_005843	CCOC(=O)/C=C(\C)/N1N=C(CC1/C=C/c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E04	compound treatment	1.15	0.0305	0.41	1.086	-0.0458	-0.62	-0.151	-0.2019	1916265	CBDivE_005844	CC(=O)/C=C(\C)/Nc1ccc(cc1)c2cnc(o2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E05	compound treatment	1.133	0.0135	0.18	1.138	0.00618	0.08	0.1882	0.9388	1609103	CBDivE_005845	O=C(NC(c1ccccc1)n2nnc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E06	compound treatment	1.186	0.0665	0.9	1.193	0.0612	0.83	1.2241	0.9993	1680339	CBDivE_005846	O=C(Nc1ccc(NC(=O)C2C3CCCCC23)cc1)C4C5CCCCC45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E07	compound treatment	1.092	-0.0275	-0.37	1.106	-0.0258	-0.35	-0.5115	-0.9997	1916266	CBDivE_005847	COC(=O)OC1=C(C(=O)c2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E08	compound treatment	1.165	0.0455	0.61	1.159	0.0272	0.37	0.696	0.9708	1555064	CBDivE_005848	COc1ccc2[nH]cc(CCNC(=O)C(C)c3ccc(CC(C)C)cc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E09	compound treatment	1.212	0.0925	1.25	1.128	-0.00382	-0.05	0.8454	0.677	1916267	CBDivE_005849	OC(=O)CCNc1cn2CCCc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E10	compound treatment	1.14	0.0205	0.28	1.18	0.0482	0.66	0.66	0.926	1916268	CBDivE_005850	C/C(=N\NC(=O)c1ccc(O)cc1)/c2ccc(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E11	compound treatment	1.063	-0.0565	-0.76	1.15	0.0182	0.25	-0.3638	-0.4538	1916269	CBDivE_005851	O=C(CC(C(CC(=O)c1ccccc1)c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E12	compound treatment	1.124	0.00448	0.06	1.131	-8.21E-4	-0.01	0.0349	0.5666	1916270	CBDivE_005852	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E13	compound treatment	1.057	-0.0625	-0.84	1.143	0.0112	0.15	-0.4886	-0.5701	1916271	CBDivE_005853	[O-][N+](=O)c1ccccc1Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E14	compound treatment	1.114	-0.00552	-0.07	1.13	-0.00182	-0.02	-0.0702	-0.8946	1916272	CBDivE_005854	COc1ccc2nc(N=Nc3ccc(cc3)N(C)C)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E15	compound treatment	1.129	0.00948	0.13	1.133	0.00118	0.02	0.1018	0.7897	1916273	CBDivE_005855	NC(=O)c1ccccc1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E16	compound treatment	1.08	-0.0395	-0.53	1.083	-0.0488	-0.67	-0.8477	-0.9939	1916274	CBDivE_005856	CC(O)CN(CCc1ccccc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E17	compound treatment	1.079	-0.0405	-0.55	1.158	0.0262	0.36	-0.1341	-0.2054	1916275	CBDivE_005857	COc1ccc(cc1NC2=CC(=O)c3ccccc3C2=O)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E18	compound treatment	1.092	-0.0275	-0.37	1.112	-0.0198	-0.27	-0.4536	-0.9879	1916276	CBDivE_005858	Cc1cc(O)c(C2=NCCSC(C2)c3ccc(O)c(c3)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E19	compound treatment	1.073	-0.0465	-0.63	1.141	0.00918	0.13	-0.3552	-0.5551	1916277	CBDivE_005859	C1CCc2c(C1)sc3ncn4nnnc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	E20	compound treatment	1.111	-0.00852	-0.11	1.181	0.0492	0.67	0.393	0.5776	1916278	CBDivE_005860	[O-][N+](=O)c1ccc(cc1)c2cc(/C=C/c3ccccc3)n[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F01	compound treatment	1.067	-0.0525	-0.71	1.153	0.0212	0.29	-0.2968	-0.3879	1916279	CBDivE_005861	CCOC(=O)C1=C(C)C2C3C(C(=O)N(Cc4ccccc4)C3=O)C1(C)C5C2C(=O)N(Cc6ccccc6)C5=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F02	compound treatment	1.098	-0.0215	-0.29	1.123	-0.00882	-0.12	-0.2903	-0.9239	1916280	CBDivE_005862	COc1ccc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F03	compound treatment	1.108	-0.0115	-0.16	1.125	-0.00682	-0.09	-0.1756	-0.9699	1916281	CBDivE_005863	CCCOc1ccccc1N2C(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F04	compound treatment	1.075	-0.0445	-0.6	1.117	-0.0148	-0.2	-0.5676	-0.8957	1916282	CBDivE_005864	OC(=O)C(Cc1ccccc1)NCc2c(O)ccc3c(=O)c(coc23)c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F05	compound treatment	1.187	0.0675	0.91	1.162	0.0302	0.41	0.9348	0.9356	1916283	CBDivE_005865	OC(=O)CCCCCNSc1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F06	compound treatment	1.124	0.00448	0.06	1.109	-0.0228	-0.31	-0.1773	-0.5592	1916284	CBDivE_005866	CC1OC(Nc2cccc(O)c2)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F07	compound treatment	1.137	0.0175	0.24	1.148	0.0162	0.22	0.3228	0.9994	1916285	CBDivE_005867	Cc1c(NC(=N)NC(=N)Nc2ccccc2)c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F08	compound treatment	1.169	0.0495	0.67	1.147	0.0152	0.21	0.6184	0.8848	1916286	CBDivE_005868	ClC(=C(Cl)COC(=O)C1CC=CCC1C(=O)Nc2nc3ccccc3s2)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F09	compound treatment	1.127	0.00748	0.1	1.131	-8.21E-4	-0.01	0.0635	0.6248	1916287	CBDivE_005869	Cl/C(=C(\NC(=O)c1ccccc1)/C(=O)Nc2nccs2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F10	compound treatment	1.119	-5.16E-4	-0.01	1.121	-0.0108	-0.15	-0.1093	-0.7396	1916288	CBDivE_005870	CC(=O)NC(NC(=S)Nc1ccc(N=Nc2ccccc2)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F11	compound treatment	1.146	0.0265	0.36	1.199	0.0672	0.92	0.9004	0.9157	1070108	CBDivE_005871	CC1=NN(C(=O)C1C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F12	compound treatment	1.148	0.0285	0.38	1.214	0.0822	1.12	1.0641	0.8982	1916289	CBDivE_005872	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc3nc(C)cc(C)n3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F13	compound treatment	1.148	0.0285	0.38	1.173	0.0412	0.56	0.6688	0.9829	1916290	CBDivE_005873	NC(Cc1ccccc1)C(=O)Oc2ccc3c(=O)c(Oc4ccccc4)c(oc3c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F14	compound treatment	1.148	0.0285	0.38	1.093	-0.0388	-0.53	-0.1026	-0.1569	1916291	CBDivE_005874	CC(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F15	compound treatment	1.121	0.00148	0.02	1.158	0.0262	0.36	0.2666	0.7456	1916292	CBDivE_005875	CC(C)CC(NC(=O)OCc1ccccc1)C(=O)OC2C(OC3OC(C)(C)OC23)C4COC(C)(C)O4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F16	compound treatment	1.124	0.00448	0.06	1.138	0.00618	0.08	0.1024	0.9868	1916293	CBDivE_005876	NC(=O)Cn1nc2C(=Nn3cnnc3)c4nn(CC(=O)N)nc4C(=Nn5cnnc5)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F17	compound treatment	1.137	0.0175	0.24	1.164	0.0322	0.44	0.4771	0.9576	1916294	CBDivE_005877	O=C(NC(Sc1ncccn1)C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F18	compound treatment	1.137	0.0175	0.24	1.145	0.0132	0.18	0.2939	0.991	1916295	CBDivE_005878	Cc1ccccc1NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F19	compound treatment	1.254	0.134	1.81	1.172	0.0402	0.55	1.6703	0.8813	1916296	CBDivE_005879	COc1ccc(cc1OC)C(=O)NC(NC(=S)Nc2ccc(cc2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	F20	compound treatment	1.137	0.0175	0.24	1.096	-0.0358	-0.49	-0.1786	-0.3293	1916297	CBDivE_005880	OC(=O)c1ccccc1C(=O)Nc2ccc3nn(nc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G01	compound treatment	1.111	-0.00852	-0.11	1.08	-0.0518	-0.71	-0.5809	-0.8114	1916298	CBDivE_005881	CCCCCCOC(=O)c1ccc(NC(=O)/C=C\C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G02	compound treatment	1.1	-0.0195	-0.26	1.123	-0.00882	-0.12	-0.2712	-0.937	1916299	CBDivE_005882	CC(=O)Nc1ccc(/N=C/c2cc(C)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G03	compound treatment	1.163	0.0435	0.59	1.106	-0.0258	-0.35	0.1658	0.2424	1916300	CBDivE_005883	Cc1n[nH]c(NCc2ccccc2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G04	compound treatment	1.112	-0.00752	-0.1	1.159	0.0272	0.37	0.1904	0.4955	1916301	CBDivE_005884	Oc1ccccc1/C(=N\NC(=O)c2ccccc2)/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G05	compound treatment	1.099	-0.0205	-0.28	1.093	-0.0388	-0.53	-0.57	-0.9542	1916302	CBDivE_005885	[O-][N+](=O)c1ccc2N(CN3CCC(Cc4ccccc4)CC3)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G06	compound treatment	1.127	0.00748	0.1	1.125	-0.00682	-0.09	0.0056	0.041	1916303	CBDivE_005886	Cc1ccc(O)c(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G07	compound treatment	1.088	-0.0315	-0.43	1.169	0.0372	0.51	0.0579	0.0874	1916304	CBDivE_005887	Oc1ccccc1/C=N/c2ccc(cc2)C(=O)Nc3ccc(cc3)c4nc5ccc(NC(=O)c6ccc(\N=C\c7ccccc7O)cc6)cc5[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G08	compound treatment	1.115	-0.00452	-0.06	1.173	0.0412	0.56	0.354	0.6267	1916305	CBDivE_005888	[O-][N+](=O)c1ccc(cc1)C(=O)OCc2cccc(COC(=O)c3ccc(cc3)[N+](=O)[O-])n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G09	compound treatment	1.124	0.00448	0.06	1.125	-0.00682	-0.09	-0.023	-0.2072	1174849	CBDivE_005889	CC1CC2(CC(C)c3ccccc3N2)C(C)CN1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G10	compound treatment	1.067	-0.0525	-0.71	1.115	-0.0168	-0.23	-0.6632	-0.8905	1916306	CBDivE_005890	[O-][N+](=O)c1ccc2C(=O)N(NC(=O)C3CC3(c4ccccc4)c5ccccc5)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G11	compound treatment	1.144	0.0245	0.33	1.147	0.0152	0.21	0.3799	0.9747	1916307	CBDivE_005891	Clc1ccc(NC(=O)CC2(C(=O)c3ccccc3C2=O)c4ccccc4)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G12	compound treatment	1.079	-0.0405	-0.55	1.12	-0.0118	-0.16	-0.5005	-0.8783	1916308	CBDivE_005892	O=C(N/N=C/c1ccc(cc1)c2ccccc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G13	compound treatment	1.098	-0.0215	-0.29	1.137	0.00518	0.07	-0.1553	-0.5199	1916309	CBDivE_005893	COc1ccccc1Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G14	compound treatment	1.133	0.0135	0.18	1.15	0.0182	0.25	0.3039	0.9884	1775602	CBDivE_005894	[O-][N+](=O)c1ccc(Cn2nc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G15	compound treatment	1.15	0.0305	0.41	1.144	0.0122	0.17	0.4082	0.9204	1916310	CBDivE_005895	COc1ccc(/C=C\2/C(=NN(C2=O)c3ccc(Cl)cc3)C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G16	compound treatment	1.153	0.0335	0.45	1.108	-0.0238	-0.32	0.0897	0.1613	1916311	CBDivE_005896	CCC(C)C(NC(=O)COc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G17	compound treatment	1.133	0.0135	0.18	1.161	0.0292	0.4	0.41	0.9371	1724516	CBDivE_005897	CC(=O)n1cc(C(SCc2ccccc2)C(NO)C(=O)OCc3ccccc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G18	compound treatment	1.119	-5.16E-4	-0.01	1.169	0.0372	0.51	0.3536	0.6973	1597672	CBDivE_005898	Cc1cc(O)c(C2=NCCSC(C2)c3cccc(O)c3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G19	compound treatment	1.131	0.0115	0.15	1.066	-0.0658	-0.9	-0.5251	-0.5765	1916312	CBDivE_005899	[O-][N+](=O)c1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	G20	compound treatment	1.211	0.0915	1.23	1.18	0.0482	0.66	1.3373	0.9564	1336007	CBDivE_005900	CCOc1ccccc1C2C(=C(C)NC3=C2C(=O)CC(C)(C)C3)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H01	compound treatment	1.13	0.0105	0.14	1.101	-0.0308	-0.42	-0.1972	-0.4446	1654360	CBDivE_005901	O=C(Nc1ccc(Oc2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H02	compound treatment	1.073	-0.0465	-0.63	1.135	0.00318	0.04	-0.4131	-0.6567	1916313	CBDivE_005902	[O-][N+](=O)c1ccccc1NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H03	compound treatment	1.133	0.0135	0.18	1.079	-0.0528	-0.72	-0.3807	-0.5124	1080217	CBDivE_005903	CCOc1ccccc1N2C(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H04	compound treatment	1.12	4.84E-4	0.01	1.137	0.00518	0.07	0.0546	0.7693	1916314	CBDivE_005904	CO/C(=N\C(NC(=S)N(C)c1ccccc1)C(Cl)(Cl)Cl)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H05	compound treatment	1.172	0.0525	0.71	1.113	-0.0188	-0.26	0.3192	0.4238	1646638	CBDivE_005905	COC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H06	compound treatment	1.116	-0.00352	-0.05	1.137	0.00518	0.07	0.0164	0.1928	1916315	CBDivE_005906	COc1ccc(OCC(O)CNCC(O)CNS(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H07	compound treatment	1.14	0.0205	0.28	1.094	-0.0378	-0.52	-0.1693	-0.2893	1916316	CBDivE_005907	OC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H08	compound treatment	1.13	0.0105	0.14	1.07	-0.0618	-0.84	-0.4961	-0.5804	1331151	CBDivE_005908	COc1ccc(NC(=O)C2CC=CCC2C(=O)OCC3CCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H09	compound treatment	1.13	0.0105	0.14	1.14	0.00818	0.11	0.1789	0.9931	1916317	CBDivE_005909	CCC(=O)NC(NC(=S)Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H10	compound treatment	1.139	0.0195	0.26	1.142	0.0102	0.14	0.284	0.9555	1916318	CBDivE_005910	FC(F)(F)c1ccc(Cl)c(NC(=S)NC(NC(=O)Cc2ccccc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H11	compound treatment	1.147	0.0275	0.37	1.152	0.0202	0.28	0.4568	0.9892	1916319	CBDivE_005911	NS(=O)(=O)c1ccc(NC(=O)/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H12	compound treatment	1.105	-0.0145	-0.2	1.145	0.0132	0.18	-0.0114	-0.0429	1916320	CBDivE_005912	[O-][N+](=O)c1ccc(/C=N/Nc2nc3nonc3nc2N\N=C\c4ccc(o4)[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H13	compound treatment	1.115	-0.00452	-0.06	1.105	-0.0268	-0.37	-0.3017	-0.8137	1916321	CBDivE_005913	CN(C)c1ccc(cc1)C2=NC(N=C(N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H14	compound treatment	1.129	0.00948	0.13	1.115	-0.0168	-0.23	-0.0717	-0.2731	1916322	CBDivE_005914	ON=c1[nH]c2cc3nn[nH]c3cc2[nH]c1=NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H15	compound treatment	1.115	-0.00452	-0.06	1.152	0.0202	0.28	0.1515	0.5375	1916323	CBDivE_005915	COc1ccc(NC(=S)NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H16	compound treatment	1.135	0.0155	0.21	1.144	0.0122	0.17	0.2651	0.9935	1916324	CBDivE_005916	O=C(NN=C1c2nn(Cc3ccccc3)nc2C(=NNC(=O)c4ccccc4)c5nn(Cc6ccccc6)nc15)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H17	compound treatment	1.124	0.00448	0.06	1.093	-0.0388	-0.53	-0.3316	-0.6222	1916325	CBDivE_005917	ClC(=C(NC(=O)c1ccccc1)Sc2nccc(SC(NC(=O)c3ccccc3)C(Cl)(Cl)Cl)n2)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H18	compound treatment	1.125	0.00548	0.07	1.137	0.00518	0.07	0.1023	0.9997	1916326	CBDivE_005918	Cc1cccc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H19	compound treatment	1.095	-0.0245	-0.33	1.09	-0.0418	-0.57	-0.6371	-0.9664	1916327	CBDivE_005919	COc1ccc(cc1OC)C(=O)NC(NC(=S)Nc2ccc(NC(=O)C)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	H20	compound treatment	1.106	-0.0135	-0.18	1.159	0.0272	0.37	0.1331	0.3223	1916328	CBDivE_005920	Cc1cc(C)n(CCCCCC(=O)O)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I01	compound treatment	1.075	-0.0445	-0.6	1.14	0.00818	0.11	-0.3458	-0.5661	1916329	CBDivE_005921	CC(=O)Nc1ccc(NC(=O)/C=C\C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I02	compound treatment	1.127	0.00748	0.1	1.087	-0.0448	-0.61	-0.3608	-0.5824	1916330	CBDivE_005922	CC(=O)c1cc2ccc(O)cc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I03	compound treatment	1.128	0.00848	0.11	1.084	-0.0478	-0.65	-0.3802	-0.5742	1409394	CBDivE_005923	CC(C)(C)c1cc(CO)c(O)c(CO)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I04	compound treatment	1.186	0.0665	0.9	1.14	0.00818	0.11	0.7131	0.789	1916331	CBDivE_005924	O=C(N/N=C/c1ccc(cc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I05	compound treatment	1.074	-0.0455	-0.61	1.153	0.0212	0.29	-0.23	-0.3389	1916332	CBDivE_005925	O=C1N(CN2CCN(Cc3ccccc3)CC2)c4ccccc4C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I06	compound treatment	1.126	0.00648	0.09	1.11	-0.0218	-0.3	-0.1486	-0.479	1916333	CBDivE_005926	CCN(CC)CCOC(=O)NS(=O)(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I07	compound treatment	1.195	0.0755	1.02	1.11	-0.0218	-0.3	0.5097	0.4804	1328487	CBDivE_005927	Nc1cccc(Oc2ccc(cc2)S(=O)(=O)c3ccc(Oc4cccc(N)c4)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I08	compound treatment	1.053	-0.0665	-0.9	1.198	0.0662	0.9	0.0036	0.0028	1916334	CBDivE_005928	O=C(NCCCCCCNC(=O)c1ccco1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I09	compound treatment	1.193	0.0735	0.99	1.206	0.0742	1.01	1.4163	0.9999	1361563	CBDivE_005929	COc1ccc(OC)c(c1)C(=O)c2coc3ccc(OCC(=O)O)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I10	compound treatment	1.081	-0.0385	-0.52	1.168	0.0362	0.49	-0.0186	-0.0259	1916335	CBDivE_005930	OC(=O)/C=C\C(=O)NNC(=O)C1CC1(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I11	compound treatment	1.099	-0.0205	-0.28	1.128	-0.00382	-0.05	-0.2326	-0.8257	1916336	CBDivE_005931	CCCCCCCSC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I12	compound treatment	1.103	-0.0165	-0.22	1.124	-0.00782	-0.11	-0.233	-0.9431	1916337	CBDivE_005932	O=C(N/N=C\c1ccc(cc1)c2ccccc2)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I13	compound treatment	1.131	0.0115	0.15	1.142	0.0102	0.14	0.2077	0.9985	1916338	CBDivE_005933	CC(=O)c1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I14	compound treatment	1.109	-0.0105	-0.14	1.129	-0.00282	-0.04	-0.1275	-0.8675	1916339	CBDivE_005934	C/C(=N\O)/c1cc([N+](=O)[O-])c2ccccc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I15	compound treatment	1.023	-0.0965	-1.3	1.052	-0.0798	-1.09	-1.6904	-0.996	1916340	CBDivE_005935	CC(=O)N1[C@@H](CS[C@@H]1c2ccc(Br)cc2)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I16	compound treatment	1.107	-0.0125	-0.17	1.161	0.0292	0.4	0.162	0.3747	1916341	CBDivE_005936	CC1(C)OCC(O1)C2OC3OC(C)(C)OC3C2OC(=O)CCCNC(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I17	compound treatment	1.107	-0.0125	-0.17	1.141	0.00918	0.13	-0.0309	-0.147	1916342	CBDivE_005937	CC(=O)n1cc(C(SCc2ccccc2)C(C(=O)OCc3ccccc3)[N+](=O)[O-])c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I18	compound treatment	1.098	-0.0215	-0.29	1.132	1.79E-4	0.0	-0.2035	-0.7011	1643437	CBDivE_005938	Cc1cc(O)c(C2=NCCSC(C2)c3cc(Cl)cc(Cl)c3O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I19	compound treatment	1.126	0.00648	0.09	1.117	-0.0148	-0.2	-0.0811	-0.3681	1916343	CBDivE_005939	Clc1ccccc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	I20	compound treatment	1.135	0.0155	0.21	1.155	0.0232	0.32	0.3712	0.9798	1916344	CBDivE_005940	O=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccc(OP(=O)(Oc4ccccc4)Oc5ccccc5)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J01	compound treatment	1.122	0.00248	0.03	1.157	0.0252	0.34	0.2665	0.7725	1397218	CBDivE_005941	Cc1ccc(cc1)S(=O)(=O)Nc2ncccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J02	compound treatment	1.145	0.0255	0.34	1.189	0.0572	0.78	0.7944	0.9323	1916345	CBDivE_005942	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J03	compound treatment	0.911	-0.209	-2.81	0.883	-0.249	-3.39	-4.3883	-0.9957	1916346	CBDivE_005943	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccc(cc4)C(=O)O)C1(C)C5C2C(=O)N(C5=O)c6ccc(cc6)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J04	compound treatment	1.121	0.00148	0.02	1.123	-0.00882	-0.12	-0.0709	-0.5814	1916347	CBDivE_005944	O=C(NCc1ccccc1)/C(=C/c2cc(nn2c3ccccc3)c4ccccc4)/NC(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J05	compound treatment	1.133	0.0135	0.18	1.13	-0.00182	-0.02	0.1111	0.605	1916348	CBDivE_005945	FC(F)(F)C(=O)NC(OC(NC(=O)C(F)(F)F)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J06	compound treatment	1.154	0.0345	0.47	1.105	-0.0268	-0.37	0.0703	0.1189	1916349	CBDivE_005946	CNCC(O)CN(C)CC(O)COc1ccc(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J07	compound treatment	1.139	0.0195	0.26	1.19	0.0582	0.79	0.7469	0.8936	1916350	CBDivE_005947	CCN(CC)CCSc1nnc(Nc2ccccc2)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J08	compound treatment	1.116	-0.00352	-0.05	1.179	0.0472	0.64	0.4214	0.6532	1916351	CBDivE_005948	[O-][N+](=O)c1ccc(cc1)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J09	compound treatment	1.144	0.0245	0.33	1.09	-0.0418	-0.57	-0.1697	-0.2575	1916352	CBDivE_005949	CCCCCC(=O)NC(NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J10	compound treatment	1.164	0.0445	0.6	1.176	0.0442	0.6	0.8503	1.0	1916353	CBDivE_005950	CCCCCCC(=O)NC(NC(=S)Nc1ccc(cc1)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J11	compound treatment	1.121	0.00148	0.02	1.122	-0.00982	-0.13	-0.0805	-0.5948	1916354	CBDivE_005951	NS(=O)(=O)c1ccc(cc1)N2C(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J12	compound treatment	1.087	-0.0325	-0.44	1.085	-0.0468	-0.64	-0.7616	-0.9832	1916355	CBDivE_005952	FC(F)(F)C(=O)Nc1cc(OC(=O)C(F)(F)F)c2nonc2c1OC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J13	compound treatment	1.114	-0.00552	-0.07	1.13	-0.00182	-0.02	-0.0702	-0.8946	1916356	CBDivE_005953	Brc1ccc(cc1)C(=O)N/C(=C\c2cc(nn2c3ccccc3)c4ccccc4)/C(=O)NCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J14	compound treatment	1.117	-0.00252	-0.03	1.117	-0.0148	-0.2	-0.1669	-0.8144	1916357	CBDivE_005954	Oc1ccc(C2Nc3cc(Cl)c(Cl)cc3N2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J15	compound treatment	1.129	0.00948	0.13	1.176	0.0442	0.6	0.5165	0.8386	1916358	CBDivE_005955	CC(C)(C)OC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCC3OC(O)C(O)C(O)C3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J16	compound treatment	1.057	-0.0625	-0.84	1.157	0.0252	0.34	-0.3536	-0.3883	1916359	CBDivE_005956	Oc1ccc(cc1)C(=O)CSc2nnnn2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J17	compound treatment	1.127	0.00748	0.1	1.178	0.0462	0.63	0.5167	0.8101	1916360	CBDivE_005957	CNC(=S)NC(/N=C(\OC)/c1ccc(C)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J18	compound treatment	1.131	0.0115	0.15	1.137	0.00518	0.07	0.1595	0.9367	1916361	CBDivE_005958	O/N=C/1\CCc2nonc2\C1=N/n3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J19	compound treatment	1.133	0.0135	0.18	1.106	-0.0258	-0.35	-0.1203	-0.3037	1916362	CBDivE_005959	COc1ccc(cc1OC)C(=O)NC(NC(=S)Nc2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	J20	compound treatment	1.078	-0.0415	-0.56	1.144	0.0122	0.17	-0.2786	-0.4769	1916363	CBDivE_005960	Nc1cc(N)n(c2ccc(CC(=O)O)cc2)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K01	compound treatment	1.14	0.0205	0.28	1.16	0.0282	0.38	0.4671	0.9869	1916364	CBDivE_005961	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K02	compound treatment	1.181	0.0615	0.83	1.107	-0.0248	-0.34	0.3472	0.3875	1916365	CBDivE_005962	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K03	compound treatment	1.09	-0.0295	-0.4	1.109	-0.0228	-0.31	-0.5016	-0.9926	1916366	CBDivE_005963	OP(=O)(Oc1ccc(Br)cc1)Oc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K04	compound treatment	1.138	0.0185	0.25	1.14	0.00818	0.11	0.2552	0.9342	1916367	CBDivE_005964	Brc1ccc(NC(=O)Cn2ccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K05	compound treatment	1.103	-0.0165	-0.22	1.115	-0.0168	-0.23	-0.3197	-0.9999	1916368	CBDivE_005965	COc1cc2c(C)nc3n(Cc4ccccc4)nc(C)c3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K06	compound treatment	1.123	0.00348	0.05	1.144	0.0122	0.17	0.1507	0.873	1330123	CBDivE_005966	O=C(Nc1cccc2c(NC(=O)C3CC3c4ccccc4)cccc12)C5CC5c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K07	compound treatment	1.09	-0.0295	-0.4	1.102	-0.0298	-0.41	-0.5691	-0.9999	1916369	CBDivE_005967	Nc1ccc(Cc2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K08	compound treatment	1.135	0.0155	0.21	1.134	0.00218	0.03	0.1687	0.7996	1916370	CBDivE_005968	CC(=O)c1nn[nH]c1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K09	compound treatment	1.084	-0.0355	-0.48	1.138	0.00618	0.08	-0.2792	-0.574	1715942	CBDivE_005969	CN1CCN(CC1)c2ccc(cc2)n3c(C)nc4cc5ccccc5cc4c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K10	compound treatment	1.098	-0.0215	-0.29	1.158	0.0262	0.36	0.0472	0.1025	1916371	CBDivE_005970	FC(F)(F)C(Oc1nc(NCC=C)nc(n1)N(c2ccccc2)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K11	compound treatment	1.123	0.00348	0.05	1.115	-0.0168	-0.23	-0.129	-0.5508	1023526	CBDivE_005971	Oc1ccc(O)c(c1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K12	compound treatment	1.118	-0.00152	-0.02	1.124	-0.00782	-0.11	-0.0899	-0.8276	1916372	CBDivE_005972	[O-][N+](=O)c1ccc2nc3c(cc2c1)n(CCCCl)c4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K13	compound treatment	1.066	-0.0535	-0.72	1.113	-0.0188	-0.26	-0.692	-0.9031	1916373	CBDivE_005973	O=C(Nc1ccc(Cc2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2)cc1)c5ccc(cc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K14	compound treatment	1.144	0.0245	0.33	1.144	0.0122	0.17	0.351	0.9494	1468846	CBDivE_005974	CC(=O)OC1=C(O)C=CC2C1OC(=O)C=C2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K15	compound treatment	1.118	-0.00152	-0.02	1.107	-0.0248	-0.34	-0.2538	-0.7485	1916374	CBDivE_005975	CC(=O)Oc1ccc(cc1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K16	compound treatment	1.151	0.0315	0.42	1.179	0.0472	0.64	0.7553	0.9797	1775153	CBDivE_005976	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4cccc(c4)[N+](=O)[O-])ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K17	compound treatment	1.135	0.0155	0.21	1.115	-0.0168	-0.23	-0.0145	-0.0467	1916375	CBDivE_005977	[O-][N+](=O)C(C(SCc1ccccc1)c2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K18	compound treatment	1.128	0.00848	0.11	1.144	0.0122	0.17	0.1984	0.9835	1916376	CBDivE_005978	CC(=NNc1nc(cs1)c2ccc(cc2)c3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K19	compound treatment	1.09	-0.0295	-0.4	1.152	0.0202	0.28	-0.087	-0.1797	1916377	CBDivE_005979	Brc1ccc(OCC(=O)N/N=C/c2cccc(I)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	K20	compound treatment	1.13	0.0105	0.14	1.139	0.00718	0.1	0.1692	0.9838	1048760	CBDivE_005980	CCN(CC)CCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L01	compound treatment	1.127	0.00748	0.1	1.14	0.00818	0.11	0.1503	0.9988	1005423	CBDivE_005981	O=C1OC(c2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L02	compound treatment	1.131	0.0115	0.15	1.187	0.0552	0.75	0.6416	0.8352	1916378	CBDivE_005982	ClC(Cl)(Cl)C(NC(=O)C(c1ccccc1)c2ccccc2)NC(=S)Nc3nc[nH]n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L03	compound treatment	1.136	0.0165	0.22	1.087	-0.0448	-0.61	-0.2749	-0.4227	1916379	CBDivE_005983	O=C1C=CC(=O)N1c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L04	compound treatment	1.139	0.0195	0.26	1.14	0.00818	0.11	0.2647	0.9271	1916380	CBDivE_005984	COC(F)(C(=O)NCc1ccco1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L05	compound treatment	1.099	-0.0205	-0.28	1.085	-0.0468	-0.64	-0.6472	-0.93	1916381	CBDivE_005985	ClC(Cl)(Cl)C(NC(=O)c1ccccc1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L06	compound treatment	1.117	-0.00252	-0.03	1.109	-0.0228	-0.31	-0.244	-0.7796	1916382	CBDivE_005986	COC1(NC2CCCCC2)N(C3CCCCC3)C(F)(F)C1(C(=O)OCCCl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L07	compound treatment	1.115	-0.00452	-0.06	1.09	-0.0418	-0.57	-0.4463	-0.7782	1521854	CBDivE_005987	NC(=O)COc1ccccc1OCC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L08	compound treatment	1.128	0.00848	0.11	1.072	-0.0598	-0.82	-0.4959	-0.602	1660114	CBDivE_005988	CC(C)NCC(O)COc1cc(C)ccc1C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L09	compound treatment	1.139	0.0195	0.26	1.174	0.0422	0.58	0.5926	0.937	1916383	CBDivE_005989	CCCCCCC(=O)NC(NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L10	compound treatment	1.116	-0.00352	-0.05	1.091	-0.0408	-0.56	-0.4272	-0.7646	1916384	CBDivE_005990	CN(C)CCCNC(=O)/C(=C\c1ccco1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L11	compound treatment	1.101	-0.0185	-0.25	1.152	0.0202	0.28	0.0179	0.0483	1013680	CBDivE_005991	OC(=O)c1ccc(cc1)N2C(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L12	compound treatment	1.065	-0.0545	-0.74	1.102	-0.0298	-0.41	-0.8076	-0.961	1916385	CBDivE_005992	CC(=O)O/N=C/1\CCc2nonc2\C1=N/Nc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L13	compound treatment	1.136	0.0165	0.22	1.137	0.00518	0.07	0.2072	0.888	1916386	CBDivE_005993	Oc1ccc(cc1)C2NC(=NC(=N2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L14	compound treatment	1.117	-0.00252	-0.03	1.122	-0.00982	-0.13	-0.1187	-0.8591	1916387	CBDivE_005994	NC(=O)NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L15	compound treatment	1.095	-0.0245	-0.33	1.152	0.0202	0.28	-0.0393	-0.0913	1396299	CBDivE_005995	OC1OC(COC(=O)C2CCCN2C(=O)OCc3ccccc3)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L16	compound treatment	1.103	-0.0165	-0.22	1.164	0.0322	0.44	0.1527	0.3104	1146211	CBDivE_005996	Cc1ccc(o1)C(C2C(=O)CCCC2=O)C3=C(O)CCCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L17	compound treatment	1.066	-0.0535	-0.72	1.161	0.0292	0.4	-0.2292	-0.278	1916388	CBDivE_005997	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L18	compound treatment	1.087	-0.0325	-0.44	1.169	0.0372	0.51	0.0483	0.0721	1916389	CBDivE_005998	Oc1ccccc1C2ON=C(C2[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L19	compound treatment	1.155	0.0355	0.48	1.183	0.0512	0.7	0.832	0.9831	1916390	CBDivE_005999	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	L20	compound treatment	1.062	-0.0575	-0.78	1.099	-0.0328	-0.45	-0.8651	-0.9658	1916391	CBDivE_006000	OC(=O)Cc1ccc(cc1)n2c(O)cc(O)nc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M01	compound treatment	1.082	-0.0375	-0.51	1.127	-0.00482	-0.07	-0.4044	-0.7923	1916392	CBDivE_006001	OC(=O)c1cc([N+](=O)[O-])c(Nc2cccc3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M02	compound treatment	1.133	0.0135	0.18	1.093	-0.0388	-0.53	-0.2457	-0.4389	1916393	CBDivE_006002	Cc1ccccc1C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M03	compound treatment	1.065	-0.0545	-0.74	1.129	-0.00282	-0.04	-0.5472	-0.7431	1916394	CBDivE_006003	OC(=O)CCC(=O)Nc1ccc(Oc2ccc(NC(=O)CCC(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M04	compound treatment	1.125	0.00548	0.07	1.126	-0.00582	-0.08	-0.0038	-0.0351	1261307	CBDivE_006004	Clc1ccc(cc1)C(=O)COc2c(Cl)cc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M05	compound treatment	1.114	-0.00552	-0.07	1.139	0.00718	0.1	0.0166	0.135	1916395	CBDivE_006005	[O-][N+](=O)c1ccc(N/N=C/2\C(=O)N(CN3CCCCC3)c4ccccc24)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M06	compound treatment	1.132	0.0125	0.17	1.149	0.0172	0.23	0.2847	0.9869	1916396	CBDivE_006006	Ic1cccc(/C=N/Nc2nc(nc(n2)N3CCOCC3)N(c4ccccc4)c5ccccc5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M07	compound treatment	1.112	-0.00752	-0.1	1.14	0.00818	0.11	0.0072	0.0476	1916117	CBDivE_006007	O=C(Oc1ccc(cc1)C2(c3ccccc3-c4ccccc42)c5ccc(OC(=O)c6ccco6)cc5)c7ccco7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M08	compound treatment	1.109	-0.0105	-0.14	1.14	0.00818	0.11	-0.0214	-0.1189	1916397	CBDivE_006008	OC(=O)CSCNC(=O)CC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M09	compound treatment	1.158	0.0385	0.52	1.121	-0.0108	-0.15	0.2628	0.4868	1916398	CBDivE_006009	OC(=O)c1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])c(/N=C/c3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M10	compound treatment	1.09	-0.0295	-0.4	1.104	-0.0278	-0.38	-0.5498	-0.9997	1916399	CBDivE_006010	CC1(C)OC(=O)C(=Cc2cc(C=C3C(=O)OC(C)(C)OC3=O)c(O)o2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M11	compound treatment	1.139	0.0195	0.26	1.141	0.00918	0.13	0.2744	0.9424	1916400	CBDivE_006011	OC(=O)CCC(=O)OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M12	compound treatment	1.079	-0.0405	-0.55	1.129	-0.00282	-0.04	-0.4137	-0.755	1916401	CBDivE_006012	Cc1cc(O)c(C2=Nc3cc(ccc3SC(C2)c4cc(Cl)cc(Cl)c4O)C(F)(F)F)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M13	compound treatment	1.078	-0.0415	-0.56	1.097	-0.0348	-0.47	-0.7318	-0.9966	1916402	CBDivE_006013	COC(=O)C(Br)(C(=O)OC)C(OC)(C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M14	compound treatment	1.061	-0.0585	-0.79	1.136	0.00418	0.06	-0.5179	-0.6544	1401160	CBDivE_006014	Nc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M15	compound treatment	1.109	-0.0105	-0.14	1.12	-0.0118	-0.16	-0.2143	-0.998	1916403	CBDivE_006015	CN(N(C)C(=O)Cc1ccccc1)C(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M16	compound treatment	1.128	0.00848	0.11	1.159	0.0272	0.37	0.343	0.8843	1096123	CBDivE_006016	CCN(CC)c1ccc2cc(c3nc4ccccc4n3C)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M17	compound treatment	1.122	0.00248	0.03	1.111	-0.0208	-0.28	-0.1771	-0.6193	1916404	CBDivE_006017	NC(CC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M18	compound treatment	1.105	-0.0145	-0.2	1.174	0.0422	0.58	0.2682	0.4415	1916405	CBDivE_006018	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccccc4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M19	compound treatment	1.088	-0.0315	-0.43	1.199	0.0672	0.92	0.3471	0.3437	1916406	CBDivE_006019	COc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	M20	compound treatment	1.094	-0.0255	-0.34	1.131	-8.21E-4	-0.01	-0.2513	-0.7297	1916407	CBDivE_006020	CC(=O)C1(C2C(C3c4ccccc41)C(=O)N(Cc5ccccc5)C2=O)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N01	compound treatment	1.063	-0.0565	-0.76	1.119	-0.0128	-0.17	-0.6627	-0.8473	1206601	CBDivE_006021	O=c1[nH]nc(c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N02	compound treatment	1.139	0.0195	0.26	1.13	-0.00182	-0.02	0.1683	0.6375	1916408	CBDivE_006022	COc1ccc(cc1NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N03	compound treatment	1.063	-0.0565	-0.76	1.075	-0.0568	-0.77	-1.087	-1.0	1777163	CBDivE_006023	CCC1=C(C(NC(=O)N1)c2ccc3OCOc3c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N04	compound treatment	1.144	0.0245	0.33	1.096	-0.0358	-0.49	-0.1118	-0.1897	1916409	CBDivE_006024	CNN=C1c2nn(NC(=O)C)nc2C(=NNC)c3nn(NC(=O)C)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N05	compound treatment	1.186	0.0665	0.9	1.14	0.00818	0.11	0.7131	0.789	1647348	CBDivE_006025	OC(=O)COc1ccc(cc1)C2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N06	compound treatment	1.09	-0.0295	-0.4	1.133	0.00118	0.02	-0.2702	-0.678	1916410	CBDivE_006026	CC(=O)c1ccc(NC(=O)C2CC=CCC2C(=O)OCC3CCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N07	compound treatment	1.057	-0.0625	-0.84	1.06	-0.0718	-0.98	-1.2889	-0.9972	1916411	CBDivE_006027	CO/C(=N\C(NC(=S)Nc1ccc(Cl)cc1)C(Cl)(Cl)Cl)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N08	compound treatment	1.054	-0.0655	-0.88	1.051	-0.0808	-1.1	-1.4043	-0.994	1332360	CBDivE_006028	CC(C)c1ccc(C)cc1OCC(O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N09	compound treatment	1.061	-0.0585	-0.79	1.1	-0.0318	-0.43	-0.865	-0.9603	1916412	CBDivE_006029	Oc1ccc(/C=N\NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N10	compound treatment	1.123	0.00348	0.05	1.133	0.00118	0.02	0.0446	0.8979	1916413	CBDivE_006030	NS(=O)(=O)c1ccc(NC(=S)NC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N11	compound treatment	1.089	-0.0305	-0.41	1.107	-0.0248	-0.34	-0.5304	-0.9953	1916414	CBDivE_006031	FC(F)(F)c1cccc(NC(=O)Cn2cnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N12	compound treatment	1.127	0.00748	0.1	1.092	-0.0398	-0.54	-0.3126	-0.5659	1916415	CBDivE_006032	ON=C1c2nn(NC(=O)C(F)(F)F)nc2C(=NO)c3nn(NC(=O)C(F)(F)F)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N13	compound treatment	1.129	0.00948	0.13	1.139	0.00718	0.1	0.1597	0.9913	1916416	CBDivE_006033	CN(N=Nc1c(C)n(C)n(c2ccccc2)c1=O)c3c(C)n(C)n(c4ccccc4)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N14	compound treatment	1.092	-0.0275	-0.37	1.12	-0.0118	-0.16	-0.3765	-0.9302	1557527	CBDivE_006034	NC(=O)NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N15	compound treatment	1.071	-0.0485	-0.65	1.129	-0.00282	-0.04	-0.49	-0.7474	1916417	CBDivE_006035	[O-][N+](=O)c1cccc(c1)C2NC(=NC(=N2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N16	compound treatment	1.082	-0.0375	-0.51	1.142	0.0102	0.14	-0.2597	-0.4949	1916418	CBDivE_006036	CC1(C)C(CCC1(C)C(=O)O)C(=O)NNC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N17	compound treatment	1.074	-0.0455	-0.61	1.159	0.0272	0.37	-0.1721	-0.24	1916419	CBDivE_006037	S=C1NC(N(Cc2ccccc2)C(=S)N1/C(=N/Cc3ccccc3)/c4ccco4)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N18	compound treatment	1.072	-0.0475	-0.64	1.068	-0.0638	-0.87	-1.0687	-0.9887	1916420	CBDivE_006038	O=C(NCCCCCCNC(=O)c1cc2ccccc2oc1=O)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N19	compound treatment	1.123	0.00348	0.05	1.156	0.0242	0.33	0.2664	0.7998	1916421	CBDivE_006039	COC(=O)c1ccccc1NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	N20	compound treatment	1.102	-0.0175	-0.24	1.145	0.0132	0.18	-0.04	-0.1348	1916422	CBDivE_006040	NC(=N)n1nc2ccc3nn(nc3c2n1)C(=N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O01	compound treatment	1.117	-0.00252	-0.03	1.139	0.00718	0.1	0.0452	0.4365	1916423	CBDivE_006041	COc1ccc(/C=N/NC(=O)c2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O02	compound treatment	1.135	0.0155	0.21	1.124	-0.00782	-0.11	0.0723	0.3082	1916424	CBDivE_006042	Cc1ccccc1C(=O)N/N=C/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O03	compound treatment	1.11	-0.00952	-0.13	1.162	0.0302	0.41	0.2002	0.4645	1711164	CBDivE_006043	Cc1nonc1NC(=O)Nc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O04	compound treatment	1.112	-0.00752	-0.1	1.181	0.0492	0.67	0.4025	0.5935	1916425	CBDivE_006044	Clc1ccc(cc1)C(=O)COc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O05	compound treatment	1.062	-0.0575	-0.78	1.121	-0.0108	-0.15	-0.653	-0.8268	1916426	CBDivE_006045	Brc1ccc2N(CN3CCC(Cc4ccccc4)CC3)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O06	compound treatment	1.12	4.84E-4	0.01	1.162	0.0302	0.41	0.2956	0.7182	1916427	CBDivE_006046	Clc1ccc(Nc2nc(N/N=C/c3cccc(I)c3)nc(n2)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O07	compound treatment	1.079	-0.0405	-0.55	1.116	-0.0158	-0.22	-0.539	-0.9173	1916428	CBDivE_006047	Brc1ccc(cc1)C(=O)c2sc3nccc4n(cnc2c34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O08	compound treatment	1.15	0.0305	0.41	1.11	-0.0218	-0.3	0.0804	0.1584	1629043	CBDivE_006048	OC1(CC2CC3C1)CC(CN4C(SCC4=O)c5ccccc5)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O09	compound treatment	1.151	0.0315	0.42	1.138	0.00618	0.08	0.3599	0.8312	1916429	CBDivE_006049	CC(O)CCC(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O10	compound treatment	1.152	0.0325	0.44	1.088	-0.0438	-0.6	-0.1127	-0.152	1916430	CBDivE_006050	COc1cc(/C=C/C(=O)c2c(O)cc(C)oc2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O11	compound treatment	1.098	-0.0215	-0.29	1.137	0.00518	0.07	-0.1553	-0.5199	1916431	CBDivE_006051	CCCCC/C=C/C(=O)NCCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O12	compound treatment	1.104	-0.0155	-0.21	1.106	-0.0258	-0.35	-0.397	-0.9691	1132073	CBDivE_006052	CCCCN1CCC(O)(C(C1)C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O13	compound treatment	1.167	0.0475	0.64	1.165	0.0332	0.45	0.7729	0.9855	1916432	CBDivE_006053	OCCCNC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O14	compound treatment	1.11	-0.00952	-0.13	1.115	-0.0168	-0.23	-0.253	-0.9624	1916433	CBDivE_006054	O=C(Oc1ccc2c(=O)c(Oc3ccccc3)coc2c1)C4CCCN4C(=O)OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O15	compound treatment	1.109	-0.0105	-0.14	1.099	-0.0328	-0.45	-0.4168	-0.8877	1010273	CBDivE_006055	CCSC(SCC)C(O)C(O)C(O)C(O)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O16	compound treatment	1.103	-0.0165	-0.22	1.153	0.0212	0.29	0.0467	0.1279	1336280	CBDivE_006056	C=CCn1c(SCc2nc3ccccc3[nH]2)nnc1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O17	compound treatment	1.113	-0.00652	-0.09	1.124	-0.00782	-0.11	-0.1376	-0.9954	1916434	CBDivE_006057	O/N=C(/CC(O)C(Cl)(Cl)Cl)\c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O18	compound treatment	1.135	0.0155	0.21	1.108	-0.0238	-0.32	-0.082	-0.2123	1590574	CBDivE_006058	Cc1cc(O)c(C2=NCCSC(C2)c3ccc(Cl)cc3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O19	compound treatment	1.141	0.0215	0.29	1.142	0.0102	0.14	0.3031	0.9432	1916435	CBDivE_006059	CCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	O20	compound treatment	1.133	0.0135	0.18	1.155	0.0232	0.32	0.3521	0.9656	1916436	CBDivE_006060	CC(=O)Oc1ccc(cc1)N2C(=O)C3C(C2=O)C4(C(=O)C)c5ccccc5C3c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P01	compound treatment	1.106	-0.0135	-0.18	1.105	-0.0268	-0.37	-0.3876	-0.9483	1916437	CBDivE_006061	CN(C)c1ccc(/C=C\2/NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P02	compound treatment	1.095	-0.0245	-0.33	1.077	-0.0548	-0.75	-0.7625	-0.9327	1916438	CBDivE_006062	Cc1ccc(cc1)C(=O)N/C(=C\c2cc(nn2c3ccccc3)c4ccccc4)/C(=O)NCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P03	compound treatment	1.114	-0.00552	-0.07	1.095	-0.0368	-0.5	-0.4077	-0.8031	1419432	CBDivE_006063	O=C(Nc1ccccc1)Nc2ccc3COC(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P04	compound treatment	1.094	-0.0255	-0.34	1.159	0.0272	0.37	0.0187	0.0369	1916439	CBDivE_006064	CCN(CC(O)CN)CC(O)COc1ccc(cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P05	compound treatment	1.123	0.00348	0.05	1.093	-0.0388	-0.53	-0.3411	-0.6418	3106511	CBDivE_006065	Cn1c[n+](C)c2ccccc12.OS(=O)(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P06	compound treatment	1.12	4.84E-4	0.01	1.138	0.00618	0.08	0.0642	0.7597	1916440	CBDivE_006066	CC(OC(=O)C1CC=CCC1C(=O)O)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P07	compound treatment	1.089	-0.0305	-0.41	1.104	-0.0278	-0.38	-0.5594	-0.9992	1916441	CBDivE_006067	CC(C)C(=O)NC(NC(=S)Nc1cc(ccc1Cl)C(F)(F)F)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P08	compound treatment	1.094	-0.0255	-0.34	1.1	-0.0318	-0.43	-0.5502	-0.9934	1452474	CBDivE_006068	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccco3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P09	compound treatment	1.098	-0.0215	-0.29	1.119	-0.0128	-0.17	-0.3289	-0.9706	1916442	CBDivE_006069	COc1ccccc1/C=N/NC(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P10	compound treatment	1.074	-0.0455	-0.61	1.089	-0.0428	-0.58	-0.8471	-0.9997	1774443	CBDivE_006070	[O-][N+](=O)c1ccc2C(=O)N(CNc3ccc4c(c3)oc5ccccc54)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P11	compound treatment	1.045	-0.0745	-1.01	1.091	-0.0408	-0.56	-1.1044	-0.9611	1916443	CBDivE_006071	FC(F)(F)c1cccc(NC(=O)Cn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P12	compound treatment	1.097	-0.0225	-0.3	1.127	-0.00482	-0.07	-0.2613	-0.8407	1916444	CBDivE_006072	ON=C1c2nn(/N=C/c3ccc(O)cc3O)nc2C(=NO)c4nn(/N=C/c5ccc(O)cc5O)nc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P13	compound treatment	1.055	-0.0645	-0.87	1.106	-0.0258	-0.35	-0.8644	-0.9207	1916445	CBDivE_006073	CC(C)(C)OC(=O)NC(Cc1cc2ccccc2[nH]1)C(=O)Oc3ccc4c(=O)c(coc4c3)c5ccc6OCCOc6c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P14	compound treatment	1.149	0.0295	0.4	1.13	-0.00182	-0.02	0.2637	0.6617	1916446	CBDivE_006074	O/N=C/1\CCc2nonc2\C1=N/Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P15	compound treatment	1.055	-0.0645	-0.87	1.116	-0.0158	-0.22	-0.768	-0.8565	1916447	CBDivE_006075	N1C(N=C(N=C1c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P16	compound treatment	1.075	-0.0445	-0.6	1.092	-0.0398	-0.54	-0.8086	-0.9987	1916448	CBDivE_006076	CCN(CC)CCOC(=O)C(O)(c1ccc(Br)cc1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P17	compound treatment	1.045	-0.0745	-1.01	1.112	-0.0198	-0.27	-0.902	-0.8665	1916449	CBDivE_006077	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NC(Nc2ccccn2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P18	compound treatment	1.093	-0.0265	-0.36	1.089	-0.0428	-0.58	-0.6658	-0.9723	1916450	CBDivE_006078	NCCCCCCNC(=O)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P19	compound treatment	1.055	-0.0645	-0.87	1.059	-0.0728	-0.99	-1.3176	-0.9978	1916451	CBDivE_006079	ClC(Cl)(Cl)C(NC(=O)C(c1ccccc1)c2ccccc2)NC(=S)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.19	P20	compound treatment	1.086	-0.0335	-0.45	1.12	-0.0118	-0.16	-0.4337	-0.9035	1465117	CBDivE_006080	Oc1ccc(cc1)C(=O)CSC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A01	compound treatment	1.092	-0.00133	-0.02	1.236	0.00676	0.09	0.0524	0.5587	1912509	CBDivE_000321	Cc1cc(N=Nc2ccc(O)cc2)[nH]n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A02	compound treatment	1.129	0.0357	0.48	1.311	0.0818	1.11	1.1286	0.9294	1912510	CBDivE_000322	CC(NC(=O)Nc1ccccc1)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A03	compound treatment	1.081	-0.0123	-0.17	1.201	-0.0282	-0.39	-0.39	-0.9295	1912511	CBDivE_000323	Cc1cc(C)c(/C=N/O)c(C)c1Cc2c(C)cc(C)c(/C=N/O)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A04	compound treatment	1.15	0.0567	0.76	1.288	0.0588	0.8	1.1071	0.9997	1912512	CBDivE_000324	C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A05	compound treatment	1.149	0.0557	0.75	1.202	-0.0272	-0.37	0.2683	0.3203	1602604	CBDivE_000325	CCc1cc(CC)c(CO)c(CC)c1CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A06	compound treatment	1.109	0.0157	0.21	1.281	0.0518	0.71	0.6485	0.8803	1912513	CBDivE_000326	C/C(=N\Nc1ccccc1)/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A07	compound treatment	1.139	0.0457	0.62	1.273	0.0438	0.6	0.8576	0.9999	1912514	CBDivE_000327	CCc1cc(CC)c(C#[N+][O-])c(CC)c1C#[N+][O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A08	compound treatment	1.057	-0.0363	-0.49	1.302	0.0728	0.99	0.355	0.3208	1912515	CBDivE_000328	Cc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A09	compound treatment	1.113	0.0197	0.27	1.264	0.0348	0.47	0.5228	0.9624	1912516	CBDivE_000329	CC(=O)c1c(C)cc(C)c(C(=O)O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A10	compound treatment	1.146	0.0527	0.71	1.168	-0.0612	-0.84	-0.0881	-0.0804	1047807	CBDivE_000330	Cc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A11	compound treatment	1.1	0.00667	0.09	1.274	0.0448	0.61	0.4952	0.8027	1491556	CBDivE_000331	COc1ccc(NS(=O)(=O)CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A12	compound treatment	1.165	0.0717	0.97	1.293	0.0638	0.87	1.2984	0.9986	1912517	CBDivE_000332	[O-][N+](=O)c1ccc(Nc2nccs2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A13	compound treatment	1.111	0.0177	0.24	1.27	0.0408	0.56	0.5615	0.9286	1358547	CBDivE_000333	CSc1sc(SC)c(CN2C(=O)c3ccccc3C2=O)c1CN4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A14	compound treatment	1.148	0.0547	0.74	1.255	0.0258	0.35	0.7698	0.9424	1912518	CBDivE_000334	CC(=O)c1cccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A15	compound treatment	1.108	0.0147	0.2	1.171	-0.0582	-0.79	-0.4217	-0.5152	1912519	CBDivE_000335	CN(C)Cc1cc(/C=N/C2CCCCC2)c(S)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A16	compound treatment	1.09	-0.00333	-0.04	1.343	0.114	1.55	1.0651	0.6863	1051757	CBDivE_000336	COc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A17	compound treatment	1.103	0.00967	0.13	1.279	0.0498	0.68	0.572	0.8279	1070881	CBDivE_000337	[O-][N+](=O)c1ccc(Sc2cccs2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A18	compound treatment	1.08	-0.0133	-0.18	1.233	0.00376	0.05	-0.091	-0.4864	1912520	CBDivE_000338	CCOC(=O)c1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A19	compound treatment	1.095	0.00167	0.02	1.277	0.0478	0.65	0.4764	0.7311	1912521	CBDivE_000339	[O-][N+](=O)c1cccc(c1)C(CC(=O)c2ccccc2)Sc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	A20	compound treatment	1.139	0.0457	0.62	1.211	-0.0182	-0.25	0.2597	0.3909	1912522	CBDivE_000340	Cc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B01	compound treatment	1.069	-0.0243	-0.33	1.173	-0.0562	-0.77	-0.7744	-0.9283	1912523	CBDivE_000341	C/C(=N\NC(=O)c1cc2ccccc2cc1O)/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B02	compound treatment	1.122	0.0287	0.39	1.27	0.0408	0.56	0.6665	0.9843	1912524	CBDivE_000342	COC(C)(C)CCC[C@@H](C)C(=O)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B03	compound treatment	1.186	0.0927	1.25	1.243	0.0138	0.19	1.0166	0.8042	1912525	CBDivE_000343	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B04	compound treatment	1.132	0.0387	0.52	1.258	0.0288	0.39	0.6461	0.9901	1912526	CBDivE_000344	CCN(CC)CC#CC(CO)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B05	compound treatment	1.14	0.0467	0.63	1.298	0.0688	0.94	1.1082	0.9812	1912527	CBDivE_000345	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B06	compound treatment	1.133	0.0397	0.54	1.231	0.00176	0.02	0.3953	0.738	1046360	CBDivE_000346	CC(=O)OCC1OC(C(OC(=O)C)C1OC(=O)C)n2ccc(=O)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B07	compound treatment	1.151	0.0577	0.78	1.208	-0.0212	-0.29	0.3453	0.4159	1912528	CBDivE_000347	COc1ccc(/C(=N\NC(=O)Nc2ccccc2)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B08	compound treatment	1.112	0.0187	0.25	1.281	0.0518	0.71	0.6771	0.9036	1912529	CBDivE_000348	CCOC(=O)c1ccc(CN(C(=O)c2ccco2)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B09	compound treatment	1.125	0.0317	0.43	1.25	0.0208	0.28	0.5022	0.98	1042364	CBDivE_000349	O=C(NN=C1CCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B10	compound treatment	1.082	-0.0113	-0.15	1.302	0.0728	0.99	0.5934	0.5912	1136077	CBDivE_000350	COc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B11	compound treatment	1.081	-0.0123	-0.17	1.203	-0.0262	-0.36	-0.3707	-0.9393	1912530	CBDivE_000351	Cc1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B12	compound treatment	1.136	0.0427	0.58	1.236	0.00676	0.09	0.4722	0.81	1300323	CBDivE_000352	COc1ccc(cc1)C(=O)NC(C)Cc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B13	compound treatment	1.117	0.0237	0.32	1.26	0.0308	0.42	0.5223	0.9909	1912531	CBDivE_000353	Cc1cc(C)nc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B14	compound treatment	1.105	0.0117	0.16	1.244	0.0148	0.2	0.2536	0.9926	1199213	CBDivE_000354	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B15	compound treatment	1.148	0.0547	0.74	1.279	0.0498	0.68	1.0013	0.9991	1912532	CBDivE_000355	COc1ccc(/C(=N/Nc2ccccc2Br)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B16	compound treatment	1.163	0.0697	0.94	1.248	0.0188	0.26	0.8454	0.868	1912533	CBDivE_000356	CCOC(=O)/C(=C\c1ccccc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B17	compound treatment	1.143	0.0497	0.67	1.308	0.0788	1.07	1.2332	0.9742	1912534	CBDivE_000357	COc1ccc(cc1)/C(=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B18	compound treatment	1.164	0.0707	0.95	1.189	-0.0402	-0.55	0.2861	0.2601	1519376	CBDivE_000358	COc1ccc2[nH]cc(CCNC(=O)c3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B19	compound treatment	1.143	0.0497	0.67	1.246	0.0168	0.23	0.6354	0.8975	1912535	CBDivE_000359	CCOC(=O)CCN1CCN(CC1)c2nc3n(C)c(=O)[nH]c(=O)c3n2CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	B20	compound treatment	1.056	-0.0373	-0.5	1.202	-0.0272	-0.37	-0.6188	-0.9888	1650085	CBDivE_000360	COc1cc(cc(OC)c1OC)C(=O)N2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C01	compound treatment	1.066	-0.0273	-0.37	1.207	-0.0222	-0.3	-0.4752	-0.9953	1912536	CBDivE_000361	CCSc1sc(CC)cc1/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C02	compound treatment	1.054	-0.0393	-0.53	1.261	0.0318	0.43	-0.069	-0.1007	1912537	CBDivE_000362	CC(=O)c1cccc(/N=C/c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C03	compound treatment	1.095	0.00167	0.02	1.237	0.00776	0.11	0.0907	0.8388	1912538	CBDivE_000363	CC(C)(C)S(=O)(=O)c1ccccc1C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C04	compound treatment	1.12	0.0267	0.36	1.235	0.00576	0.08	0.3099	0.8416	1912539	CBDivE_000364	Oc1ccccc1C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C05	compound treatment	1.148	0.0547	0.74	1.254	0.0248	0.34	0.7602	0.9372	1041788	CBDivE_000365	CN1CCCC1c2cccnc2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C06	compound treatment	1.092	-0.00133	-0.02	1.225	-0.00424	-0.06	-0.0536	-0.8849	1912540	CBDivE_000366	COc1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C07	compound treatment	1.038	-0.0553	-0.75	1.201	-0.0282	-0.39	-0.8002	-0.9526	1912541	CBDivE_000367	CCN(CC)S(=O)(=O)c1c(Br)cc(C)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C08	compound treatment	1.058	-0.0353	-0.48	1.252	0.0228	0.31	-0.1176	-0.2068	1912542	CBDivE_000368	Oc1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C09	compound treatment	1.093	-3.31E-4	0.0	1.256	0.0268	0.36	0.2548	0.6984	1157303	CBDivE_000369	CCC(C)c1ccc(cc1)S(=O)(=O)CCc2ccc(C)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C10	compound treatment	1.086	-0.00733	-0.1	1.279	0.0498	0.68	0.4098	0.5977	1912543	CBDivE_000370	O=C(Oc1ccc(/C=N/Nc2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C11	compound treatment	1.073	-0.0203	-0.27	1.288	0.0588	0.8	0.3726	0.44	1912544	CBDivE_000371	OC(=O)CSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C12	compound treatment	1.159	0.0657	0.89	1.241	0.0118	0.16	0.7398	0.8217	1912545	CBDivE_000372	O=C(Oc1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)cc1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C13	compound treatment	1.084	-0.00933	-0.13	1.216	-0.0132	-0.18	-0.2167	-0.9844	1912546	CBDivE_000373	CCS(=O)(=O)CCOS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C14	compound treatment	1.103	0.00967	0.13	1.259	0.0298	0.41	0.3791	0.8896	1912547	CBDivE_000374	Clc1ccccc1/N=C/c2ccc(OC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C15	compound treatment	1.096	0.00267	0.04	1.267	0.0378	0.51	0.3895	0.7547	1912548	CBDivE_000375	[O-][N+](=O)c1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C16	compound treatment	1.086	-0.00733	-0.1	1.269	0.0398	0.54	0.3134	0.5687	1912549	CBDivE_000376	CC(=O)c1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C17	compound treatment	1.088	-0.00533	-0.07	1.204	-0.0252	-0.34	-0.2943	-0.8368	1912550	CBDivE_000377	CCS(=O)(=O)CCOS(=O)(=O)c1ccc(cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C18	compound treatment	1.101	0.00767	0.1	1.197	-0.0322	-0.44	-0.2378	-0.5264	1912551	CBDivE_000378	CN(C)c1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C19	compound treatment	1.141	0.0477	0.64	1.236	0.00676	0.09	0.5199	0.8002	1015526	CBDivE_000379	C(Cc1ccncc1)Sc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	C20	compound treatment	1.133	0.0397	0.54	1.25	0.0208	0.28	0.5785	0.9557	1912552	CBDivE_000380	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D01	compound treatment	1.127	0.0337	0.45	1.206	-0.0232	-0.32	0.097	0.1752	1912553	CBDivE_000381	Cc1ccc(CCC(=O)NNC(=O)c2ccco2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D02	compound treatment	1.121	0.0277	0.37	1.256	0.0268	0.36	0.5219	0.9999	1912554	CBDivE_000382	Cc1ccc(cc1)S(=O)(=O)N(Cc2ccc(cc2)[N+](=O)[O-])C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D03	compound treatment	1.118	0.0247	0.33	1.232	0.00276	0.04	0.2619	0.782	1227067	CBDivE_000383	Cn1c2ccccc2c3cc(ccc13)C(=C(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D04	compound treatment	1.139	0.0457	0.62	1.191	-0.0382	-0.52	0.0669	0.0829	1912555	CBDivE_000384	Clc1ccc(cc1)C(=O)OCCN2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D05	compound treatment	1.116	0.0227	0.31	1.24	0.0108	0.15	0.32	0.9433	1005723	CBDivE_000385	OC(=O)c1cc(N=Nc2ccc(cc2)[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D06	compound treatment	1.083	-0.0103	-0.14	1.207	-0.0222	-0.3	-0.313	-0.9378	1359375	CBDivE_000386	CC(C)(C)N(Cc1ccccc1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D07	compound treatment	1.093	-3.31E-4	0.0	1.259	0.0298	0.41	0.2838	0.6993	1912556	CBDivE_000387	CC(/N=C/c1cc(Br)ccc1O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D08	compound treatment	1.125	0.0317	0.43	1.271	0.0418	0.57	0.7047	0.99	1118257	CBDivE_000388	O=C(Nc1cccc(NC(=O)c2ccco2)c1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D09	compound treatment	1.107	0.0137	0.18	1.198	-0.0312	-0.43	-0.1709	-0.3681	1912557	CBDivE_000389	COC(=O)C1(CCC1(C(=O)OC)C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D10	compound treatment	1.08	-0.0133	-0.18	1.243	0.0138	0.19	0.0055	0.021	2009	CBDivE_000390	COc1ccc2[nH]cc(CCNC(=O)C3CC3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D11	compound treatment	1.104	0.0107	0.14	1.259	0.0298	0.41	0.3887	0.9028	1912558	CBDivE_000391	COC(=O)[C@]1(C#N)C(C)(C)[C@@]1(C#N)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D12	compound treatment	1.109	0.0157	0.21	1.265	0.0358	0.49	0.4942	0.93	1243405	CBDivE_000392	COC(=O)c1cc(OC)c(OC)cc1NC(=O)C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D13	compound treatment	1.168	0.0747	1.01	1.312	0.0828	1.13	1.5103	0.9984	1089341	CBDivE_000393	O=C(CC(=O)c1ccccc1)C(=O)CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D14	compound treatment	1.096	0.00267	0.04	1.23	7.55E-4	0.01	0.0327	0.8744	1441763	CBDivE_000394	CCOC(=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D15	compound treatment	1.117	0.0237	0.32	1.292	0.0628	0.86	0.8309	0.9097	1912559	CBDivE_000395	O=C1CC(Cc2ccccc2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D16	compound treatment	1.096	0.00267	0.04	1.255	0.0258	0.35	0.2738	0.7755	1912560	CBDivE_000396	CNC(=O)N(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D17	compound treatment	1.089	-0.00433	-0.06	1.245	0.0158	0.21	0.1106	0.4968	1912561	CBDivE_000397	CCOC(=O)/C(=C(\CC)/Cc1ccccc1)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D18	compound treatment	1.116	0.0227	0.31	1.287	0.0578	0.79	0.7731	0.9151	1912562	CBDivE_000398	C/C(=C\C(=O)N1CCc2ccccc12)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D19	compound treatment	1.129	0.0357	0.48	1.239	0.00976	0.13	0.4343	0.87	1912563	CBDivE_000399	OCCOC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	D20	compound treatment	1.042	-0.0513	-0.69	1.264	0.0348	0.47	-0.1545	-0.1842	1912564	CBDivE_000400	Cc1ccc(N/N=C/2\CCCNC2=O)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E01	compound treatment	1.144	0.0507	0.68	1.27	0.0408	0.56	0.8763	0.9947	1912565	CBDivE_000401	Cc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E02	compound treatment	1.106	0.0127	0.17	1.213	-0.0162	-0.22	-0.0358	-0.1279	1214999	CBDivE_000402	CC1(C)CC1C(=O)Nc2ccc(Cc3ccc(NC(=O)C4CC4(C)C)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E03	compound treatment	1.226	0.133	1.79	1.378	0.149	2.03	2.6999	0.9981	1267778	CBDivE_000403	COc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E04	compound treatment	1.09	-0.00333	-0.04	1.165	-0.0642	-0.88	-0.6512	-0.7424	1540118	CBDivE_000404	O=C(OCC1c2ccccc2-c3ccccc13)ON4C(=O)CCC4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E05	compound treatment	1.021	-0.0723	-0.98	1.235	0.00576	0.08	-0.6345	-0.6481	1912566	CBDivE_000405	Fc1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E06	compound treatment	1.075	-0.0183	-0.25	1.227	-0.00224	-0.03	-0.1965	-0.7886	1912567	CBDivE_000406	CC1(C)CC1C(=O)Oc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E07	compound treatment	1.139	0.0457	0.62	1.339	0.11	1.5	1.494	0.923	1912568	CBDivE_000407	Brc1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E08	compound treatment	1.133	0.0397	0.54	1.296	0.0668	0.91	1.0221	0.9679	1536992	CBDivE_000408	CC(=O)Nc1ccc(NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E09	compound treatment	1.077	-0.0163	-0.22	1.256	0.0268	0.36	0.1022	0.2398	1738712	CBDivE_000409	CC(C)(C)c1ccc(cc1)S(=O)(=O)CCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E10	compound treatment	1.102	0.00867	0.12	1.268	0.0388	0.53	0.4564	0.8432	1912569	CBDivE_000410	COC(=O)CCC(=O)Nc1ccc(C)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E11	compound treatment	1.069	-0.0243	-0.33	1.185	-0.0442	-0.6	-0.6587	-0.9591	1912570	CBDivE_000411	Cc1ccc(CCS(=O)(=O)c2ccc(cc2)C(C)(C)C)c[n+]1CC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E12	compound treatment	1.14	0.0467	0.63	1.221	-0.00824	-0.11	0.3657	0.5718	1354265	CBDivE_000412	COC(=O)CCC(=O)Nc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E13	compound treatment	1.178	0.0847	1.14	1.357	0.128	1.74	2.0396	0.979	1015526	CBDivE_000413	C(Cc1ccncc1)Sc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E14	compound treatment	1.028	-0.0653	-0.88	1.244	0.0148	0.2	-0.4809	-0.532	1912571	CBDivE_000414	COC(=O)CCC(=O)NC(C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E15	compound treatment	1.11	0.0167	0.22	1.269	0.0398	0.54	0.5423	0.9241	1242743	CBDivE_000415	Cc1ccnc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E16	compound treatment	1.123	0.0297	0.4	1.276	0.0468	0.64	0.7339	0.9748	1912572	CBDivE_000416	CC(C)(C)c1cc(c(OC(=O)c2ccc(cc2)c3ccccc3)c(c1)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E17	compound treatment	1.079	-0.0143	-0.19	1.264	0.0348	0.47	0.1984	0.3876	1912573	CBDivE_000417	NC(=N)SCc1ccccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E18	compound treatment	1.084	-0.00933	-0.13	1.221	-0.00824	-0.11	-0.1685	-0.9984	1081802	CBDivE_000418	[O-][N+](=O)c1ccccc1NC(=O)COc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E19	compound treatment	1.004	-0.0893	-1.21	1.18	-0.0492	-0.67	-1.327	-0.9619	1434575	CBDivE_000419	CC(SCCc1ccccn1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	E20	compound treatment	1.106	0.0127	0.17	1.26	0.0308	0.42	0.4174	0.9217	1912574	CBDivE_000420	[O-][N+](=O)c1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F01	compound treatment	1.086	-0.00733	-0.1	1.236	0.00676	0.09	-0.0048	-0.0355	1478080	CBDivE_000421	OC(=O)CCC(=O)Nc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F02	compound treatment	1.153	0.0597	0.8	1.272	0.0428	0.58	0.9815	0.9875	1912575	CBDivE_000422	[O-][N+](=O)/C=C/c1cn(C(=O)CCl)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F03	compound treatment	1.14	0.0467	0.63	1.212	-0.0172	-0.24	0.2789	0.415	1912576	CBDivE_000423	COC1(OC)N=C(N)C2(C#N)C(C)(C)C21C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F04	compound treatment	1.138	0.0447	0.6	1.206	-0.0232	-0.32	0.202	0.2966	1912577	CBDivE_000424	Cc1cc(OC(=O)c2ccco2)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F05	compound treatment	1.085	-0.00833	-0.11	1.17	-0.0592	-0.81	-0.6507	-0.7978	1276122	CBDivE_000425	CCOC(=O)CC1=CC(C)(CC(=O)OCC)C(C#N)(C#N)C(=C1C#N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F06	compound treatment	1.102	0.00867	0.12	1.238	0.00876	0.12	0.1671	0.9999	1912578	CBDivE_000426	COc1ccc(NC(=O)c2ccco2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F07	compound treatment	1.027	-0.0663	-0.89	1.171	-0.0582	-0.79	-1.1944	-0.9982	1912579	CBDivE_000427	NC(=S)N/N=C/c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F08	compound treatment	1.135	0.0417	0.56	1.277	0.0478	0.65	0.858	0.9973	1218825	CBDivE_000428	Cc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F09	compound treatment	1.136	0.0427	0.58	1.323	0.0938	1.28	1.3111	0.9351	1210571	CBDivE_000429	CCOC(=O)C1(C#N)C(C=C(C(=C1N)C#N)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F10	compound treatment	1.123	0.0297	0.4	1.206	-0.0232	-0.32	0.0589	0.1153	1912580	CBDivE_000430	CC(C)(C)N(Cc1ccc(cc1)[N+](=O)[O-])C(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F11	compound treatment	1.118	0.0247	0.33	1.256	0.0268	0.36	0.4933	0.9989	1912581	CBDivE_000431	COc1ccc(/C=N/NC(=S)N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F12	compound treatment	1.07	-0.0233	-0.31	1.257	0.0278	0.38	0.0451	0.0915	1409588	CBDivE_000432	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F13	compound treatment	1.117	0.0237	0.32	1.198	-0.0312	-0.43	-0.0755	-0.1418	1056261	CBDivE_000433	COC(=O)C1(C(=O)OC)C(C)(C)C1(C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F14	compound treatment	1.086	-0.00733	-0.1	1.235	0.00576	0.08	-0.0144	-0.1144	1912582	CBDivE_000434	CC(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F15	compound treatment	1.046	-0.0473	-0.64	1.183	-0.0462	-0.63	-0.8974	-1.0	1160601	CBDivE_000435	Cc1cc(c(C#N)c(N)n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F16	compound treatment	1.135	0.0417	0.56	1.253	0.0238	0.32	0.6266	0.9657	1605588	CBDivE_000436	CC(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F17	compound treatment	1.087	-0.00633	-0.09	1.237	0.00776	0.11	0.0144	0.1058	1912583	CBDivE_000437	NC(=S)N/N=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F18	compound treatment	1.026	-0.0673	-0.91	1.2	-0.0292	-0.4	-0.9243	-0.9317	1730812	CBDivE_000438	Oc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F19	compound treatment	1.116	0.0227	0.31	1.251	0.0218	0.3	0.426	0.9999	1912584	CBDivE_000439	Nc1nc(cc(c1C#N)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	F20	compound treatment	1.115	0.0217	0.29	1.18	-0.0492	-0.67	-0.2681	-0.3661	1912585	CBDivE_000440	[O-][N+](=O)/C(=C\c1c[nH]c2ccccc12)/C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G01	compound treatment	1.115	0.0217	0.29	1.194	-0.0352	-0.48	-0.1331	-0.2367	1912586	CBDivE_000441	Cc1ccc(CCSc2ccc(cc2)C(C)(C)C)c[n+]1CC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G02	compound treatment	1.103	0.00967	0.13	1.233	0.00376	0.05	0.1284	0.9166	1185376	CBDivE_000442	Clc1ccc(OCC(=O)Nc2ccccc2C#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G03	compound treatment	1.062	-0.0313	-0.42	1.285	0.0558	0.76	0.2387	0.2744	1912587	CBDivE_000443	O=C(C[n+]1ccc(CCSCc2ccc3CCc4cccc2c43)cc1)c5ccc6CCc7cccc5c76
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G04	compound treatment	1.097	0.00367	0.05	1.248	0.0188	0.26	0.2158	0.8286	1912588	CBDivE_000444	CC(=O)c1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G05	compound treatment	1.104	0.0107	0.14	1.207	-0.0222	-0.3	-0.1127	-0.3357	1912589	CBDivE_000445	[O-][N+](=O)c1ccc(cc1)C(=O)C[n+]2ccc(CCSC3Cc4cccc5cccc3c45)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G06	compound treatment	1.053	-0.0403	-0.54	1.233	0.00376	0.05	-0.3485	-0.6377	1411018	CBDivE_000446	Clc1ccc(OCC(=O)Nc2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G07	compound treatment	1.109	0.0157	0.21	1.265	0.0358	0.49	0.4942	0.93	1912590	CBDivE_000447	Fc1ccc(SCCc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G08	compound treatment	1.128	0.0347	0.47	1.239	0.00976	0.13	0.4248	0.8736	1587426	CBDivE_000448	Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G09	compound treatment	1.256	0.163	2.19	1.431	0.202	2.75	3.4972	0.9937	1016850	CBDivE_000449	C(Cc1ccncc1)SCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G10	compound treatment	1.039	-0.0543	-0.73	1.266	0.0368	0.5	-0.1639	-0.1846	1172242	CBDivE_000450	COc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G11	compound treatment	1.175	0.0817	1.1	1.355	0.126	1.71	1.9917	0.9771	1912591	CBDivE_000451	C(Cc1ccccc1)SCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G12	compound treatment	1.141	0.0477	0.64	1.294	0.0648	0.88	1.0791	0.9879	1560606	CBDivE_000452	Clc1ccc(OCC(=O)Oc2cccc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G13	compound treatment	1.248	0.155	2.09	1.273	0.0438	0.6	1.8973	0.8743	1912592	CBDivE_000453	Clc1ccc(CSCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G14	compound treatment	1.042	-0.0513	-0.69	1.246	0.0168	0.23	-0.3281	-0.4499	1912593	CBDivE_000454	CC(C)c1cc(Cl)c(C)cc1OC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G15	compound treatment	1.086	-0.00733	-0.1	1.264	0.0348	0.47	0.2652	0.5477	1659659	CBDivE_000455	C(Cc1ccncc1)SC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G16	compound treatment	1.149	0.0557	0.75	1.284	0.0548	0.75	1.059	1.0	1912594	CBDivE_000456	CN(C)c1ccc(/C=N/c2ccccc2c3ccccc3\N=C\c4ccc(cc4)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G17	compound treatment	1.205	0.112	1.51	1.281	0.0518	0.71	1.5643	0.9403	1228661	CBDivE_000457	C(Cc1ccncc1)Sc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G18	compound treatment	1.053	-0.0403	-0.54	1.248	0.0188	0.26	-0.2039	-0.3391	1912595	CBDivE_000458	COc1ccc(cc1)/C(=N/Nc2ccccc2Br)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G19	compound treatment	1.044	-0.0493	-0.67	1.102	-0.127	-1.74	-1.6975	-0.9134	1912596	CBDivE_000459	CCCCS(=O)(=O)CCSC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	G20	compound treatment	1.14	0.0467	0.63	1.282	0.0528	0.72	0.9539	0.9978	1912597	CBDivE_000460	C/C(=N\Nc1ccccc1Br)/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H01	compound treatment	1.076	-0.0173	-0.23	1.228	-0.00124	-0.02	-0.1773	-0.7564	1912598	CBDivE_000461	CC1=C(C#N)C(=O)C(C#N)(C#N)C(C)(C)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H02	compound treatment	1.08	-0.0133	-0.18	1.217	-0.0122	-0.17	-0.2452	-0.9993	1912599	CBDivE_000462	CCOc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H03	compound treatment	1.069	-0.0243	-0.33	1.192	-0.0372	-0.51	-0.5912	-0.9777	1717432	CBDivE_000463	NC1=C(C#N)C2=C(CCCC2)C(c3ccccc3)C1(C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H04	compound treatment	1.103	0.00967	0.13	1.255	0.0258	0.35	0.3406	0.9091	1912600	CBDivE_000464	[O-][N+](=O)c1ccc(N/N=C/CCCN2C(=O)c3ccccc3C2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H05	compound treatment	1.114	0.0207	0.28	1.219	-0.0102	-0.14	0.0984	0.3155	1205285	CBDivE_000465	NC1=C(C#N)C2=C(CCCC2)C(c3ccco3)C1(C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H06	compound treatment	1.049	-0.0443	-0.6	1.243	0.0138	0.19	-0.2903	-0.4631	1345179	CBDivE_000466	COc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H07	compound treatment	1.052	-0.0413	-0.56	1.199	-0.0302	-0.41	-0.6859	-0.989	1912601	CBDivE_000467	CCC/C=C/1\CC(c2ccccc2)C(C#N)(C#N)C(=C1C#N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H08	compound treatment	1.058	-0.0353	-0.48	1.252	0.0228	0.31	-0.1176	-0.2068	1438108	CBDivE_000468	COc1ccc(cc1)C(=O)NC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H09	compound treatment	1.114	0.0207	0.28	1.126	-0.103	-1.41	-0.7984	-0.5563	1258841	CBDivE_000469	O=C1C(=C2CCCCC2C(c3ccco3)C1(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H10	compound treatment	1.071	-0.0223	-0.3	1.262	0.0328	0.45	0.1028	0.1908	1613914	CBDivE_000470	CCCOc1ccc(NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H11	compound treatment	1.062	-0.0313	-0.42	1.18	-0.0492	-0.67	-0.7737	-0.9751	1606655	CBDivE_000471	Nc1nc2CCCCc2c(c3ccco3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H12	compound treatment	1.075	-0.0183	-0.25	1.301	0.0718	0.98	0.517	0.5123	1519946	CBDivE_000472	COc1ccc(cc1)C(=O)Nc2ccc(OC(C)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H13	compound treatment	1.124	0.0307	0.41	1.257	0.0278	0.38	0.5602	0.999	1912602	CBDivE_000473	Brc1cccc(c1)C2C3CCCCC3=C(C#N)C(=O)C2(C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H14	compound treatment	1.021	-0.0723	-0.98	1.215	-0.0142	-0.19	-0.8273	-0.8315	1129166	CBDivE_000474	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H15	compound treatment	1.108	0.0147	0.2	1.224	-0.00524	-0.07	0.0894	0.4247	1213622	CBDivE_000475	OC(=O)c1ccccc1C(=O)OC(C#C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H16	compound treatment	1.041	-0.0523	-0.71	1.23	7.55E-4	0.01	-0.4919	-0.6967	1912603	CBDivE_000476	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H17	compound treatment	1.119	0.0257	0.35	1.256	0.0268	0.36	0.5028	0.9997	1439216	CBDivE_000477	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H18	compound treatment	1.058	-0.0353	-0.48	1.171	-0.0582	-0.79	-0.8987	-0.9702	1162761	CBDivE_000478	CCOC(=O)c1ccc(NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H19	compound treatment	0.991	-0.102	-1.38	1.146	-0.0832	-1.14	-1.7788	-0.9953	1529411	CBDivE_000479	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ncncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	H20	compound treatment	1.029	-0.0643	-0.87	1.245	0.0158	0.21	-0.4618	-0.5165	1325092	CBDivE_000480	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I01	compound treatment	1.131	0.0377	0.51	1.255	0.0258	0.35	0.6077	0.9837	3001847	CBDivE_000481	Cc1ccc(cc1)S(=O)(=O)O.NC(=N)SCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I02	compound treatment	1.062	-0.0313	-0.42	1.249	0.0198	0.27	-0.1084	-0.2162	1912604	CBDivE_000482	C/C(=N\NC(=O)c1ccccc1O)/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I03	compound treatment	1.12	0.0267	0.36	1.272	0.0428	0.58	0.6667	0.9731	3105371	CBDivE_000483	CCS(=O)(=O)/C=C/SC(=N)N.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I04	compound treatment	1.083	-0.0103	-0.14	1.172	-0.0572	-0.78	-0.6505	-0.8204	1912606	CBDivE_000484	C/C(=N\Nc1ccccc1Br)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I05	compound treatment	1.003	-0.0903	-1.22	1.234	0.00476	0.06	-0.8158	-0.6685	3105372	CBDivE_000485	CCCS(=O)(=O)/C=C/SC(=N)N.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I06	compound treatment	1.106	0.0127	0.17	1.245	0.0158	0.21	0.2728	0.9936	1912608	CBDivE_000486	Oc1ccc(/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I07	compound treatment	1.064	-0.0293	-0.4	1.157	-0.0722	-0.99	-0.9764	-0.9197	1912609	CBDivE_000487	CC(C)CSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I08	compound treatment	1.068	-0.0253	-0.34	1.264	0.0348	0.47	0.0935	0.16	1912610	CBDivE_000488	CN(C)c1ccc(/C=N/c2ccc(cc2C)c3ccc(\N=C\c4ccc(cc4)N(C)C)c(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I09	compound treatment	1.06	-0.0333	-0.45	1.249	0.0198	0.27	-0.1275	-0.2432	1912611	CBDivE_000489	OCCSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I10	compound treatment	1.088	-0.00533	-0.07	1.18	-0.0492	-0.67	-0.5257	-0.7784	1627815	CBDivE_000490	CC(=O)Nc1cccc(NC(=S)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I11	compound treatment	1.017	-0.0763	-1.03	1.207	-0.0222	-0.3	-0.9426	-0.8781	1912612	CBDivE_000491	CN(C)CCS(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I12	compound treatment	1.124	0.0307	0.41	1.244	0.0148	0.2	0.4348	0.9451	1912613	CBDivE_000492	CN(N(C)C(=S)Nc1ccccc1)C(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I13	compound treatment	1.04	-0.0533	-0.72	1.225	-0.00424	-0.06	-0.5497	-0.7615	1737061	CBDivE_000493	CN(CC#CC(O)(c1ccccc1)c2ccccc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I14	compound treatment	1.063	-0.0303	-0.41	1.211	-0.0182	-0.25	-0.4653	-0.9715	1912614	CBDivE_000494	CCc1ccc(cc1)C(C)NC(=O)Nc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I15	compound treatment	1.125	0.0317	0.43	1.186	-0.0432	-0.59	-0.1149	-0.1578	1164872	CBDivE_000495	OC(C#CCN1CCOCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I16	compound treatment	1.091	-0.00233	-0.03	1.249	0.0198	0.27	0.1683	0.6203	1208590	CBDivE_000496	COc1ccccc1NC(=O)Nc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I17	compound treatment	1.034	-0.0593	-0.8	1.207	-0.0222	-0.3	-0.7805	-0.9118	1912615	CBDivE_000497	Fc1cc(Cl)c(cc1F)C(=O)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I18	compound treatment	1.046	-0.0473	-0.64	1.241	0.0118	0.16	-0.3382	-0.5136	1912616	CBDivE_000498	CC(C)C1CCC(C)CC1OC(=O)CSC(=N)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I19	compound treatment	1.084	-0.00933	-0.13	1.2	-0.0292	-0.4	-0.371	-0.8872	1458063	CBDivE_000499	OC(C#CCN(C1CCCCC1)C2CCCCC2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	I20	compound treatment	1.15	0.0567	0.76	1.252	0.0228	0.31	0.76	0.9211	1912617	CBDivE_000500	[O-][N+](=O)c1ccc(cc1)N2N=C(CC2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J01	compound treatment	1.112	0.0187	0.25	1.25	0.0208	0.28	0.3782	0.9983	1207293	CBDivE_000501	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2nccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J02	compound treatment	1.107	0.0137	0.18	1.235	0.00576	0.08	0.1859	0.9275	1912618	CBDivE_000502	OCC1OC(O)C(Nc2ccc(O[N+](=O)[O-])cc2O[N+](=O)[O-])C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J03	compound treatment	1.11	0.0167	0.22	1.193	-0.0362	-0.49	-0.1905	-0.3508	1653724	CBDivE_000503	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J04	compound treatment	1.066	-0.0273	-0.37	1.239	0.00976	0.13	-0.1667	-0.4252	1695165	CBDivE_000504	OCC(O)C1OC2OC3(CCCCC3)OC2C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J05	compound treatment	1.043	-0.0503	-0.68	1.156	-0.0732	-1.0	-1.1864	-0.9823	1687990	CBDivE_000505	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J06	compound treatment	1.119	0.0257	0.35	1.23	7.55E-4	0.01	0.2521	0.7278	1912619	CBDivE_000506	CCOC(=O)c1c(oc2ccc(O)cc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J07	compound treatment	1.084	-0.00933	-0.13	1.237	0.00776	0.11	-0.0142	-0.0866	1912620	CBDivE_000507	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J08	compound treatment	1.064	-0.0293	-0.4	1.237	0.00776	0.11	-0.205	-0.5006	1912621	CBDivE_000508	CC(C)Oc1ccc(NC(=O)NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J09	compound treatment	1.089	-0.00433	-0.06	1.208	-0.0212	-0.29	-0.2462	-0.833	1570647	CBDivE_000509	C=CCNC(=O)c1ccccc1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J10	compound treatment	1.046	-0.0473	-0.64	1.209	-0.0202	-0.28	-0.6467	-0.9297	1912622	CBDivE_000510	CC(C)N(Cc1ccccc1)C(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J11	compound treatment	1.057	-0.0363	-0.49	1.25	0.0208	0.28	-0.1464	-0.2587	1265340	CBDivE_000511	O=C(NCc1ccccc1)c2ccccc2C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J12	compound treatment	1.069	-0.0243	-0.33	1.159	-0.0702	-0.96	-0.9094	-0.8981	1912623	CBDivE_000512	[O-][N+](=O)c1ccc(cc1)C(=O)NCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J13	compound treatment	1.096	0.00267	0.04	1.202	-0.0272	-0.37	-0.2372	-0.6356	1912624	CBDivE_000513	[O-][N+](=O)c1ccc(NC(=O)c2ccccc2C(=O)Nc3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J14	compound treatment	1.066	-0.0273	-0.37	1.167	-0.0622	-0.85	-0.8609	-0.9303	1912625	CBDivE_000514	COc1ccc(CN(C(=O)CCC(=O)O)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J15	compound treatment	1.039	-0.0543	-0.73	1.193	-0.0362	-0.49	-0.8678	-0.9816	1079844	CBDivE_000515	OC(=O)c1ccccc1C(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J16	compound treatment	1.076	-0.0173	-0.23	1.205	-0.0242	-0.33	-0.3991	-0.9856	1226739	CBDivE_000516	Cc1c(Cn2ccnc2)c3ccccc3n1CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J17	compound treatment	1.087	-0.00633	-0.09	1.188	-0.0412	-0.56	-0.4581	-0.8053	1912626	CBDivE_000517	CC(=O)c1ccc(NC(=O)CCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J18	compound treatment	1.118	0.0247	0.33	1.209	-0.0202	-0.28	0.0401	0.0928	1295084	CBDivE_000518	COc1ccc(cc1)C(=O)Nc2ccc(OC)cc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J19	compound treatment	1.086	-0.00733	-0.1	1.189	-0.0402	-0.55	-0.458	-0.8213	1467312	CBDivE_000519	Cc1ccccc1NC(=O)CCC(=O)OC2CCC(CC2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	J20	compound treatment	1.055	-0.0383	-0.52	1.191	-0.0382	-0.52	-0.7344	-1.0	1658667	CBDivE_000520	O=C(N1CCN(CC1)C(=O)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K01	compound treatment	1.074	-0.0193	-0.26	1.222	-0.00724	-0.1	-0.2543	-0.9117	1912627	CBDivE_000521	ClC(=C(Cl)COC(=O)CCC(=O)Nc1ccccc1)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K02	compound treatment	1.144	0.0507	0.68	1.292	0.0628	0.86	1.0885	0.9938	1912628	CBDivE_000522	C/C(=N\O)/c1ccc2ccccc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K03	compound treatment	1.074	-0.0193	-0.26	1.174	-0.0552	-0.75	-0.7171	-0.8995	1912629	CBDivE_000523	Fc1cccc(NC(=O)CCC(=O)OCC(=C(Cl)Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K04	compound treatment	1.046	-0.0473	-0.64	1.171	-0.0582	-0.79	-1.0131	-0.9941	1912630	CBDivE_000524	CCOC(=O)c1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K05	compound treatment	1.074	-0.0193	-0.26	1.214	-0.0152	-0.21	-0.3314	-0.9937	1912631	CBDivE_000525	[O-][N+](=O)c1ccccc1NC(=O)c2ccccc2C(=O)OCC(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K06	compound treatment	1.109	0.0157	0.21	1.239	0.00976	0.13	0.2435	0.9751	1912632	CBDivE_000526	Oc1ccccc1/C=N/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K07	compound treatment	1.053	-0.0403	-0.54	1.167	-0.0622	-0.85	-0.9849	-0.9769	1912633	CBDivE_000527	CCC(C)c1cc(cc([N+](=O)[O-])c1OC(=O)OC(C)C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K08	compound treatment	1.061	-0.0323	-0.44	1.205	-0.0242	-0.33	-0.5422	-0.9907	1912634	CBDivE_000528	COc1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K09	compound treatment	1.073	-0.0203	-0.27	1.176	-0.0532	-0.73	-0.7074	-0.9114	1912635	CBDivE_000529	COc1ccc(cc1)C(=O)/C=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K10	compound treatment	1.108	0.0147	0.2	1.163	-0.0662	-0.9	-0.4988	-0.5394	1912636	CBDivE_000530	COc1ccc(/C=N/c2ccc(C)c(\N=C\c3ccc(OC)cc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K11	compound treatment	1.089	-0.00433	-0.06	1.153	-0.0762	-1.04	-0.7765	-0.7457	1912637	CBDivE_000531	CC(=O)Oc1ccc2ccccc2c1C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K12	compound treatment	1.077	-0.0163	-0.22	1.177	-0.0522	-0.71	-0.6596	-0.8845	1912638	CBDivE_000532	COc1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K13	compound treatment	1.055	-0.0383	-0.52	1.174	-0.0552	-0.75	-0.8983	-0.9831	1912639	CBDivE_000533	Cc1ccc(/C=N/NC(=O)c2ccccc2O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K14	compound treatment	1.117	0.0237	0.32	1.235	0.00576	0.08	0.2813	0.8554	1124348	CBDivE_000534	COc1ccc(cc1)C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K15	compound treatment	1.152	0.0587	0.79	1.229	-2.45E-4	0.0	0.5573	0.7041	1912640	CBDivE_000535	CC(=O)c1cccc(/N=C/c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K16	compound treatment	1.084	-0.00933	-0.13	1.217	-0.0122	-0.17	-0.2071	-0.9903	1912641	CBDivE_000536	FC(F)(F)C(Oc1nc(Nc2cccc3ccccc23)nc(OC(C(F)(F)F)C(F)(F)F)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K17	compound treatment	0.998	-0.0953	-1.29	1.101	-0.128	-1.75	-2.146	-0.9886	1912642	CBDivE_000537	Cc1ccccc1/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K18	compound treatment	1.053	-0.0403	-0.54	1.216	-0.0132	-0.18	-0.5124	-0.8939	1912643	CBDivE_000538	CCOC(=O)c1ccc(/N=C/c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K19	compound treatment	1.022	-0.0713	-0.96	1.186	-0.0432	-0.59	-1.0974	-0.9724	1912644	CBDivE_000539	CN(C)c1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	K20	compound treatment	1.057	-0.0363	-0.49	1.231	0.00176	0.02	-0.3296	-0.6718	1912645	CBDivE_000540	CC(=O)n1nc(C)cc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L01	compound treatment	1.121	0.0277	0.37	1.291	0.0618	0.84	0.8594	0.933	1912646	CBDivE_000541	O=C(Nc1cccc2ccccc12)c3ccccc3C(=O)N(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L02	compound treatment	1.145	0.0517	0.7	1.265	0.0358	0.49	0.8377	0.9847	1912647	CBDivE_000542	COc1ccc2[nH]cc(CCN3C(=O)C=C(C)C3=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L03	compound treatment	1.105	0.0117	0.16	1.232	0.00276	0.04	0.1379	0.852	1374599	CBDivE_000543	Clc1ccc(OCC(=O)NCc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L04	compound treatment	1.101	0.00767	0.1	1.209	-0.0202	-0.28	-0.1221	-0.414	1912648	CBDivE_000544	CCCOc1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L05	compound treatment	1.148	0.0547	0.74	1.195	-0.0342	-0.47	0.1913	0.2192	1081834	CBDivE_000545	Clc1ccc(OCC(=O)Nc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L06	compound treatment	1.09	-0.00333	-0.04	1.213	-0.0162	-0.22	-0.1884	-0.8336	1875934	CBDivE_000546	CC(C)Oc1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L07	compound treatment	1.105	0.0117	0.16	1.254	0.0248	0.34	0.35	0.9397	1514679	CBDivE_000547	Clc1ccc(OCC(=O)N2CCOCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L08	compound treatment	1.113	0.0197	0.27	1.132	-0.0972	-1.33	-0.75	-0.5546	1610373	CBDivE_000548	Clc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L09	compound treatment	1.072	-0.0213	-0.29	1.23	7.55E-4	0.01	-0.1962	-0.6814	1205331	CBDivE_000549	Clc1ccc(OCC(=O)Nc2cccc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L10	compound treatment	1.052	-0.0413	-0.56	1.249	0.0198	0.27	-0.2038	-0.3291	1912649	CBDivE_000550	CN(C)Cc1c(OC(=O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L11	compound treatment	1.1	0.00667	0.09	1.24	0.0108	0.15	0.1673	0.9725	1712550	CBDivE_000551	Clc1ccc(OCC(=O)N(c2ccccc2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L12	compound treatment	1.026	-0.0673	-0.91	1.255	0.0258	0.35	-0.3939	-0.4045	1124099	CBDivE_000552	COc1ccc(cc1)C(=O)N2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L13	compound treatment	1.121	0.0277	0.37	1.243	0.0138	0.19	0.3966	0.9493	1377883	CBDivE_000553	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L14	compound treatment	1.002	-0.0913	-1.23	1.238	0.00876	0.12	-0.7868	-0.6356	1677396	CBDivE_000554	COc1ccc(cc1)C(=O)Nc2ccc(OCC(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L15	compound treatment	1.094	6.69E-4	0.01	1.178	-0.0512	-0.7	-0.4877	-0.6979	1912650	CBDivE_000555	CC(=O)c1ccc(NC(=O)c2ccccc2C(=O)Nc3ccc(cc3)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L16	compound treatment	1.016	-0.0773	-1.04	1.213	-0.0162	-0.22	-0.8943	-0.8386	1912651	CBDivE_000556	CC(C)(C)N(Cc1ccc(Cl)cc1Cl)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L17	compound treatment	1.113	0.0197	0.27	1.225	-0.00424	-0.06	0.1467	0.5402	1912652	CBDivE_000557	CC(NC(=O)CCCN1C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L18	compound treatment	1.073	-0.0203	-0.27	1.217	-0.0122	-0.17	-0.312	-0.9717	1912653	CBDivE_000558	COc1cc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L19	compound treatment	1.128	0.0347	0.47	1.2	-0.0292	-0.4	0.0487	0.0793	1912654	CBDivE_000559	COc1ccc(CN(C(=O)c2ccc(cc2)[N+](=O)[O-])C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	L20	compound treatment	1.085	-0.00833	-0.11	1.189	-0.0402	-0.55	-0.4675	-0.8346	1743039	CBDivE_000560	CC(Cc1c[nH]c2ccccc12)N3C(=O)CCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M01	compound treatment	1.102	0.00867	0.12	1.27	0.0408	0.56	0.4757	0.8376	1912655	CBDivE_000561	[O-][N+](=O)c1ccc(/C=N/c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M02	compound treatment	1.138	0.0447	0.6	1.227	-0.00224	-0.03	0.4045	0.6703	1912656	CBDivE_000562	COc1ccc(/C=N/c2ccccc2C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M03	compound treatment	1.117	0.0237	0.32	1.221	-0.00824	-0.11	0.1463	0.4321	1912657	CBDivE_000563	CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M04	compound treatment	1.059	-0.0343	-0.46	1.208	-0.0212	-0.29	-0.5323	-0.9745	1912658	CBDivE_000564	COc1ccc(/C=N/c2ccccc2C#N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M05	compound treatment	1.044	-0.0493	-0.67	1.171	-0.0582	-0.79	-1.0322	-0.9961	1912659	CBDivE_000565	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M06	compound treatment	1.074	-0.0193	-0.26	1.207	-0.0222	-0.3	-0.3989	-0.9972	1912660	CBDivE_000566	CN(C)c1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M07	compound treatment	1.046	-0.0473	-0.64	1.212	-0.0172	-0.24	-0.6178	-0.9079	1912661	CBDivE_000567	CCOC(=O)c1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M08	compound treatment	1.107	0.0137	0.18	1.232	0.00276	0.04	0.157	0.8341	1912662	CBDivE_000568	Oc1ccc(/N=C/c2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M09	compound treatment	1.045	-0.0483	-0.65	1.155	-0.0742	-1.01	-1.1769	-0.9773	1912663	CBDivE_000569	Cc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M10	compound treatment	1.091	-0.00233	-0.03	1.189	-0.0402	-0.55	-0.4103	-0.7464	1912664	CBDivE_000570	Cc1cc(ccc1/N=C/c2ccccc2F)c3ccc(/N=C/c4ccccc4F)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M11	compound treatment	1.056	-0.0373	-0.5	1.243	0.0138	0.19	-0.2235	-0.4158	1912665	CBDivE_000571	CCOc1ccc(cc1)C2N(CCN2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M12	compound treatment	1.098	0.00467	0.06	1.182	-0.0472	-0.64	-0.411	-0.6349	1912666	CBDivE_000572	Fc1ccccc1/C=N/c2nccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M13	compound treatment	1.071	-0.0223	-0.3	1.163	-0.0662	-0.9	-0.8518	-0.8945	1912667	CBDivE_000573	COC(=O)c1ccccc1/N=C/c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M14	compound treatment	1.075	-0.0183	-0.25	1.214	-0.0152	-0.21	-0.3219	-0.9963	1912668	CBDivE_000574	CN(C)c1ccc(/C=N/c2ccc(cc2)c3ccc(\N=C\c4ccc(cc4)N(C)C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M15	compound treatment	1.081	-0.0123	-0.17	1.232	0.00276	0.04	-0.0911	-0.5339	1912669	CBDivE_000575	COc1ccc(/N=C/c2c(O)ccc3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M16	compound treatment	1.075	-0.0183	-0.25	1.295	0.0658	0.9	0.4592	0.4937	1912670	CBDivE_000576	CN(C)c1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M17	compound treatment	1.064	-0.0293	-0.4	1.196	-0.0332	-0.45	-0.6004	-0.9977	1912671	CBDivE_000577	Oc1ccc2ccccc2c1/C=N/c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M18	compound treatment	1.082	-0.0113	-0.15	1.192	-0.0372	-0.51	-0.4672	-0.8809	1912672	CBDivE_000578	CN(C)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M19	compound treatment	1.046	-0.0473	-0.64	1.228	-0.00124	-0.02	-0.4635	-0.7256	1912673	CBDivE_000579	Oc1ccc2ccccc2c1/C=N/c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	M20	compound treatment	1.111	0.0177	0.24	1.258	0.0288	0.39	0.4458	0.9715	1912674	CBDivE_000580	CN(C)c1ccc(/C=N/c2ccc(Cc3ccc(\N=C\c4ccc(cc4)N(C)C)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N01	compound treatment	1.111	0.0177	0.24	1.184	-0.0452	-0.62	-0.2677	-0.4048	1912675	CBDivE_000581	OC(=O)COc1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N02	compound treatment	1.125	0.0317	0.43	1.207	-0.0222	-0.3	0.0876	0.1672	1912676	CBDivE_000582	CCOC(=O)/C(=C/c1c[nH]c2ccccc12)/NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N03	compound treatment	1.097	0.00367	0.05	1.197	-0.0322	-0.44	-0.2759	-0.6236	1912677	CBDivE_000583	CCC1(CC)C(=O)NC(=O)N(C(=O)c2ccccc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N04	compound treatment	1.074	-0.0193	-0.26	1.18	-0.0492	-0.67	-0.6592	-0.9151	1535492	CBDivE_000584	COc1ccc2[nH]cc(CCN3C(=O)CCC3=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N05	compound treatment	1.068	-0.0253	-0.34	1.221	-0.00824	-0.11	-0.3211	-0.8927	1410589	CBDivE_000585	CC(C)Cc1ccc(cc1)C(C)C(=O)NC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N06	compound treatment	1.024	-0.0693	-0.94	1.181	-0.0482	-0.66	-1.1266	-0.9852	1912678	CBDivE_000586	C/C(=C\C(=O)NCCc1c[nH]c2ccccc12)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N07	compound treatment	1.041	-0.0523	-0.71	1.149	-0.0802	-1.09	-1.273	-0.9775	1606035	CBDivE_000587	O=C(Nc1ccc(OCc2ccccc2)cc1)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N08	compound treatment	1.045	-0.0483	-0.65	1.123	-0.106	-1.45	-1.4855	-0.935	1563376	CBDivE_000588	OC(=O)COc1ccc(NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N09	compound treatment	1.042	-0.0513	-0.69	1.132	-0.0972	-1.33	-1.4273	-0.9541	1476162	CBDivE_000589	COc1ccc(cc1)C(=O)Oc2cc(C)cc(OC(=O)c3ccc(OC)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N10	compound treatment	1.049	-0.0443	-0.6	1.224	-0.00524	-0.07	-0.4735	-0.7861	1912679	CBDivE_000590	[O-][N+](=O)c1ccc(cc1)C(=O)OCCOc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N11	compound treatment	1.078	-0.0153	-0.21	1.204	-0.0252	-0.34	-0.3897	-0.9703	1613661	CBDivE_000591	O=C(Nc1ccc(cc1)c2ccc(NC(=O)c3ccco3)cc2)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N12	compound treatment	1.016	-0.0773	-1.04	1.185	-0.0442	-0.6	-1.1643	-0.9661	1912680	CBDivE_000592	CC1=CC(=O)N(CCc2c[nH]c3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N13	compound treatment	1.076	-0.0173	-0.23	1.192	-0.0372	-0.51	-0.5245	-0.938	1564697	CBDivE_000593	O=C(Oc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1)C5CC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N14	compound treatment	1.088	-0.00533	-0.07	1.21	-0.0192	-0.26	-0.2364	-0.8689	1568877	CBDivE_000594	CCC(=O)Oc1ccc(CNC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N15	compound treatment	1.012	-0.0813	-1.1	1.244	0.0148	0.2	-0.6336	-0.568	1387712	CBDivE_000595	COC(=O)c1cc(OC)c(OC)cc1NC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N16	compound treatment	1.113	0.0197	0.27	1.189	-0.0402	-0.55	-0.2004	-0.3288	1912681	CBDivE_000596	CC(Cc1c[nH]c2ccccc12)NC(=O)OCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N17	compound treatment	1.088	-0.00533	-0.07	1.229	-2.45E-4	0.0	-0.0532	-0.7391	1338376	CBDivE_000597	COc1ccc(cc1)C(=O)Nc2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N18	compound treatment	1.049	-0.0443	-0.6	1.246	0.0168	0.23	-0.2613	-0.4082	1912682	CBDivE_000598	CC(=O)SC(C[N+](=O)[O-])c1cn(C(=O)C)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N19	compound treatment	1.105	0.0117	0.16	1.204	-0.0252	-0.34	-0.1321	-0.349	1912683	CBDivE_000599	Cc1ccccc1N=Nc2ccc(NC(=O)c3ccccc3)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	N20	compound treatment	1.065	-0.0283	-0.38	1.178	-0.0512	-0.7	-0.7644	-0.9597	1912684	CBDivE_000600	COc1ccc(N/N=C/2\CCCNC2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O01	compound treatment	1.086	-0.00733	-0.1	1.265	0.0358	0.49	0.2748	0.5524	1912685	CBDivE_000601	Cc1ccc(/N=C/2\C(=O)Nc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O02	compound treatment	1.079	-0.0143	-0.19	1.306	0.0768	1.05	0.6034	0.5669	1912686	CBDivE_000602	CN(C)c1ccc(/C=N/c2nccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O03	compound treatment	1.084	-0.00933	-0.13	1.226	-0.00324	-0.04	-0.1203	-0.9016	1912687	CBDivE_000603	O=C(N/N=C/c1cccnc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O04	compound treatment	1.116	0.0227	0.31	1.246	0.0168	0.23	0.3778	0.9897	1912688	CBDivE_000604	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O05	compound treatment	1.118	0.0247	0.33	1.245	0.0158	0.21	0.3872	0.9776	1912689	CBDivE_000605	O=C(N/N=C/c1cccnc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O06	compound treatment	1.123	0.0297	0.4	1.255	0.0258	0.35	0.5314	0.9979	1912690	CBDivE_000606	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O07	compound treatment	1.013	-0.0803	-1.08	1.231	0.00176	0.02	-0.7494	-0.6913	1912691	CBDivE_000607	[O-][N+](=O)c1ccc(N/N=C/c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O08	compound treatment	1.145	0.0517	0.7	1.292	0.0628	0.86	1.098	0.9948	1912692	CBDivE_000608	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O09	compound treatment	1.144	0.0507	0.68	1.304	0.0748	1.02	1.2042	0.9811	1912693	CBDivE_000609	CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O10	compound treatment	1.137	0.0437	0.59	1.264	0.0348	0.47	0.7517	0.9942	1912694	CBDivE_000610	C/C(=N\NC(=O)Nc1ccccc1)/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O11	compound treatment	1.02	-0.0733	-0.99	1.221	-0.00824	-0.11	-0.779	-0.7824	1912695	CBDivE_000611	CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O12	compound treatment	1.129	0.0357	0.48	1.284	0.0548	0.75	0.8682	0.9774	1912696	CBDivE_000612	Oc1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O13	compound treatment	1.024	-0.0693	-0.94	1.205	-0.0242	-0.33	-0.8951	-0.9023	1912697	CBDivE_000613	CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O14	compound treatment	1.126	0.0327	0.44	1.244	0.0148	0.2	0.4539	0.9369	1912698	CBDivE_000614	C/C(=N\NC(=O)c1ccccc1O)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O15	compound treatment	1.17	0.0767	1.03	1.242	0.0128	0.17	0.8544	0.8146	1912699	CBDivE_000615	Oc1ccccc1C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O16	compound treatment	1.095	0.00167	0.02	1.218	-0.0112	-0.15	-0.0925	-0.5969	1912700	CBDivE_000616	CC/C(=N\NC(=O)Nc1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O17	compound treatment	1.136	0.0427	0.58	1.214	-0.0152	-0.21	0.26	0.4249	1912701	CBDivE_000617	Oc1ccc(/N=C/c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O18	compound treatment	1.063	-0.0303	-0.41	1.245	0.0158	0.21	-0.1374	-0.2973	1912702	CBDivE_000618	COc1ccc(/C=N/NC(=O)Nc2ccccc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O19	compound treatment	1.078	-0.0153	-0.21	1.228	-0.00124	-0.02	-0.1582	-0.7626	1912703	CBDivE_000619	CCN(CC)c1ccc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	O20	compound treatment	1.161	0.0677	0.91	1.268	0.0388	0.53	1.0192	0.9662	1912704	CBDivE_000620	Oc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P01	compound treatment	1.101	0.00767	0.1	1.218	-0.0112	-0.15	-0.0353	-0.1907	1534077	CBDivE_000621	O=C1CCC(=O)N1CCc2c[nH]c3ccc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P02	compound treatment	1.113	0.0197	0.27	1.248	0.0188	0.26	0.3685	0.9998	1144814	CBDivE_000622	CCOC(=O)c1c(C)[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P03	compound treatment	1.003	-0.0903	-1.22	1.207	-0.0222	-0.3	-1.0762	-0.857	1668491	CBDivE_000623	OCC(NCc1ccccc1)C#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P04	compound treatment	1.115	0.0217	0.29	1.161	-0.0682	-0.93	-0.4513	-0.4627	1912705	CBDivE_000624	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)OCC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P05	compound treatment	1.079	-0.0143	-0.19	1.181	-0.0482	-0.66	-0.6019	-0.8778	1385156	CBDivE_000625	OC(=O)C#CCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P06	compound treatment	1.058	-0.0353	-0.48	1.216	-0.0132	-0.18	-0.4647	-0.9118	1912706	CBDivE_000626	CC(=O)N/C(=C\c1c[nH]c2ccccc12)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P07	compound treatment	1.03	-0.0633	-0.85	1.124	-0.105	-1.44	-1.6189	-0.9693	1912707	CBDivE_000627	CC(C)(O)C(=O)/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P08	compound treatment	1.132	0.0387	0.52	1.237	0.00776	0.11	0.4437	0.8335	1785248	CBDivE_000628	CC(=O)n1cc(/C=C(\C)/[N+](=O)[O-])c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P09	compound treatment	1.097	0.00367	0.05	1.279	0.0498	0.68	0.5148	0.7567	1912708	CBDivE_000629	OC(=O)/C=C(\Oc1ccccc1)/C2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P10	compound treatment	1.048	-0.0453	-0.61	1.171	-0.0582	-0.79	-0.994	-0.9917	1441843	CBDivE_000630	CCOC(=O)CC(=O)c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P11	compound treatment	1.019	-0.0743	-1.0	1.183	-0.0462	-0.63	-1.155	-0.975	1912709	CBDivE_000631	COC(=O)/C=C(\Oc1ccccc1)/C2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P12	compound treatment	1.107	0.0137	0.18	1.207	-0.0222	-0.3	-0.0841	-0.2369	1912710	CBDivE_000632	NC(=S)CCCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P13	compound treatment	1.031	-0.0623	-0.84	1.211	-0.0182	-0.25	-0.7705	-0.8787	1649045	CBDivE_000633	CC1CC2(C)CC(C1C(=O)O)C(=O)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P14	compound treatment	1.124	0.0307	0.41	1.179	-0.0502	-0.69	-0.1919	-0.2398	1287759	CBDivE_000634	CN1CCN(CC1)C(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P15	compound treatment	1.13	0.0367	0.49	1.201	-0.0282	-0.39	0.0774	0.1235	1912711	CBDivE_000635	CC(C)C1=CCC(C(C1)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P16	compound treatment	1.119	0.0257	0.35	1.218	-0.0112	-0.15	0.1364	0.3603	1447804	CBDivE_000636	COc1ccc2[nH]cc(CCNC(=O)N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P17	compound treatment	1.167	0.0737	0.99	1.313	0.0838	1.14	1.5104	0.9976	1912712	CBDivE_000637	CC1=CC(C)(C)C(C(C1)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P18	compound treatment	1.047	-0.0463	-0.63	1.176	-0.0532	-0.73	-0.9554	-0.9972	1546922	CBDivE_000638	OC(COc1ccccc1)Cn2ccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P19	compound treatment	1.074	-0.0193	-0.26	1.175	-0.0542	-0.74	-0.7075	-0.902	1086128	CBDivE_000639	C(N1CCN(Cc2ccccc2)C1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.2	P20	compound treatment	1.06	-0.0333	-0.45	1.243	0.0138	0.19	-0.1853	-0.3804	1132083	CBDivE_000640	NC(=O)CCCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A01	compound treatment	1.121	-0.00479	-0.06	1.134	-0.00749	-0.1	-0.1179	-0.9756	1296062	CBDivE_006081	CC(c1c(O)c2ccccc2oc1=O)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A02	compound treatment	1.092	-0.0338	-0.46	1.17	0.0285	0.39	-0.0474	-0.0792	1777874	CBDivE_006082	Nc1ccc(cc1)C(=O)Nc2ccc(cc2)c3nc4ccc(NC(=O)c5ccc(N)cc5)c(Cl)c4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A03	compound treatment	1.142	0.0162	0.22	1.173	0.0315	0.43	0.4585	0.9509	1315455	CBDivE_006083	CC(=O)Oc1ccccc1N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A04	compound treatment	1.16	0.0342	0.46	1.138	-0.00349	-0.05	0.2927	0.6308	1916452	CBDivE_006084	CCOC(=O)c1c(CN2CCOCC2)n(c3ccccc3)c4ccc(OS(=O)(=O)c5ccc(C)cc5)cc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A05	compound treatment	1.101	-0.0248	-0.33	1.17	0.0285	0.39	0.0384	0.0749	1916453	CBDivE_006085	Oc1ccccc1/C=N/c2ccc(N=Nc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A06	compound treatment	1.134	0.00821	0.11	1.177	0.0355	0.48	0.4207	0.847	1916454	CBDivE_006086	COc1ccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A07	compound treatment	1.096	-0.0298	-0.4	1.156	0.0145	0.2	-0.1443	-0.3221	2827	CBDivE_006087	CN1CCCC(=C(c2cccs2)c3cccs3)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A08	compound treatment	1.139	0.0132	0.18	1.17	0.0285	0.39	0.4009	0.9374	1916455	CBDivE_006088	CCN1C(=O)/C(=C\2/CCCN2)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A09	compound treatment	1.097	-0.0288	-0.39	1.113	-0.0285	-0.39	-0.5494	-1.0	1916456	CBDivE_006089	COc1ccc(CCN(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A10	compound treatment	1.142	0.0162	0.22	1.159	0.0175	0.24	0.3235	0.999	1916457	CBDivE_006090	OC(=O)c1ccccc1NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A11	compound treatment	1.139	0.0132	0.18	1.164	0.0225	0.31	0.3431	0.9665	1916458	CBDivE_006091	CC1(CC1C(=O)NNC(=O)CCC(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A12	compound treatment	1.188	0.0622	0.84	1.148	0.00651	0.09	0.6562	0.7776	1189737	CBDivE_006092	CC(=O)NC(CC(=O)O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A13	compound treatment	1.152	0.0262	0.35	1.169	0.0275	0.38	0.5153	0.9996	1916459	CBDivE_006093	CCc1nc2ccccc2c(NC(=O)CN(C)C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A14	compound treatment	1.148	0.0222	0.3	1.142	5.09E-4	0.01	0.2168	0.7233	1916460	CBDivE_006094	CCCCOC(C(=O)OC(C)CN(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A15	compound treatment	1.084	-0.0418	-0.56	1.141	-4.91E-4	-0.01	-0.4034	-0.7154	1916461	CBDivE_006095	OCCN1CCN(CCCN2c3ccccc3Sc4ccccc24)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A16	compound treatment	1.162	0.0362	0.49	1.146	0.00451	0.06	0.3889	0.7899	1618263	CBDivE_006096	CC(C)N(C(C)C)S(=NS(=O)(=O)c1ccccc1)N(C(C)C)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A17	compound treatment	1.096	-0.0298	-0.4	1.161	0.0195	0.27	-0.0961	-0.1993	1916462	CBDivE_006097	Cc1cc(NC(=O)CN2CCCCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A18	compound treatment	1.168	0.0422	0.57	1.17	0.0285	0.39	0.6775	0.9827	1916463	CBDivE_006098	Cc1cc2c(C)cc[n+](CCCS(=O)(=O)O)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A19	compound treatment	1.139	0.0132	0.18	1.105	-0.0365	-0.5	-0.2258	-0.4273	1916464	CBDivE_006099	CN1CCc2c1nc3ccccc3c2NC(=O)CNCCc4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	A20	compound treatment	1.129	0.00321	0.04	1.186	0.0445	0.61	0.4598	0.7556	1916465	CBDivE_006100	OC(=O)CCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B01	compound treatment	1.129	0.00321	0.04	1.125	-0.0165	-0.22	-0.1284	-0.5607	1552490	CBDivE_006101	CC(=O)NC(Cc1cnc[nH]1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B02	compound treatment	1.128	0.00221	0.03	1.184	0.0425	0.58	0.431	0.7425	1443	CBDivE_006102	CN(C)CCOC(c1ccccc1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B03	compound treatment	1.132	0.00621	0.08	1.168	0.0265	0.36	0.3148	0.8485	1916466	CBDivE_006103	Nc1ccc(Oc2ccc(cc2)C3(c4ccccc4-c5ccccc53)c6ccc(Oc7ccc(N)cc7)cc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B04	compound treatment	1.177	0.0512	0.69	1.122	-0.0195	-0.27	0.3006	0.4061	1472447	CBDivE_006104	OC1(NC(=O)c2ccccc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B05	compound treatment	1.14	0.0142	0.19	1.115	-0.0265	-0.36	-0.1199	-0.2932	1916467	CBDivE_006105	O=C(CC(=O)N/N=C/c1ccco1)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B06	compound treatment	1.139	0.0132	0.18	1.154	0.0125	0.17	0.2466	0.9998	1916468	CBDivE_006106	O=C(CN1CCCCC1)Nc2c3CCN(Cc4ccccc4)c3nc5ccccc25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B07	compound treatment	1.096	-0.0298	-0.4	1.156	0.0145	0.2	-0.1443	-0.3221	1075430	CBDivE_006107	OCC(NC(=O)C(Cl)Cl)C(O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B08	compound treatment	1.139	0.0132	0.18	1.156	0.0145	0.2	0.2659	0.9986	1916469	CBDivE_006108	C(NCn1nnc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B09	compound treatment	1.103	-0.0228	-0.31	1.137	-0.00449	-0.06	-0.2607	-0.8316	1224001	CBDivE_006109	CCN1CCN(CC1)c2cc3N(C)c4ccccc4Oc3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B10	compound treatment	1.161	0.0352	0.47	1.126	-0.0155	-0.21	0.1865	0.3588	1164162	CBDivE_006110	CC1(C)C(CCC1(C)C(=O)O)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B11	compound treatment	1.09	-0.0358	-0.48	1.203	0.0615	0.84	0.2517	0.2601	1916470	CBDivE_006111	[O-][N+](=O)c1c(NCCCc2ccccc2)ccc3nsnc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B12	compound treatment	1.183	0.0572	0.77	1.177	0.0355	0.48	0.8881	0.9748	1617173	CBDivE_006112	CC(=O)Oc1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B13	compound treatment	1.134	0.00821	0.11	1.117	-0.0245	-0.33	-0.1578	-0.4486	1916471	CBDivE_006113	CN1C(=O)N(C)C(=O)C(=NNc2ccc(cc2)[N+](=O)[O-])C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B14	compound treatment	1.08	-0.0458	-0.62	1.114	-0.0275	-0.37	-0.7019	-0.9713	1916472	CBDivE_006114	COc1ccc(cc1)C(=O)c2coc-3c2C(=O)C(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B15	compound treatment	1.173	0.0472	0.64	1.146	0.00451	0.06	0.4938	0.7718	1708697	CBDivE_006115	Cc1ccc(cc1)S(=O)(=O)NCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B16	compound treatment	1.174	0.0482	0.65	1.129	-0.0125	-0.17	0.3394	0.5049	1473956	CBDivE_006116	OC(=O)c1ccc(cc1C(=O)O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B17	compound treatment	1.129	0.00321	0.04	1.119	-0.0225	-0.31	-0.1862	-0.6013	1916473	CBDivE_006117	COc1ccccc1N2CCN(CC(=O)Nc3cc(C)nc4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B18	compound treatment	1.166	0.0402	0.54	1.136	-0.00549	-0.07	0.3306	0.6038	1463092	CBDivE_006118	COc1ccc(cc1)N(C(C)C2CC2)C(=O)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B19	compound treatment	1.181	0.0552	0.74	1.156	0.0145	0.2	0.6666	0.8649	1916474	CBDivE_006119	CCc1nc2ccccc2c(NC(=O)CN3CCN(CC3)C(=O)c4ccco4)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	B20	compound treatment	1.171	0.0452	0.61	1.142	5.09E-4	0.01	0.4362	0.7151	1364308	CBDivE_006120	CN(C)Cc1cc(CN(C)C)c(O)c(n1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C01	compound treatment	1.139	0.0132	0.18	1.143	0.00151	0.02	0.1406	0.7836	1916475	CBDivE_006121	Oc1c(C(c2ccccc2)c3c(O)c4ccccc4sc3=O)c(=O)sc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C02	compound treatment	1.255	0.129	1.74	1.188	0.0465	0.63	1.681	0.9063	1916476	CBDivE_006122	Cc1cc(NC(=O)CN2CCN(CC2)C(=O)c3ccco3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C03	compound treatment	1.148	0.0222	0.3	1.191	0.0495	0.68	0.6893	0.9332	1337844	CBDivE_006123	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C04	compound treatment	1.148	0.0222	0.3	1.129	-0.0125	-0.17	0.0914	0.2653	1173001	CBDivE_006124	CCOC(=O)c1c(C)n(C)c2cc(CN(C)C)c(O)c(CN(C)C)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C05	compound treatment	1.132	0.00621	0.08	1.1	-0.0415	-0.57	-0.3408	-0.5959	1273465	CBDivE_006125	O=C(Oc1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C06	compound treatment	1.145	0.0192	0.26	1.193	0.0515	0.7	0.6799	0.9082	1916477	CBDivE_006126	Clc1ccc(OCC(=O)O/N=C/c2ccco2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C07	compound treatment	1.134	0.00821	0.11	1.189	0.0475	0.65	0.5364	0.8161	1916478	CBDivE_006127	CCn1c(COC)c(c2ccccc2)c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C08	compound treatment	1.18	0.0542	0.73	1.2	0.0585	0.8	1.0813	0.9991	1916479	CBDivE_006128	O=C(CN1CCCC1=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C09	compound treatment	1.141	0.0152	0.21	1.169	0.0275	0.38	0.4103	0.9597	1657371	CBDivE_006129	COc1ccc(CCN(C)CCC(=O)Nc2c(C)cc(C)cc2C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C10	compound treatment	1.138	0.0122	0.16	1.146	0.00451	0.06	0.16	0.9098	1703138	CBDivE_006130	CC(=O)Nc1cccc(NC(=O)COc2ccccc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C11	compound treatment	1.137	0.0112	0.15	1.109	-0.0325	-0.44	-0.2064	-0.4408	1916480	CBDivE_006131	CC/C(=C\c1oc2ccc(OC)cc2[n+]1C)/C=C/3\Sc4ccccc4N3CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C12	compound treatment	1.205	0.0792	1.07	1.18	0.0385	0.53	1.1269	0.9465	1493571	CBDivE_006132	NC(=O)NC(CC(=O)O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C13	compound treatment	1.11	-0.0158	-0.21	1.145	0.00351	0.05	-0.1168	-0.5349	1916481	CBDivE_006133	OC(=O)CC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C14	compound treatment	1.155	0.0292	0.39	1.184	0.0425	0.58	0.6885	0.9823	1916482	CBDivE_006134	COC(C(=O)OC(C)CN(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C15	compound treatment	1.156	0.0302	0.41	1.138	-0.00349	-0.05	0.2545	0.6203	1916483	CBDivE_006135	CCc1nc2ccccc2c(NC(=O)CN(C)CCc3ccc(OC)c(OC)c3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C16	compound treatment	1.178	0.0522	0.7	1.2	0.0585	0.8	1.0622	0.9981	1916484	CBDivE_006136	CC1(C)CC(=C(C(CCCC(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O)C4C(=O)CC(C)(C)CC4=O)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C17	compound treatment	1.13	0.00421	0.06	1.148	0.00651	0.09	0.1029	0.9767	1916485	CBDivE_006137	CCN(CC)CC(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C18	compound treatment	1.092	-0.0338	-0.46	1.115	-0.0265	-0.36	-0.5778	-0.9934	1916486	CBDivE_006138	Cc1cccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C19	compound treatment	1.12	-0.00579	-0.08	1.176	0.0345	0.47	0.2775	0.5818	1916487	CBDivE_006139	CC(C)Cc1ccc(cc1)C(C)C(=O)N/N=C/c2c3ccccc3cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	C20	compound treatment	1.183	0.0572	0.77	1.157	0.0155	0.21	0.6953	0.8688	1916488	CBDivE_006140	CC(C)CC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D01	compound treatment	1.11	-0.0158	-0.21	1.164	0.0225	0.31	0.0664	0.1778	1343180	CBDivE_006141	O=C(Oc1cccc(OC(=O)c2ccccc2)c1OC(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D02	compound treatment	1.137	0.0112	0.15	1.183	0.0415	0.57	0.5072	0.8657	1307685	CBDivE_006142	Nc1ccc(C(=O)Nc2ccccc2C(=O)O)c(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D03	compound treatment	1.133	0.00721	0.1	1.149	0.00751	0.1	0.1412	0.9997	1916489	CBDivE_006143	O=C(c1ccc2C(=O)N(C(=O)c2c1)c3cccc4ccccc34)c5ccc6C(=O)N(C(=O)c6c5)c7cccc8ccccc78
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D04	compound treatment	1.091	-0.0348	-0.47	1.144	0.00251	0.03	-0.3077	-0.6538	1916490	CBDivE_006144	Oc1ccccc1/C=N/NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D05	compound treatment	1.178	0.0522	0.7	1.191	0.0495	0.68	0.9754	0.9998	1351970	CBDivE_006145	Oc1ccc(NCn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D06	compound treatment	1.124	-0.00179	-0.02	1.192	0.0505	0.69	0.47	0.6819	1916491	CBDivE_006146	CN(C)c1cc(NC(=O)CN2CCN(CC2)C(=O)c3ccco3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D07	compound treatment	1.129	0.00321	0.04	1.119	-0.0225	-0.31	-0.1862	-0.6013	3010927	CBDivE_006147	NCC(O)c1ccc(cc1)[N+](=O)[O-].OC(=O)c1ccccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D08	compound treatment	1.163	0.0372	0.5	1.161	0.0195	0.27	0.5431	0.9559	1916492	CBDivE_006148	Clc1ccc(/C=N/NC(=O)CC(=O)N\N=C\c2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D09	compound treatment	1.133	0.00721	0.1	1.151	0.00951	0.13	0.1605	0.99	1247012	CBDivE_006149	Cc1ccc(cc1)S(=O)(=O)N2CCn3c(C2)nc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D10	compound treatment	1.185	0.0592	0.8	1.153	0.0115	0.16	0.6758	0.8302	1916493	CBDivE_006150	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D11	compound treatment	1.174	0.0482	0.65	1.141	-4.91E-4	-0.01	0.4552	0.6998	1776236	CBDivE_006151	COC(=O)Nc1nc2ccc(cc2c(=O)[nH]1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D12	compound treatment	1.117	-0.00879	-0.12	1.165	0.0235	0.32	0.1428	0.4179	1916494	CBDivE_006152	Cc1ccc(cc1NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D13	compound treatment	1.166	0.0402	0.54	1.152	0.0105	0.14	0.4849	0.8643	1916495	CBDivE_006153	[O-][N+](=O)c1ccc(cc1)c2cc(n[nH]2)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D14	compound treatment	1.13	0.00421	0.06	1.158	0.0165	0.23	0.1993	0.8586	1916496	CBDivE_006154	Cc1ccc(cc1)C(=O)c2coc-3c2C(=O)C(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D15	compound treatment	1.122	-0.00379	-0.05	1.143	0.00151	0.02	-0.0216	-0.3919	1199439	CBDivE_006155	CC1(C)CC(=C(C(=O)C1)C2(O)C(=O)c3ccccc3C2=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D16	compound treatment	1.127	0.00121	0.02	1.126	-0.0155	-0.21	-0.1378	-0.6506	1359218	CBDivE_006156	OC(=O)c1ccccc1NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D17	compound treatment	1.151	0.0252	0.34	1.146	0.00451	0.06	0.284	0.8216	1916497	CBDivE_006157	COc1ccc(CCN(C)CC(=O)Nc2c3CCCc3nc4ccccc24)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D18	compound treatment	1.15	0.0242	0.33	1.148	0.00651	0.09	0.2937	0.8678	1916498	CBDivE_006158	CCOC(=O)c1c(NC(=O)CN(CC)CC)sc2CCCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D19	compound treatment	1.121	-0.00479	-0.06	1.168	0.0265	0.36	0.2099	0.5716	1916499	CBDivE_006159	COc1ccc(CCNCC(=O)Nc2cc(nc3ccccc23)N(C)C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	D20	compound treatment	1.156	0.0302	0.41	1.151	0.00951	0.13	0.3799	0.8882	1522012	CBDivE_006160	CN(C)Cc1cc(CN(C)C)c(O)c(n1)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E01	compound treatment	1.109	-0.0168	-0.23	1.053	-0.0885	-1.21	-1.0134	-0.8254	1916500	CBDivE_006161	CCC(=S)/C=C/1\Sc2ccc3ccccc3c2N1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E02	compound treatment	1.161	0.0352	0.47	1.208	0.0665	0.91	0.9772	0.9545	1916501	CBDivE_006162	COc1ccc(CCNCC(=O)Nc2cc(C)nc3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E03	compound treatment	1.122	-0.00379	-0.05	1.107	-0.0345	-0.47	-0.3687	-0.7794	1916502	CBDivE_006163	OCCN1CCN(CC1)c2ncccc2C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E04	compound treatment	1.137	0.0112	0.15	1.11	-0.0315	-0.43	-0.1967	-0.4321	1916503	CBDivE_006164	Cn1cnc([N+](=O)[O-])c1Sc2cn3CCCc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E05	compound treatment	1.132	0.00621	0.08	1.12	-0.0215	-0.29	-0.148	-0.4855	1916504	CBDivE_006165	Cc1ccccc1OCC(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)COc5ccccc5C)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E06	compound treatment	1.197	0.0712	0.96	1.203	0.0615	0.84	1.2724	0.9977	1916505	CBDivE_006166	C/C(=N/OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E07	compound treatment	1.085	-0.0408	-0.55	1.114	-0.0275	-0.37	-0.6542	-0.9825	1261424	CBDivE_006167	CC(=O)OC(OC(=O)C)c1cn(C(=O)C)c2nccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E08	compound treatment	1.15	0.0242	0.33	1.154	0.0125	0.17	0.3516	0.9541	1916506	CBDivE_006168	CN(C)/C=C/c1c([N+](=O)[O-])c2ccc(O)cc2n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E09	compound treatment	1.203	0.0772	1.04	1.168	0.0265	0.36	0.9921	0.8999	1114888	CBDivE_006169	OC(=O)c1ccccc1C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E10	compound treatment	1.137	0.0112	0.15	1.203	0.0615	0.84	0.7	0.8213	1428816	CBDivE_006170	COc1ccccc1NC(=O)C2CCC(C)(C(=O)O)C2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E11	compound treatment	1.097	-0.0288	-0.39	1.201	0.0595	0.81	0.2992	0.3325	1916507	CBDivE_006171	C/C(=C\c1sc2ccccc2[n+]1CCCS(=O)(=O)O)/C=C/3\Sc4ccccc4N3CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E12	compound treatment	1.128	0.00221	0.03	1.13	-0.0115	-0.16	-0.0897	-0.5625	1916508	CBDivE_006172	OC(=O)CCC(=O)NNC(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E13	compound treatment	1.062	-0.0638	-0.86	1.164	0.0225	0.31	-0.3915	-0.4285	1916509	CBDivE_006173	CCC/1(CC)C(=O)NC(=O)N\C1=N/CCc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E14	compound treatment	1.147	0.0212	0.29	1.167	0.0255	0.35	0.4483	0.9953	1916510	CBDivE_006174	Cc1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E15	compound treatment	1.111	-0.0148	-0.2	1.115	-0.0265	-0.36	-0.3965	-0.9609	3105945	CBDivE_006175	CC(C)(C)c1cc(CCC(=O)O)cc(c1O)C(C)(C)C.Nc1c2CCCc2nc3CCCc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E16	compound treatment	1.105	-0.0208	-0.28	1.116	-0.0255	-0.35	-0.4441	-0.9943	1916511	CBDivE_006176	CCCCN(CCCC)/C(=N/S(=O)(=O)Nc1ccccc1)/Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E17	compound treatment	1.109	-0.0168	-0.23	1.172	0.0305	0.42	0.134	0.2829	1916512	CBDivE_006177	CCc1nc2ccccc2c(NC(=O)CN3CCCC3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E18	compound treatment	1.142	0.0162	0.22	1.121	-0.0205	-0.28	-0.043	-0.1211	1774959	CBDivE_006178	Cc1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E19	compound treatment	1.114	-0.0118	-0.16	1.149	0.00751	0.1	-0.0401	-0.2118	1916513	CBDivE_006179	CC(=O)Oc1ccc(C(=O)O)c(c1)n2c(=O)c3ccc4c(=O)n(c5cc(OC(=O)C)ccc5C(=O)O)c(=O)c6ccc(c2=O)c3c46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	E20	compound treatment	1.118	-0.00779	-0.11	1.171	0.0295	0.4	0.2102	0.5055	351	CBDivE_006180	CC(C)NCC(O)COc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F01	compound treatment	1.061	-0.0648	-0.87	1.177	0.0355	0.48	-0.2757	-0.2759	1454193	CBDivE_006181	O=c1oc2ccccc2c(NCc3ccccc3)c1CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F02	compound treatment	1.095	-0.0308	-0.42	1.142	5.09E-4	0.01	-0.2888	-0.6952	1916514	CBDivE_006182	Cc1cc(O)c(C(=O)O)c2=C(=O)c3c(O)c(O)c(C4OC(CO)C(O)C(O)C4O)c(O)c3C(=O)=c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F03	compound treatment	1.125	-7.91E-4	-0.01	1.16	0.0185	0.25	0.1709	0.6766	1389573	CBDivE_006183	Cc1ccccc1OCNC(=O)c2cccc(NC(=O)c3ccccc3C(=O)O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F04	compound treatment	1.111	-0.0148	-0.2	1.154	0.0125	0.17	-0.0205	-0.078	1363954	CBDivE_006184	CCOC(=O)c1nc2ccccc2[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F05	compound treatment	1.152	0.0262	0.35	1.142	5.09E-4	0.01	0.2549	0.7209	1774505	CBDivE_006185	Cc1ccccc1NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F06	compound treatment	1.124	-0.00179	-0.02	1.121	-0.0205	-0.28	-0.2147	-0.7654	1916515	CBDivE_006186	CN1CCN(CC(=O)Nc2c3CCN(Cc4ccccc4)c3nc5ccccc25)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F07	compound treatment	1.132	0.00621	0.08	1.156	0.0145	0.2	0.1991	0.9268	1593690	CBDivE_006187	OC(=O)CNS(=O)(=O)c1cccc2nsnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F08	compound treatment	1.159	0.0332	0.45	1.154	0.0125	0.17	0.4374	0.9124	1916516	CBDivE_006188	ON(Cn1nnc2ccccc12)Cn3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F09	compound treatment	1.155	0.0292	0.39	1.176	0.0345	0.47	0.6114	0.9961	1330314	CBDivE_006189	CCN(CC)C(=O)N1CCN(CC1)c2ccc(Nc3ccnc4cc5ccccc5cc34)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F10	compound treatment	1.077	-0.0488	-0.66	1.111	-0.0305	-0.42	-0.7594	-0.9755	1916517	CBDivE_006190	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F11	compound treatment	1.107	-0.0188	-0.25	1.183	0.0415	0.57	0.221	0.3563	1153948	CBDivE_006191	OC(=O)CCNc1c(cnc2ccccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F12	compound treatment	1.136	0.0102	0.14	1.18	0.0385	0.53	0.4687	0.8634	1916518	CBDivE_006192	COc1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F13	compound treatment	1.137	0.0112	0.15	1.147	0.00551	0.08	0.1601	0.9479	1916519	CBDivE_006193	[O-][N+](=O)c1ccc(cc1)c2cc(n[nH]2)c3c4ccccc4cc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F14	compound treatment	1.166	0.0402	0.54	1.136	-0.00549	-0.07	0.3306	0.6038	1405391	CBDivE_006194	COc1ccc(OC)c(c1)C(=O)c2coc3ccc(O)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F15	compound treatment	1.149	0.0232	0.31	1.152	0.0105	0.14	0.3227	0.9372	1632632	CBDivE_006195	COc1cccc(c1)C(N)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F16	compound treatment	1.129	0.00321	0.04	1.139	-0.00249	-0.03	0.0066	0.1199	1916520	CBDivE_006196	Nc1ccc(cc1)C(=O)Oc2ccc(cc2)c3ccc(OC(=O)c4ccc(N)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F17	compound treatment	1.127	0.00121	0.02	1.164	0.0225	0.31	0.2286	0.7436	1504404	CBDivE_006197	CCOC(=O)c1c(oc2ccc(O)c(CN(C)C)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F18	compound treatment	1.183	0.0572	0.77	1.157	0.0155	0.21	0.6953	0.8688	1618734	CBDivE_006198	OC(=O)c1cc(Cc2ccc(NC(=O)Cc3ccccc3)c(c2)C(=O)O)ccc1NC(=O)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F19	compound treatment	1.142	0.0162	0.22	1.11	-0.0315	-0.43	-0.149	-0.3092	1916521	CBDivE_006199	CN1CCN(CC(=O)Nc2c3CCCc3nc4ccccc24)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	F20	compound treatment	1.105	-0.0208	-0.28	1.098	-0.0435	-0.59	-0.6177	-0.9415	1710369	CBDivE_006200	COc1ccc(CCc2nc(I)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G01	compound treatment	1.081	-0.0448	-0.6	1.064	-0.0775	-1.06	-1.1745	-0.9648	1916522	CBDivE_006201	COc1ccc2S/C(=C\C(=S)C)/N(CCCS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G02	compound treatment	1.132	0.00621	0.08	1.16	0.0185	0.25	0.2377	0.8938	1916523	CBDivE_006202	O=C(CNCCc1c[nH]c2ccccc12)Nc3c4CCCc4nc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G03	compound treatment	1.167	0.0412	0.56	1.158	0.0165	0.23	0.5523	0.9208	1774382	CBDivE_006203	OC(=O)c1cccc(NCN2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G04	compound treatment	1.119	-0.00679	-0.09	1.164	0.0225	0.31	0.1523	0.4753	1916524	CBDivE_006204	CCOC(=O)CSc1cn2CCCc2[n+]1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G05	compound treatment	1.099	-0.0268	-0.36	1.118	-0.0235	-0.32	-0.4821	-0.9982	1774843	CBDivE_006205	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Oc2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G06	compound treatment	1.112	-0.0138	-0.19	1.167	0.0255	0.35	0.1144	0.29	1916525	CBDivE_006206	Clc1ccc(OCC(=O)O/N=C/c2ccc(Br)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G07	compound treatment	1.111	-0.0148	-0.2	1.17	0.0285	0.39	0.1338	0.3062	1916526	CBDivE_006207	CC(=O)N1/C(=C/Nc2ccc(Cl)cc2)/C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G08	compound treatment	1.137	0.0112	0.15	1.164	0.0225	0.31	0.324	0.9468	1916527	CBDivE_006208	CN(C)Cc1c(O)ccc2c([N+](=O)[O-])c(/C=C/N(C)C)n(c3ccc(C)cc3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G09	compound treatment	1.16	0.0342	0.46	1.141	-4.91E-4	-0.01	0.3216	0.6968	1916528	CBDivE_006209	N/C(=C\c1sc2ccccc2[n+]1CCCS(=O)(=O)O)/C=C/3\Sc4ccccc4N3CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G10	compound treatment	1.104	-0.0218	-0.29	1.14	-0.00149	-0.02	-0.2222	-0.7542	1774549	CBDivE_006210	COC(=O)c1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G11	compound treatment	1.121	-0.00479	-0.06	1.151	0.00951	0.13	0.046	0.3174	1916529	CBDivE_006211	CCN1/C(=C/C(=C/c2sc3ccccc3[n+]2CCCS(=O)(=O)O)/OC)/Sc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G12	compound treatment	1.109	-0.0168	-0.23	1.143	0.00151	0.02	-0.1456	-0.6402	1916530	CBDivE_006212	CC(C)Oc1ccc(cc1)C(CC(=O)NN)NS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G13	compound treatment	1.152	0.0262	0.35	1.13	-0.0115	-0.16	0.1392	0.36	1916531	CBDivE_006213	OC(=O)CCC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G14	compound treatment	1.15	0.0242	0.33	1.113	-0.0285	-0.39	-0.0438	-0.0863	1916532	CBDivE_006214	Cc1ccc(NN=Nc2ccc3C(=O)c4ccccc4C(=O)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G15	compound treatment	1.16	0.0342	0.46	1.154	0.0125	0.17	0.447	0.9084	3105946	CBDivE_006215	CC(C)(C)c1cc(CCC(=O)O)cc(c1O)C(C)(C)C.Nc1c2CCCc2nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G16	compound treatment	1.183	0.0572	0.77	1.138	-0.00349	-0.05	0.5121	0.6622	1916533	CBDivE_006216	C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G17	compound treatment	1.145	0.0192	0.26	1.15	0.00851	0.12	0.2653	0.9343	1916534	CBDivE_006217	CCCC1(CCC)C(=O)NC(=NCCO)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G18	compound treatment	1.164	0.0382	0.52	1.188	0.0465	0.63	0.813	0.9947	1916535	CBDivE_006218	COc1ccccc1NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G19	compound treatment	1.163	0.0372	0.5	1.071	-0.0705	-0.96	-0.3247	-0.2995	1916536	CBDivE_006219	CC(=O)c1cccc(/N=C/c2c(O)ccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	G20	compound treatment	1.242	0.116	1.57	1.151	0.00951	0.13	1.2003	0.763	1916537	CBDivE_006220	C/C(=N/NC(=O)c1cc2ccccc2cc1O)/c3cc4cc(ccc4oc3=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H01	compound treatment	1.108	-0.0178	-0.24	1.133	-0.00849	-0.12	-0.2516	-0.9441	1916538	CBDivE_006221	Cc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccc(C)cc5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H02	compound treatment	1.091	-0.0348	-0.47	1.152	0.0105	0.14	-0.2305	-0.4698	1162874	CBDivE_006222	O=S(=O)(c1ccccc1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H03	compound treatment	1.127	0.00121	0.02	1.117	-0.0245	-0.33	-0.2246	-0.6718	1916539	CBDivE_006223	CCOC(=O)c1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H04	compound treatment	1.148	0.0222	0.3	1.17	0.0285	0.39	0.4868	0.9917	1413107	CBDivE_006224	Nc1ccc(C(=O)Nc2ccccc2)c(N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H05	compound treatment	1.129	0.00321	0.04	1.144	0.00251	0.03	0.0548	0.9932	1916540	CBDivE_006225	OC(=O)c1ccccc1NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H06	compound treatment	1.129	0.00321	0.04	1.143	0.00151	0.02	0.0452	0.9422	1268849	CBDivE_006226	OC(=O)c1cccc(NCn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H07	compound treatment	1.155	0.0292	0.39	1.129	-0.0125	-0.17	0.1582	0.3685	1916541	CBDivE_006227	O=C1CN(CCc2ccccc2)CC(=O)N1CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H08	compound treatment	1.145	0.0192	0.26	1.097	-0.0445	-0.61	-0.2458	-0.3725	1610442	CBDivE_006228	COC(=O)Nc1nc2cc3OCCOc3cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H09	compound treatment	1.14	0.0142	0.19	1.149	0.00751	0.1	0.208	0.9569	1916542	CBDivE_006229	[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc2ccc(Br)cc2C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H10	compound treatment	1.148	0.0222	0.3	1.156	0.0145	0.2	0.3518	0.9797	1916543	CBDivE_006230	CC(=O)Nc1ccc2C(=O)N(C(=O)c2c1)c3cccc(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H11	compound treatment	1.152	0.0262	0.35	1.139	-0.00249	-0.03	0.226	0.6363	1339213	CBDivE_006231	Oc1c(C(=O)Nc2ccc(Cl)cc2)c(=O)[nH]c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H12	compound treatment	1.128	0.00221	0.03	1.154	0.0125	0.17	0.1417	0.8183	1420902	CBDivE_006232	COc1ccc(OC)c(c1)C(=O)c2coc3cc(Br)c(O)c(Br)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H13	compound treatment	1.114	-0.0118	-0.16	1.127	-0.0145	-0.2	-0.2522	-0.9942	1916544	CBDivE_006233	[O-][N+](=O)c1ccc(cc1)c2cc([nH]n2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H14	compound treatment	1.156	0.0302	0.41	1.144	0.00251	0.03	0.3124	0.7638	1916545	CBDivE_006234	O=C(NNC(=O)C1CC1c2ccccc2)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H15	compound treatment	1.094	-0.0318	-0.43	1.145	0.00351	0.05	-0.2694	-0.6243	1916546	CBDivE_006235	COc1ccc(cc1)C(CC(=O)O)NC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H16	compound treatment	1.178	0.0522	0.7	1.154	0.0125	0.17	0.6187	0.8537	1916547	CBDivE_006236	[O-][N+](=O)C1C(=N)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H17	compound treatment	1.119	-0.00679	-0.09	1.06	-0.0815	-1.11	-0.8505	-0.7628	1916548	CBDivE_006237	CC(NCC(=O)Nc1cc(nc2ccccc12)N(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H18	compound treatment	1.134	0.00821	0.11	1.145	0.00351	0.05	0.1122	0.9296	1212389	CBDivE_006238	CCC(=O)c1ccc(OCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H19	compound treatment	1.114	-0.0118	-0.16	1.182	0.0405	0.55	0.2781	0.4838	1916549	CBDivE_006239	O=C(CN1CCN(CC1)C(=O)c2ccccc2)Nc3c4CCCc4nc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	H20	compound treatment	1.16	0.0342	0.46	1.153	0.0115	0.16	0.4373	0.8971	1358199	CBDivE_006240	CC(=O)Nc1cc(C)nc(C)c1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I01	compound treatment	1.061	-0.0648	-0.87	1.128	-0.0135	-0.18	-0.7481	-0.8376	1916550	CBDivE_006241	COc1ccc2sc(/C=C(/C)\SC)[n+](CCCS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I02	compound treatment	1.138	0.0122	0.16	1.139	-0.00249	-0.03	0.0925	0.5497	1916551	CBDivE_006242	CC(C)NCC(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I03	compound treatment	1.125	-7.91E-4	-0.01	1.103	-0.0385	-0.52	-0.3787	-0.7213	1279382	CBDivE_006243	Cc1ccccc1OCC(=O)Nc2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I04	compound treatment	1.103	-0.0228	-0.31	1.142	5.09E-4	0.01	-0.2125	-0.691	1916552	CBDivE_006244	CN(C)/C=C\1/N=C(c2ccccc2)c3cc(Cl)ccc3N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I05	compound treatment	1.147	0.0212	0.29	1.153	0.0115	0.16	0.3133	0.96	1581406	CBDivE_006245	Cc1ccccc1OCC(=O)Nc2cccc(c2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I06	compound treatment	1.149	0.0232	0.31	1.122	-0.0195	-0.27	0.0335	0.0815	1916553	CBDivE_006246	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I07	compound treatment	1.127	0.00121	0.02	1.149	0.00751	0.1	0.0839	0.8096	1916554	CBDivE_006247	[O-][N+](=O)c1ccc2nc3c(cc2c1)n(CCCN4CCCCC4)c5ccccc53
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I08	compound treatment	1.117	-0.00879	-0.12	1.269	0.128	1.74	1.1456	0.6574	1916555	CBDivE_006248	CC(=O)C(C(=O)C)C1=C(Cl)C(=O)C(=O)c2c(coc12)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I09	compound treatment	1.123	-0.00279	-0.04	1.152	0.0105	0.14	0.0747	0.5042	1916556	CBDivE_006249	CCN1/C(=C/c2ccc3ccccc3[n+]2CCCS(=O)(=O)O)/C=Cc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I10	compound treatment	1.123	-0.00279	-0.04	1.164	0.0225	0.31	0.1904	0.6158	1916557	CBDivE_006250	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I11	compound treatment	1.156	0.0302	0.41	1.132	-0.00949	-0.13	0.1967	0.4599	1580989	CBDivE_006251	OC(=O)CCCC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I12	compound treatment	1.062	-0.0638	-0.86	1.124	-0.0175	-0.24	-0.7772	-0.8703	1916558	CBDivE_006252	OC(C(=O)OCCN1CCOCC1)(c2ccc(Br)cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I13	compound treatment	1.136	0.0102	0.14	1.13	-0.0115	-0.16	-0.0134	-0.0643	1916559	CBDivE_006253	CCc1nc2ccccc2c(NC(=O)CN3CCCCC3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I14	compound treatment	1.106	-0.0198	-0.27	1.108	-0.0335	-0.46	-0.5117	-0.9673	1340916	CBDivE_006254	CC(C)OC(=O)C1=C(C)NC(=O)NC1c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I15	compound treatment	1.101	-0.0248	-0.33	1.082	-0.0595	-0.81	-0.8101	-0.9232	1916560	CBDivE_006255	CCN(CC)CC(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I16	compound treatment	1.093	-0.0328	-0.44	1.147	0.00551	0.08	-0.2597	-0.5787	1916561	CBDivE_006256	C/C(=N/NC(=O)C1CC1c2ccccc2)/CC(=O)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I17	compound treatment	1.101	-0.0248	-0.33	1.148	0.00651	0.09	-0.1737	-0.5021	1916562	CBDivE_006257	CCCC/1(CCC)C(=O)NC(=O)N\C1=N/CCc2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I18	compound treatment	1.092	-0.0338	-0.46	1.135	-0.00649	-0.09	-0.3849	-0.8289	1158776	CBDivE_006258	COc1c2ccoc2c(OC)c3oc(cc(=O)c13)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I19	compound treatment	1.152	0.0262	0.35	1.169	0.0275	0.38	0.5153	0.9996	1916563	CBDivE_006259	Cc1cc(NC(=O)CN2CCN(CC2)C(=O)c3ccccc3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	I20	compound treatment	1.128	0.00221	0.03	1.138	-0.00349	-0.05	-0.0126	-0.224	1916564	CBDivE_006260	CC(C)(C)OC(=O)C(N)CCCCNC(=O)OCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J01	compound treatment	1.113	-0.0128	-0.17	1.141	-4.91E-4	-0.01	-0.1267	-0.734	1471915	CBDivE_006261	Cc1ccccc1NC(=O)c2cccc(NC(=O)c3ccccc3C(=O)O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J02	compound treatment	1.146	0.0202	0.27	1.192	0.0505	0.69	0.6798	0.9177	1916565	CBDivE_006262	CN(C)c1ccc(/C=N/CC(O)C\N=C\c2ccc(cc2)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J03	compound treatment	0.959	-0.167	-2.25	1.074	-0.0675	-0.92	-2.2418	-0.9222	1352496	CBDivE_006263	Nc1ccc(C(=O)Nc2ccc(cc2)C(=O)O)c(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J04	compound treatment	1.129	0.00321	0.04	1.17	0.0285	0.39	0.3055	0.781	1687447	CBDivE_006264	Cc1ccc(cc1)S(=O)(=O)Nc2cc(C)ccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J05	compound treatment	1.154	0.0282	0.38	1.155	0.0135	0.18	0.3994	0.9446	3106632	CBDivE_006265	NCC(O)c1ccc(cc1)[N+](=O)[O-].OC(=O)CNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J06	compound treatment	1.15	0.0242	0.33	1.122	-0.0195	-0.27	0.043	0.1021	1916566	CBDivE_006266	Cc1cccc(NCn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J07	compound treatment	1.155	0.0292	0.39	1.186	0.0445	0.61	0.7078	0.9781	1496276	CBDivE_006267	O=C1N(CCC2=NCCc3ccccc23)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J08	compound treatment	1.115	-0.0108	-0.15	1.193	0.0515	0.7	0.3937	0.5489	1774701	CBDivE_006268	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J09	compound treatment	1.141	0.0152	0.21	1.124	-0.0175	-0.24	-0.0236	-0.0749	1916567	CBDivE_006269	CN1C(=O)N(C)C(=O)C(CC(=O)c2ccccc2)(CC(=O)c3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J10	compound treatment	1.154	0.0282	0.38	1.16	0.0185	0.25	0.4476	0.9801	1247627	CBDivE_006270	CC(=O)Nc1ccc(cc1)c2sc(c(c2c3ccccc3)c4ccccc4)c5ccc(NC(=O)C)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J11	compound treatment	1.137	0.0112	0.15	1.141	-4.91E-4	-0.01	0.1022	0.6752	1524934	CBDivE_006271	CCN1CCN(CC1)c2ccc(cc2)n3c(C)nc4cc5ccccc5cc4c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J12	compound treatment	1.15	0.0242	0.33	1.124	-0.0175	-0.24	0.0623	0.154	1916568	CBDivE_006272	[O-][N+](=O)c1ccc2n(Cc3ccccc3)c4cc[n+]([O-])cc4c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J13	compound treatment	1.152	0.0262	0.35	1.156	0.0145	0.2	0.3899	0.9624	1483282	CBDivE_006273	COc1ccc(cc1)C(CC(=O)O)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J14	compound treatment	1.101	-0.0248	-0.33	1.113	-0.0285	-0.39	-0.5112	-0.9972	1916569	CBDivE_006274	COc1ccccc1NC(=O)c2nn(C)cc2/N=C/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J15	compound treatment	1.144	0.0182	0.25	1.151	0.00951	0.13	0.2654	0.9554	1916570	CBDivE_006275	OC(=O)CC(NC(=O)C(F)(F)F)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J16	compound treatment	1.07	-0.0558	-0.75	1.151	0.00951	0.13	-0.4405	-0.5768	1369650	CBDivE_006276	CN(C)Cc1cc(CN(C)C)c(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J17	compound treatment	1.126	2.09E-4	0.0	1.141	-4.91E-4	-0.01	-0.0027	-0.3764	1916571	CBDivE_006277	CC(C)(C)c1cc(CCC(=O)Nc2c3CCN(Cc4ccccc4)c3nc5ccccc25)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J18	compound treatment	1.105	-0.0208	-0.28	1.11	-0.0315	-0.43	-0.502	-0.9787	1916572	CBDivE_006278	NC(=S)NN=C(c1ccc(O)cc1)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J19	compound treatment	1.068	-0.0578	-0.78	1.079	-0.0625	-0.85	-1.1538	-0.999	1916573	CBDivE_006279	CCc1nc2ccccc2c(NC(=O)CN3CCN(C)CC3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	J20	compound treatment	1.094	-0.0318	-0.43	1.148	0.00651	0.09	-0.2405	-0.5491	1508248	CBDivE_006280	COc1ccc(cc1OC)c2ncccc2OC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K01	compound treatment	1.114	-0.0118	-0.16	1.133	-0.00849	-0.12	-0.1943	-0.9878	1916574	CBDivE_006281	CN(/C=C/C(=C/C=[N+](\C)/c1ccccc1)/OCCCS(=O)(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K02	compound treatment	1.12	-0.00579	-0.08	1.124	-0.0175	-0.24	-0.2239	-0.8921	1916575	CBDivE_006282	CN1CCN(CC(=O)Nc2cc(C)nc3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K03	compound treatment	1.129	0.00321	0.04	1.134	-0.00749	-0.1	-0.0416	-0.3751	1520812	CBDivE_006283	CC(=O)N(CN1C(=O)c2ccc(Br)cc2C1=O)c3cccc(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K04	compound treatment	1.158	0.0322	0.43	1.165	0.0235	0.32	0.5339	0.9888	1916576	CBDivE_006284	O=C(CCCCCCC(=O)Nc1cccc2ccccc12)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K05	compound treatment	1.135	0.00921	0.12	1.136	-0.00549	-0.07	0.0349	0.2407	1916577	CBDivE_006285	CCCCOc1ccc(cc1)C(=O)Nc2cccc(c2)C(=O)OCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K06	compound treatment	1.111	-0.0148	-0.2	1.12	-0.0215	-0.29	-0.3483	-0.9825	1850997	CBDivE_006286	Oc1[nH]c(=O)[nH]c(=O)c1N=C2C(=O)NC(=O)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K07	compound treatment	1.155	0.0292	0.39	1.153	0.0115	0.16	0.3896	0.9186	1692917	CBDivE_006287	CCOC(=O)c1cc2C(=O)c3ccccc3-n2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K08	compound treatment	1.133	0.00721	0.1	1.179	0.0375	0.51	0.4305	0.8267	1916578	CBDivE_006288	CC(=O)C(C(=O)C)c1c(Cl)c(O)c(O)c2c(coc12)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K09	compound treatment	1.105	-0.0208	-0.28	1.145	0.00351	0.05	-0.1645	-0.5781	1916579	CBDivE_006289	CC/C(=C\c1sc2ccc(C)cc2[n+]1CCCS(=O)(=O)O)/C=C/3\Sc4ccc(C)cc4N3CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K10	compound treatment	1.104	-0.0218	-0.29	1.204	0.0625	0.85	0.3949	0.4379	1916580	CBDivE_006290	CC(=O)N(CN1C(=O)c2ccc(cc2C1=O)[N+](=O)[O-])c3ccc(cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K11	compound treatment	1.132	0.00621	0.08	1.104	-0.0375	-0.51	-0.3023	-0.5835	1916581	CBDivE_006291	CCC1(CC)C(=O)NC(=NCCc2ccc(OC)c(OC)c2)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K12	compound treatment	1.132	0.00621	0.08	1.139	-0.00249	-0.03	0.0352	0.3896	1916582	CBDivE_006292	CCOC(C(=O)OCCCN(CC)CC)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K13	compound treatment	1.092	-0.0338	-0.46	1.15	0.00851	0.12	-0.2403	-0.5108	1916583	CBDivE_006293	CC(Cc1ccccc1)NCC(=O)Nc2cc(nc3ccccc23)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K14	compound treatment	1.127	0.00121	0.02	1.114	-0.0275	-0.37	-0.2535	-0.6757	1236651	CBDivE_006294	CCc1cc(C(=O)Cc2nc3ccccc3[nH]2)c(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K15	compound treatment	1.126	2.09E-4	0.0	1.11	-0.0315	-0.43	-0.3016	-0.7024	1916584	CBDivE_006295	O=C(CN1CCCCC1)Nc2c3CCCc3nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K16	compound treatment	1.149	0.0232	0.31	1.157	0.0155	0.21	0.3709	0.9818	1916585	CBDivE_006296	CC1(C)C(CCC1(C)C(=O)O)C(=O)NNC(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K17	compound treatment	1.127	0.00121	0.02	1.091	-0.0505	-0.69	-0.4753	-0.6902	1645058	CBDivE_006297	CN1CCC2=C(C1)C(=O)NC3(CCCCC3)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K18	compound treatment	1.133	0.00721	0.1	1.132	-0.00949	-0.13	-0.0227	-0.1405	1774501	CBDivE_006298	OC(=O)c1cc(ccc1C(=O)Nc2ccc3ccccc3c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K19	compound treatment	1.127	0.00121	0.02	1.123	-0.0185	-0.25	-0.1668	-0.66	1916586	CBDivE_006299	CN(C)c1cc(NC(=O)CNC(C)(C)C)c2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	K20	compound treatment	1.14	0.0142	0.19	1.157	0.0155	0.21	0.2851	0.9988	1916587	CBDivE_006300	O=C(NCc1ccccc1)/C(=C\C=C\c2ccccc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L01	compound treatment	1.063	-0.0628	-0.85	1.139	-0.00249	-0.03	-0.623	-0.7349	1123832	CBDivE_006301	Nc1nonc1n2cc(nn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L02	compound treatment	1.086	-0.0398	-0.54	1.146	0.00451	0.06	-0.3361	-0.622	1916588	CBDivE_006302	COC(=O)/C=C/1\Nc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L03	compound treatment	1.155	0.0292	0.39	1.114	-0.0275	-0.37	0.0136	0.0249	1916589	CBDivE_006303	O=C(CN1CCN(CC1)c2ccc3ccccc3n2)c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L04	compound treatment	1.138	0.0122	0.16	1.136	-0.00549	-0.07	0.0635	0.3511	1430404	CBDivE_006304	CC(=O)Nc1ccc(Cc2ccc(NC(=O)C)c(C)c2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L05	compound treatment	1.077	-0.0488	-0.66	1.118	-0.0235	-0.32	-0.6919	-0.9452	1012001	CBDivE_006305	NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L06	compound treatment	1.114	-0.0118	-0.16	1.114	-0.0275	-0.37	-0.3776	-0.9271	1151713	CBDivE_006306	CCN(Cn1nnc2ccccc12)Cn3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L07	compound treatment	1.113	-0.0128	-0.17	1.089	-0.0525	-0.72	-0.6282	-0.8531	1916590	CBDivE_006307	CCN(CC)C(=O)N1CCN(CC1)c2ccc(NC(=O)c3cc(Br)cc(Br)c3O)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L08	compound treatment	1.119	-0.00679	-0.09	1.089	-0.0525	-0.72	-0.5709	-0.7912	1916591	CBDivE_006308	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L09	compound treatment	1.118	-0.00779	-0.11	1.151	0.00951	0.13	0.0174	0.1041	1916592	CBDivE_006309	Cc1cc(/C=N/NC(=O)N)cc(/C=N/NC(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L10	compound treatment	1.143	0.0172	0.23	1.101	-0.0405	-0.55	-0.2263	-0.3777	1916593	CBDivE_006310	Nc1ccc2C(=O)N(CNc3ccc(cc3)C(=O)Oc4ccccc4)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L11	compound treatment	1.135	0.00921	0.12	1.172	0.0305	0.42	0.382	0.8799	1331319	CBDivE_006311	OC(=O)c1cc(Cl)ccc1NS(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L12	compound treatment	1.072	-0.0538	-0.73	1.109	-0.0325	-0.44	-0.8264	-0.972	1916594	CBDivE_006312	CC1(C)C/C(=N\O)/c2[nH]c(nc2C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L13	compound treatment	1.121	-0.00479	-0.06	1.111	-0.0305	-0.42	-0.3397	-0.8073	1579999	CBDivE_006313	OC12NC(=O)NC2(O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L14	compound treatment	1.129	0.00321	0.04	1.172	0.0305	0.42	0.3248	0.7765	1011888	CBDivE_006314	CC(=O)Nc1ccc-2c(Cc3cc(NC(=O)C)ccc32)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L15	compound treatment	1.098	-0.0278	-0.37	1.161	0.0195	0.27	-0.077	-0.1675	1916595	CBDivE_006315	CN(C)CC(=O)Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L16	compound treatment	1.121	-0.00479	-0.06	1.143	0.00151	0.02	-0.0311	-0.4592	1916596	CBDivE_006316	O=C(Nc1ccc(Oc2cccc(Oc3ccc(NC(=O)c4cccc5ccccc45)cc3)c2)cc1)c6cccc7ccccc67
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L17	compound treatment	1.076	-0.0498	-0.67	1.142	5.09E-4	0.01	-0.4701	-0.6998	1916597	CBDivE_006317	CCCCN(CCCC)CC(=O)Nc1cc(nc2ccccc12)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L18	compound treatment	1.089	-0.0368	-0.5	1.118	-0.0235	-0.32	-0.5775	-0.9776	1597857	CBDivE_006318	OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L19	compound treatment	1.116	-0.00979	-0.13	1.133	-0.00849	-0.12	-0.1753	-0.9978	1693747	CBDivE_006319	O[C@@H](C1CC2CCN1CC2C=C)c3ccnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	L20	compound treatment	1.051	-0.0748	-1.01	1.104	-0.0375	-0.51	-1.075	-0.9504	1913938	CBDivE_006320	O=C(Nc1ncccc1OC(=O)C2(CC3CC4CC(C3)C2)C4)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M01	compound treatment	1.184	0.0582	0.79	1.12	-0.0215	-0.29	0.3481	0.4153	1916598	CBDivE_006321	ClC(Cl)(Cl)C(NC1CCS(=O)(=O)C1)NC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M02	compound treatment	1.152	0.0262	0.35	1.152	0.0105	0.14	0.3514	0.9209	1916599	CBDivE_006322	CCOC(=O)c1c(CSC(=N)N)n(C)c2cc(Br)c(OC(=O)C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M03	compound treatment	1.095	-0.0308	-0.42	1.149	0.00751	0.1	-0.2213	-0.5173	3106664	CBDivE_006323	CC1CCc2cccc3c(CCN)cn1c23.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M04	compound treatment	1.141	0.0152	0.21	1.138	-0.00349	-0.05	0.1114	0.529	3011148	CBDivE_006324	NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-].OC(=O)Cc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M05	compound treatment	1.114	-0.0118	-0.16	1.13	-0.0115	-0.16	-0.2233	-1.0	1916600	CBDivE_006325	COc1ccc(CCN(C)CCC(=O)NCc2ccccc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M06	compound treatment	1.088	-0.0378	-0.51	1.169	0.0275	0.38	-0.0952	-0.1505	1916601	CBDivE_006326	Cc1ccccc1NC(=O)CCCCCCC(=O)Nc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M07	compound treatment	1.123	-0.00279	-0.04	1.165	0.0235	0.32	0.2001	0.6198	1566936	CBDivE_006327	OC1=C(CC(=O)c2cccs2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M08	compound treatment	1.158	0.0322	0.43	1.157	0.0155	0.21	0.4568	0.9453	1916602	CBDivE_006328	CC(=O)c1coc2c1cc(O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M09	compound treatment	1.183	0.0572	0.77	1.128	-0.0135	-0.18	0.4157	0.5239	1916603	CBDivE_006329	C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M10	compound treatment	1.124	-0.00179	-0.02	1.099	-0.0425	-0.58	-0.4268	-0.7359	1777349	CBDivE_006330	OC(=O)c1ccc(cc1)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M11	compound treatment	1.126	2.09E-4	0.0	1.169	0.0275	0.38	0.2673	0.7124	1916604	CBDivE_006331	CN(C)CC(=O)Nc1c2CCCc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M12	compound treatment	1.118	-0.00779	-0.11	1.139	-0.00249	-0.03	-0.0983	-0.8903	1916605	CBDivE_006332	CC(CN(C)C)OC(=O)C(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M13	compound treatment	1.101	-0.0248	-0.33	1.072	-0.0695	-0.95	-0.9065	-0.9021	1916606	CBDivE_006333	CCc1nc2ccccc2c(NC(=O)CNC(C)Cc3ccccc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M14	compound treatment	1.104	-0.0218	-0.29	1.151	0.00951	0.13	-0.1162	-0.3616	1916607	CBDivE_006334	Clc1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M15	compound treatment	1.111	-0.0148	-0.2	1.073	-0.0685	-0.93	-0.8015	-0.8392	1916608	CBDivE_006335	NC(=O)c1cc2-c3[nH]c4ccccc4c3CCc2[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M16	compound treatment	1.154	0.0282	0.38	1.147	0.00551	0.08	0.3222	0.8307	1916609	CBDivE_006336	C/C(=N/NC(=O)c1ccccc1[N+](=O)[O-])/c2ccc3ccccc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M17	compound treatment	1.076	-0.0498	-0.67	1.168	0.0265	0.36	-0.2194	-0.2876	1030416	CBDivE_006337	CCCC1(CC)C(=N)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M18	compound treatment	1.139	0.0132	0.18	1.147	0.00551	0.08	0.1791	0.9263	1916610	CBDivE_006338	OC(=O)c1cc(ccc1C(=O)Nc2cccc(O)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M19	compound treatment	1.091	-0.0348	-0.47	1.171	0.0295	0.4	-0.0473	-0.0766	1916611	CBDivE_006339	CN1CCc2c1nc3ccccc3c2NC(=O)CNC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	M20	compound treatment	1.095	-0.0308	-0.42	1.14	-0.00149	-0.02	-0.3081	-0.7408	1914348	CBDivE_006340	C(CSCCc1ccncc1)SCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N01	compound treatment	1.076	-0.0498	-0.67	1.16	0.0185	0.25	-0.2965	-0.4132	1916612	CBDivE_006341	Cc1ccc(cc1NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N02	compound treatment	1.14	0.0142	0.19	1.122	-0.0195	-0.27	-0.0524	-0.1599	1442861	CBDivE_006342	Cc1ccc(cc1)S(=O)(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N03	compound treatment	1.053	-0.0728	-0.98	1.092	-0.0495	-0.67	-1.1716	-0.9833	1916613	CBDivE_006343	Oc1ccc(cc1NCn2nnc3ccccc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N04	compound treatment	1.146	0.0202	0.27	1.089	-0.0525	-0.72	-0.3134	-0.4091	1916614	CBDivE_006344	COc1ccccc1N2CCN(CC(=O)Nc3cc(nc4ccccc34)N(C)C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N05	compound treatment	1.174	0.0482	0.65	1.132	-0.00949	-0.13	0.3684	0.5555	3106151	CBDivE_006345	NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-].OC(=O)c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N06	compound treatment	1.116	-0.00979	-0.13	1.154	0.0125	0.17	0.0272	0.1262	1916615	CBDivE_006346	CN(Cn1nnc2ccccc12)Cn3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N07	compound treatment	1.115	-0.0108	-0.15	1.076	-0.0655	-0.89	-0.7344	-0.8117	1916616	CBDivE_006347	COC(=O)Nc1nc2sc3CCCCc3c2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N08	compound treatment	1.103	-0.0228	-0.31	1.114	-0.0275	-0.37	-0.4825	-0.9952	1774960	CBDivE_006348	OC(=O)c1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N09	compound treatment	1.125	-7.91E-4	-0.01	1.159	0.0175	0.24	0.1613	0.6748	1493999	CBDivE_006349	CN1C(=O)N(C)C2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N10	compound treatment	1.158	0.0322	0.43	1.152	0.0105	0.14	0.4086	0.893	1916617	CBDivE_006350	OC(=O)c1ccc(cc1[N+](=O)[O-])N2C(=O)c3ccc(Oc4ccc(cc4)[N+](=O)[O-])cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N11	compound treatment	1.135	0.00921	0.12	1.138	-0.00349	-0.05	0.0542	0.4073	1350736	CBDivE_006351	OC(=O)CCNc1c(cnc2n(ncc12)c3ccccc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N12	compound treatment	1.126	2.09E-4	0.0	1.103	-0.0385	-0.52	-0.3691	-0.7033	1527682	CBDivE_006352	CCN(CC)CCN1CCn2c3C1CCCc3c4cc(C)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N13	compound treatment	1.145	0.0192	0.26	1.158	0.0165	0.23	0.3424	0.9975	1916618	CBDivE_006353	CC(C)(C)c1cc(/C=C/C(=O)O)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N14	compound treatment	1.117	-0.00879	-0.12	1.133	-0.00849	-0.12	-0.1657	-0.9999	1446119	CBDivE_006354	OC(=O)CCC(=O)Nc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N15	compound treatment	1.07	-0.0558	-0.75	1.151	0.00951	0.13	-0.4405	-0.5768	1916619	CBDivE_006355	CCCCN(CCCC)CC(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N16	compound treatment	1.114	-0.0118	-0.16	1.133	-0.00849	-0.12	-0.1943	-0.9878	1278041	CBDivE_006356	OC(=O)c1cccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(c4)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N17	compound treatment	1.07	-0.0558	-0.75	1.155	0.0135	0.18	-0.4019	-0.5187	1916620	CBDivE_006357	CCc1nc2ccccc2c(NC(=O)CN3CCN(CC3)C(=O)c4ccccc4)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N18	compound treatment	1.058	-0.0678	-0.91	1.049	-0.0925	-1.26	-1.5385	-0.9875	1916621	CBDivE_006358	CC(=O)Nc1cccc(NCCNC(=O)c2cc3ccccc3oc2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N19	compound treatment	1.099	-0.0268	-0.36	1.154	0.0125	0.17	-0.1349	-0.3377	1916622	CBDivE_006359	OS(=O)(=O)C1=CC(=O)C(=[N+]=[N-])c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	N20	compound treatment	1.117	-0.00879	-0.12	1.159	0.0175	0.24	0.085	0.3187	3012223	CBDivE_006360	CCc1nc(C)ccc1O.OC(=O)c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O01	compound treatment	1.105	-0.0208	-0.28	1.142	5.09E-4	0.01	-0.1934	-0.6894	1630750	CBDivE_006361	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O02	compound treatment	1.126	2.09E-4	0.0	1.134	-0.00749	-0.1	-0.0702	-0.6873	1469048	CBDivE_006362	CCOC(=O)c1c(CN2CCOCC2)n(C)c3cc(Br)c(OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O03	compound treatment	1.099	-0.0268	-0.36	1.165	0.0235	0.32	-0.0289	-0.0598	1916624	CBDivE_006363	COc1ccc(cc1OC)C(=O)N/N=C(\C)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O04	compound treatment	1.099	-0.0268	-0.36	1.159	0.0175	0.24	-0.0867	-0.2002	1916625	CBDivE_006364	COc1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O05	compound treatment	1.065	-0.0608	-0.82	1.132	-0.00949	-0.13	-0.6714	-0.8087	1916626	CBDivE_006365	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O06	compound treatment	1.112	-0.0138	-0.19	1.168	0.0265	0.36	0.1241	0.3051	1916627	CBDivE_006366	CN(C)/C=N/C(=O)CN1CCCC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O07	compound treatment	1.113	-0.0128	-0.17	1.127	-0.0145	-0.2	-0.2617	-0.9977	1916628	CBDivE_006367	[O-][N+](=O)c1ccc2n(Cc3ccccc3)c4CCN=C(NCc5ccccc5)c4c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O08	compound treatment	1.139	0.0132	0.18	1.102	-0.0395	-0.54	-0.2548	-0.4492	1916629	CBDivE_006368	Cc1ccc(N)cc1N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O09	compound treatment	1.172	0.0462	0.62	1.13	-0.0115	-0.16	0.33	0.5134	1916630	CBDivE_006369	C/C(=N/NC(=O)c1ccccc1I)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O10	compound treatment	1.154	0.0282	0.38	1.106	-0.0355	-0.48	-0.0731	-0.1188	1916631	CBDivE_006370	COC(=O)NCCCCNC(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O11	compound treatment	1.099	-0.0268	-0.36	1.138	-0.00349	-0.05	-0.2892	-0.7934	1916632	CBDivE_006371	Cc1cc(NC(=O)CNC(C)(C)C)c2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O12	compound treatment	1.134	0.00821	0.11	1.149	0.00751	0.1	0.1507	0.9992	1027148	CBDivE_006372	CN(C)CCOC(c1ccccc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O13	compound treatment	1.11	-0.0158	-0.21	1.169	0.0275	0.38	0.1146	0.2657	1916633	CBDivE_006373	CCCCN(CCCC)CC(=O)Nc1c2CCCc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O14	compound treatment	1.125	-7.91E-4	-0.01	1.153	0.0115	0.16	0.1034	0.6575	1342556	CBDivE_006374	CN(C)S(=NS(=O)(=O)c1ccccc1)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O15	compound treatment	1.117	-0.00879	-0.12	1.118	-0.0235	-0.32	-0.3104	-0.9086	1916634	CBDivE_006375	CCOC(=O)c1c(N)c2cc(cnc2n1C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O16	compound treatment	1.149	0.0232	0.31	1.164	0.0225	0.31	0.4384	1.0	1784118	CBDivE_006376	COc1ccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O17	compound treatment	1.094	-0.0318	-0.43	1.159	0.0175	0.24	-0.1344	-0.2739	1916635	CBDivE_006377	Nc1ccc(cc1)c2nc3ccc(cc3[nH]2)c4nc5ccc(N)cc5[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O18	compound treatment	1.118	-0.00779	-0.11	1.115	-0.0265	-0.36	-0.3298	-0.8765	1916636	CBDivE_006378	OC(=O)CCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O19	compound treatment	1.173	0.0472	0.64	1.153	0.0115	0.16	0.5613	0.8558	1916637	CBDivE_006379	O=C(CN1CCN(CC1)C(=O)c2ccco2)Nc3c4CCCc4nc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	O20	compound treatment	1.123	-0.00279	-0.04	1.147	0.00551	0.08	0.0265	0.3154	1916638	CBDivE_006380	COC(=O)/C=C\1/Nc2ccccc2OC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P01	compound treatment	1.112	-0.0138	-0.19	1.129	-0.0125	-0.17	-0.252	-0.999	1774703	CBDivE_006381	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P02	compound treatment	1.113	-0.0128	-0.17	1.112	-0.0295	-0.4	-0.4064	-0.9286	1916639	CBDivE_006382	O=C(c1ccccc1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P03	compound treatment	1.114	-0.0118	-0.16	1.123	-0.0185	-0.25	-0.2908	-0.9753	1916640	CBDivE_006383	CC(=O)Nc1cccc(NCn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P04	compound treatment	1.114	-0.0118	-0.16	1.156	0.0145	0.2	0.0274	0.1081	1524869	CBDivE_006384	Nc1ccc(Oc2ccc(cc2)S(=O)(=O)c3ccc(Oc4ccc(N)cc4)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P05	compound treatment	1.097	-0.0288	-0.39	1.087	-0.0545	-0.74	-0.8001	-0.9542	3106155	CBDivE_006385	NCC(O)c1ccc(cc1)[N+](=O)[O-].OC(=O)Cc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P06	compound treatment	1.104	-0.0218	-0.29	1.122	-0.0195	-0.27	-0.3958	-0.9987	1916641	CBDivE_006386	CN(C)c1ccc(/C=N/NC(=O)CC(=O)N\N=C\c2ccc(cc2)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P07	compound treatment	1.051	-0.0748	-1.01	1.126	-0.0155	-0.21	-0.8628	-0.837	1632281	CBDivE_006387	CN1CCN(CC1)c2cc3N(C)c4ccccc4Oc3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P08	compound treatment	1.155	0.0292	0.39	1.132	-0.00949	-0.13	0.1871	0.4512	1916642	CBDivE_006388	OC(=O)c1cccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P09	compound treatment	1.096	-0.0298	-0.4	1.123	-0.0185	-0.25	-0.4625	-0.9748	1916643	CBDivE_006389	[O-][N+](=O)c1cccc(/C=N/Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P10	compound treatment	1.082	-0.0438	-0.59	1.092	-0.0495	-0.67	-0.8949	-0.9978	1775570	CBDivE_006390	Oc1ccccc1N2C(=O)c3ccc(Oc4ccc(cc4)[N+](=O)[O-])cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P11	compound treatment	1.057	-0.0688	-0.93	1.094	-0.0475	-0.65	-1.1141	-0.9845	1916644	CBDivE_006391	CCN1CCN(CC1)c2ccc3nsnc3c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P12	compound treatment	1.127	0.00121	0.02	1.127	-0.0145	-0.2	-0.1282	-0.6465	1488780	CBDivE_006392	Cc1ccc(cc1)C(=O)CC2=C(O)C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P13	compound treatment	1.079	-0.0468	-0.63	1.129	-0.0125	-0.17	-0.5668	-0.8669	1916645	CBDivE_006393	O=C1C2C3CC(C=C3)C2C(=O)N1c4ccc(cc4)c5nc6cc(ccc6[nH]5)N7C(=O)C8C9CC(C=C9)C8C7=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P14	compound treatment	1.126	2.09E-4	0.0	1.115	-0.0265	-0.36	-0.2534	-0.7016	1486911	CBDivE_006394	OC(=O)c1cccc(NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P15	compound treatment	1.056	-0.0698	-0.94	1.119	-0.0225	-0.31	-0.8826	-0.8913	1916646	CBDivE_006395	CCN(CC)CC(=O)Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P16	compound treatment	1.059	-0.0668	-0.9	1.09	-0.0515	-0.7	-1.1336	-0.9924	1395693	CBDivE_006396	CCN(CC)CCN1CC(CC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P17	compound treatment	1.037	-0.0888	-1.2	1.111	-0.0305	-0.42	-1.141	-0.8999	1916647	CBDivE_006397	CN1CCN(CC(=O)Nc2c3CCCc3nc4CCCCc24)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P18	compound treatment	1.108	-0.0178	-0.24	1.106	-0.0355	-0.48	-0.5119	-0.9476	1916648	CBDivE_006398	CC1=NN(c2cc(C)[nH]n2)C(C)(C)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P19	compound treatment	1.055	-0.0708	-0.96	1.062	-0.0795	-1.08	-1.4418	-0.998	1377181	CBDivE_006399	CC(C)NCC(O)COc1c(C)cc(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.20	P20	compound treatment	1.07	-0.0558	-0.75	1.116	-0.0255	-0.35	-0.778	-0.9384	1655784	CBDivE_006400	CCc1ccc(cc1N)c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A01	compound treatment	1.337	0.0464	0.63	1.415	-0.0329	-0.45	0.1255	0.1629	1404144	CBDivE_006401	Fc1ccc(cc1)C2NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A02	compound treatment	1.198	-0.0926	-1.25	1.452	0.0041	0.06	-0.8437	-0.6748	1916649	CBDivE_006402	O/N=C/c1ccc(CCCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A03	compound treatment	1.393	0.102	1.38	1.442	-0.0059	-0.08	0.92	0.6648	1916650	CBDivE_006403	Cc1cc([nH]n1)C(=O)N/N=C\c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A04	compound treatment	1.264	-0.0266	-0.36	1.45	0.0021	0.03	-0.2334	-0.6485	1916651	CBDivE_006404	COc1ccc(/C=C/c2cc(nc3ccc4ccccc4c23)c5ccc(Br)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A05	compound treatment	1.365	0.0744	1.0	1.493	0.0451	0.62	1.1447	0.9724	1916652	CBDivE_006405	O=C1N(Cc2ccccc2)C(=O)c3ccc(N4CCOCC4)c5cccc1c35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A06	compound treatment	1.275	-0.0156	-0.21	1.373	-0.0749	-1.02	-0.871	-0.8352	1916653	CBDivE_006406	Fc1ccc(/C=N/c2ccc3ncccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A07	compound treatment	1.374	0.0834	1.13	1.506	0.0581	0.79	1.3559	0.9853	1471012	CBDivE_006407	S=C(Nc1ccccc1)N2CCCN2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A08	compound treatment	1.224	-0.0666	-0.9	1.522	0.0741	1.01	0.0793	0.0586	1916654	CBDivE_006408	COC(=O)CNc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A09	compound treatment	1.389	0.0984	1.33	1.393	-0.0549	-0.75	0.4094	0.2686	1335362	CBDivE_006409	CC1CN(C)C(CC21NC(=O)NC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A10	compound treatment	1.172	-0.119	-1.6	1.406	-0.0419	-0.57	-1.5353	-0.9037	1666421	CBDivE_006410	COc1ccc(CC2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A11	compound treatment	1.433	0.142	1.92	1.539	0.0911	1.24	2.2369	0.9777	1916655	CBDivE_006411	Nc1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A12	compound treatment	1.225	-0.0656	-0.88	1.462	0.0141	0.19	-0.4897	-0.5408	1916656	CBDivE_006412	Cc1ccc(O)c(CCc2ccc(cc2)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A13	compound treatment	1.389	0.0984	1.33	1.497	0.0491	0.67	1.4122	0.9498	1510495	CBDivE_006413	COc1ccccc1NC(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A14	compound treatment	1.218	-0.0726	-0.98	1.477	0.0291	0.4	-0.4119	-0.3898	1499139	CBDivE_006414	O=S(=O)(NCn1nnc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A15	compound treatment	1.41	0.119	1.61	1.474	0.0261	0.36	1.3907	0.843	1916657	CBDivE_006415	[O-][N+](=O)c1ccc(/C=N/Nc2ccc(Cl)nn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A16	compound treatment	1.196	-0.0946	-1.28	1.428	-0.0199	-0.27	-1.0942	-0.8387	1916658	CBDivE_006416	Nc1ccc(cc1)C(=O)Nc2ccc(cc2)c3nc4ccc(NC(=O)c5ccc(N)cc5)cc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A17	compound treatment	1.354	0.0634	0.86	1.516	0.0681	0.93	1.2615	0.9992	1916659	CBDivE_006417	COc1nc(C)nc(n1)N(C)C(=O)NS(=O)(=O)Nc2ccc(C)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A18	compound treatment	1.218	-0.0726	-0.98	1.401	-0.0469	-0.64	-1.1447	-0.9787	1249604	CBDivE_006418	CCn1c2ccccc2c3cc(NC(=O)COc4ccc(C)cc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A19	compound treatment	1.403	0.112	1.52	1.486	0.0381	0.52	1.4397	0.8981	1415539	CBDivE_006419	N[C@@H](c1ccccc1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	A20	compound treatment	1.209	-0.0816	-1.1	1.431	-0.0169	-0.23	-0.9413	-0.837	1916660	CBDivE_006420	COc1cc(/C=C\2/SC(=O)N(CO)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B01	compound treatment	1.965	0.674	9.1	1.369	-0.0789	-1.08	5.6726	0.6192	1916661	CBDivE_006421	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B02	compound treatment	0.088	-1.2	-16.22	1.497	0.0491	0.67	-10.9985	-0.6773	1916662	CBDivE_006422	OCCNc1c(cc(cc1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B03	compound treatment	2.087	0.796	10.74	1.326	-0.122	-1.66	6.4218	0.5907	1916663	CBDivE_006423	COC(=O)CCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B04	compound treatment	0.081	-1.21	-16.32	1.433	-0.0149	-0.2	-11.6824	-0.7159	1053949	CBDivE_006424	OC(=O)CN(CC(=O)O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B05	compound treatment	2.099	0.808	10.91	1.429	-0.0189	-0.26	7.5294	0.6902	1916664	CBDivE_006425	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3cc(ccc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B06	compound treatment	0.073	-1.22	-16.43	1.413	-0.0349	-0.48	-11.9515	-0.7273	1916665	CBDivE_006426	Brc1ccc(NCN2C(=O)/C(=C/c3ccccc3)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B07	compound treatment	2.137	0.846	11.42	1.47	0.0221	0.3	8.2873	0.7255	1916666	CBDivE_006427	COc1ccccc1NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B08	compound treatment	0.072	-1.22	-16.44	1.375	-0.0729	-0.99	-12.3275	-0.7485	1916667	CBDivE_006428	COc1ccccc1NC(=O)C2C(C3C=CC2C43CC4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B09	compound treatment	2.075	0.784	10.58	1.462	0.0141	0.19	7.6187	0.7198	1624682	CBDivE_006429	COC(=O)c1ccccc1NC(=O)CCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B10	compound treatment	0.066	-1.22	-16.52	1.451	0.0031	0.04	-11.6519	-0.7053	1916668	CBDivE_006430	Cc1cc(nc2nc(C)nc(C)c12)c3c(C)nc(C)nc3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B11	compound treatment	2.146	0.855	11.54	1.455	0.0071	0.1	8.2285	0.713	1916669	CBDivE_006431	[O-][N+](=O)c1ccc(cc1)c2cc(=O)[nH]c3c(Cl)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B12	compound treatment	0.065	-1.23	-16.53	1.443	-0.0049	-0.07	-11.7386	-0.71	1916670	CBDivE_006432	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B13	compound treatment	2.088	0.797	10.76	1.397	-0.0509	-0.69	7.1159	0.6601	1563075	CBDivE_006433	O=C1CCCC2=C1C(Nc3ccc4ccccc4c23)c5cccnc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B14	compound treatment	0.064	-1.23	-16.55	1.446	-0.0019	-0.03	-11.7192	-0.7082	1916671	CBDivE_006434	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B15	compound treatment	2.1	0.809	10.92	1.409	-0.0389	-0.53	7.3461	0.672	1049730	CBDivE_006435	c1nc(oc1c2ccccc2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B16	compound treatment	0.061	-1.23	-16.59	1.433	-0.0149	-0.2	-11.8731	-0.7157	1916672	CBDivE_006436	O=C(Nc1ccc(N=Nc2ccccc2)cc1)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B17	compound treatment	2.042	0.751	10.14	1.426	-0.0219	-0.3	6.9568	0.686	1916673	CBDivE_006437	O=C/1N(CN2CCOCC2)C(=S)S\C1=C\c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B18	compound treatment	0.074	-1.22	-16.41	1.46	0.0121	0.17	-11.4888	-0.7	1916674	CBDivE_006438	Cc1ccccc1C(=O)NNC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B19	compound treatment	2.07	0.779	10.51	1.345	-0.103	-1.4	6.4428	0.6074	1145324	CBDivE_006439	O=C1N(CN(CC2CCCO2)CN3C(=O)c4ccccc4C3=O)C(=O)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	B20	compound treatment	0.071	-1.22	-16.45	1.433	-0.0149	-0.2	-11.7778	-0.7158	1916675	CBDivE_006440	CC(C)(C)c1cc(/C=N/CCCC\N=C\c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C01	compound treatment	1.369	0.0784	1.06	1.435	-0.0129	-0.18	0.6236	0.5816	3106193	CBDivE_006441	CC1NCCn2cccc12.OC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C02	compound treatment	1.222	-0.0686	-0.93	1.44	-0.0079	-0.11	-0.7305	-0.7841	1916677	CBDivE_006442	Oc1cccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C03	compound treatment	1.369	0.0784	1.06	1.473	0.0251	0.34	0.99	0.8905	1916678	CBDivE_006443	C/C(=N\NC(=O)Cc1ccccc1)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C04	compound treatment	1.177	-0.114	-1.53	1.419	-0.0289	-0.39	-1.3623	-0.8609	1916679	CBDivE_006444	CCOC(=O)c1c(C)c2c(ccc3ccccc32)nc1c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C05	compound treatment	1.3	0.00941	0.13	1.506	0.0581	0.79	0.65	0.81	1777460	CBDivE_006445	CCOc1ccc(NC(=O)c2c(cnn2C)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C06	compound treatment	1.202	-0.0886	-1.2	1.465	0.0171	0.23	-0.6802	-0.5586	1916680	CBDivE_006446	[O-][N+](=O)c1ccc(/C=N/c2ccc3ncccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C07	compound treatment	1.376	0.0854	1.15	1.465	0.0171	0.23	0.9796	0.8333	1916681	CBDivE_006447	FC(F)(F)c1cccc(c1)N2N=C(CC2c3ccccc3)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C08	compound treatment	1.238	-0.0526	-0.71	1.46	0.0121	0.17	-0.385	-0.5285	1260673	CBDivE_006448	Cc1ccc(cc1)S(=O)(=O)Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C09	compound treatment	1.427	0.136	1.84	1.501	0.0531	0.72	1.8133	0.9169	1916682	CBDivE_006449	OC(=O)c1cc2ccc(Oc3nc(Oc4ccccc4)nc(Oc5ccc6cc(C(=O)O)c(=O)oc6c5)n3)cc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C10	compound treatment	1.206	-0.0846	-1.14	1.511	0.0631	0.86	-0.1985	-0.1389	1916683	CBDivE_006450	Nc1ccccc1C(=O)NNC(=O)c2cccc(c2)C(=O)NNC(=O)c3ccccc3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C11	compound treatment	1.277	-0.0136	-0.18	1.451	0.0031	0.04	-0.0998	-0.5301	1916684	CBDivE_006451	CC(C)(C)NC(=O)NS(=O)(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C12	compound treatment	1.226	-0.0646	-0.87	1.415	-0.0329	-0.45	-0.9334	-0.9523	1916685	CBDivE_006452	O=C1C2C3CCC(O3)C2C(=O)N1c4ccc5ncccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C13	compound treatment	1.367	0.0764	1.03	1.506	0.0581	0.79	1.2891	0.9916	1916686	CBDivE_006453	Clc1ccc(NC(=O)Nn2cnnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C14	compound treatment	1.256	-0.0346	-0.47	1.469	0.0211	0.29	-0.1265	-0.2308	1656957	CBDivE_006454	CC1(CN2CN3C1)C(=O)C(C2)(C3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C15	compound treatment	1.307	0.0164	0.22	1.536	0.0881	1.2	1.006	0.8235	1916687	CBDivE_006455	Oc1ccc(cc1/C=N/Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C16	compound treatment	1.207	-0.0836	-1.13	1.472	0.0241	0.33	-0.565	-0.481	1916688	CBDivE_006456	O/C(=C\C(=N\NC(=O)c1ccco1)\C(F)(F)F)/C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C17	compound treatment	1.474	0.183	2.47	1.49	0.0421	0.57	2.1555	0.8486	1916689	CBDivE_006457	COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2ccc(Br)cn2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C18	compound treatment	1.175	-0.116	-1.56	1.475	0.0271	0.37	-0.8414	-0.525	1175675	CBDivE_006458	CC(C)(C)Nc1nc(Cl)nc(NCC=C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C19	compound treatment	1.411	0.12	1.62	1.438	-0.0099	-0.13	1.0532	0.6461	1916690	CBDivE_006459	OC(=O)C1CC(=Nc2ccccc2N1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	C20	compound treatment	1.195	-0.0956	-1.29	1.448	1.03E-4	0.0	-0.9109	-0.7063	1522279	CBDivE_006460	Cc1ccc(OCC(=O)Nc2cccc(Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D01	compound treatment	1.843	0.552	7.45	1.37	-0.0779	-1.06	4.5185	0.6002	1532803	CBDivE_006461	Cc1sc2ncnc(NCCO)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D02	compound treatment	0.089	-1.2	-16.21	1.352	-0.0959	-1.31	-12.3871	-0.7617	1916691	CBDivE_006462	CC(=O)C1=C(C)NC(NC1c2ccc(cc2)[N+](=O)[O-])c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D03	compound treatment	1.909	0.618	8.34	1.394	-0.0539	-0.73	5.3795	0.6423	1916692	CBDivE_006463	[O-][N+](=O)C(CNC(=O)c1ccccc1)(CN2CCOCC2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D04	compound treatment	0.08	-1.21	-16.33	1.124	-0.324	-4.42	-14.6714	-0.8672	1579934	CBDivE_006464	ON1COc2ccc3ccccc3c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D05	compound treatment	2.045	0.754	10.18	1.464	0.0161	0.22	7.3518	0.7222	1916693	CBDivE_006465	OC(=O)CCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D06	compound treatment	0.074	-1.22	-16.41	1.427	-0.0209	-0.28	-11.807	-0.7193	1364170	CBDivE_006466	C(Nc1ccccn1)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D07	compound treatment	2.084	0.793	10.7	1.438	-0.0099	-0.13	7.4731	0.6981	1914245	CBDivE_006467	Oc1cc2c(cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D08	compound treatment	0.072	-1.22	-16.44	1.396	-0.0519	-0.71	-12.125	-0.7369	1916694	CBDivE_006468	C/C(=N\NC(=O)c1ccc(OCc2ccccc2)cc1)/c3ccc(cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D09	compound treatment	2.053	0.762	10.29	1.423	-0.0249	-0.34	7.0328	0.6834	1219206	CBDivE_006469	COC(=O)c1ccc(NC(=O)CCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D10	compound treatment	0.072	-1.22	-16.44	1.443	-0.0049	-0.07	-11.6718	-0.71	1916695	CBDivE_006470	OCc1cccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D11	compound treatment	2.114	0.823	11.11	1.497	0.0491	0.67	8.3282	0.7484	1916696	CBDivE_006471	Fc1ccc(Nc2nc(N/N=C/c3cccc(I)c3)nc(n2)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D12	compound treatment	0.066	-1.22	-16.52	1.456	0.0081	0.11	-11.6037	-0.7024	1916697	CBDivE_006472	CC(C)(C)NC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D13	compound treatment	2.12	0.829	11.19	1.438	-0.0099	-0.13	7.8165	0.6985	1224847	CBDivE_006473	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4cccnc4)ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D14	compound treatment	0.056	-1.23	-16.66	1.425	-0.0229	-0.31	-11.998	-0.7202	1916698	CBDivE_006474	CCN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@H](N2C1=S)c5cc(OC)c(OC)c(OC)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D15	compound treatment	2.117	0.826	11.15	1.461	0.0131	0.18	8.0097	0.7183	1916699	CBDivE_006475	Nc1ccc(cc1)c2nnc(o2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D16	compound treatment	0.065	-1.23	-16.53	1.363	-0.0849	-1.16	-12.51	-0.7548	1916700	CBDivE_006476	O=C(NNC(=O)C1CC1(c2ccccc2)c3ccccc3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D17	compound treatment	2.096	0.805	10.87	1.436	-0.0119	-0.16	7.5683	0.6965	1916701	CBDivE_006477	O=C/1N(CN2CCCCC2)C(=S)S\C1=C\c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D18	compound treatment	0.073	-1.22	-16.43	1.405	-0.0429	-0.58	-12.0287	-0.7318	1916702	CBDivE_006478	Ic1cccc(c1)C(=O)NNC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D19	compound treatment	2.097	0.806	10.88	1.47	0.0221	0.3	7.9057	0.7264	1916703	CBDivE_006479	Cc1ccc(NC(=O)c2c(cnn2C)[N+](=O)[O-])cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	D20	compound treatment	0.078	-1.21	-16.36	1.471	0.0231	0.32	-11.3446	-0.6934	1916704	CBDivE_006480	CC(C)(C)c1cc(/C=N/CC\N=C\c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E01	compound treatment	1.325	0.0344	0.46	1.409	-0.0389	-0.53	-0.0469	-0.0665	3012407	CBDivE_006481	Cc1ccc2CNCCn12.OC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E02	compound treatment	1.254	-0.0366	-0.49	1.409	-0.0389	-0.53	-0.7242	-0.9994	1916706	CBDivE_006482	CN(C)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E03	compound treatment	1.39	0.0994	1.34	1.419	-0.0289	-0.39	0.6696	0.4791	1916707	CBDivE_006483	C/C(=N\NC(=O)c1ccncc1)/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E04	compound treatment	1.196	-0.0946	-1.28	1.454	0.0061	0.08	-0.8435	-0.6596	1916708	CBDivE_006484	O=C(/C=C/c1ccc2ccccc2n1)c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E05	compound treatment	1.339	0.0484	0.65	1.51	0.0621	0.85	1.0606	0.9918	1775187	CBDivE_006485	Cn1ncc([N+](=O)[O-])c1C(=O)Nc2ccc(cc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E06	compound treatment	1.194	-0.0966	-1.3	1.443	-0.0049	-0.07	-0.9687	-0.7424	1916709	CBDivE_006486	Brc1ccc(/C=N/c2ccc3ncccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E07	compound treatment	1.32	0.0294	0.4	1.552	0.104	1.42	1.2843	0.8713	1709102	CBDivE_006487	CC(=O)NC1(C)CCC2(C)CC1(C)C(=NC2(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E08	compound treatment	1.227	-0.0636	-0.86	1.507	0.0591	0.81	-0.0368	-0.0312	1916710	CBDivE_006488	[O-][N+](=O)c1ccc(CS(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E09	compound treatment	1.371	0.0804	1.08	1.456	0.0081	0.11	0.8451	0.7751	1916711	CBDivE_006489	CCCCCOc1ccc(cc1)C2(Cc3nc4ccccc4[nH]3)C(=O)c5ccccc5C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E10	compound treatment	1.275	-0.0156	-0.21	1.677	0.229	3.12	2.0603	0.658	1316275	CBDivE_006490	OC(=O)c1ccccc1NC(=O)c2cccc(c2)C(=O)Nc3ccccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E11	compound treatment	1.467	0.176	2.38	1.537	0.0891	1.22	2.542	0.9513	1916712	CBDivE_006491	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E12	compound treatment	1.199	-0.0916	-1.24	1.427	-0.0209	-0.28	-1.0753	-0.8479	1916713	CBDivE_006492	CC(CCC(=O)n1nnc2ccccc12)CC(=O)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E13	compound treatment	1.265	-0.0256	-0.35	1.437	-0.0109	-0.15	-0.3492	-0.929	1916714	CBDivE_006493	Cc1cccc(Cl)c1NC(=O)NS(=O)(=O)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E14	compound treatment	1.217	-0.0736	-0.99	1.46	0.0121	0.17	-0.5853	-0.5816	1775605	CBDivE_006494	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E15	compound treatment	1.349	0.0584	0.79	1.421	-0.0269	-0.37	0.2978	0.3426	1916715	CBDivE_006495	Cc1cc(O)c(C2=NCCSC(C2)c3cc(Br)ccc3O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E16	compound treatment	1.253	-0.0376	-0.51	1.45	0.0021	0.03	-0.3384	-0.6661	1580129	CBDivE_006496	Nc1ccccc1C(=O)Nc2ccc(cc2C(=O)O)c3ccc(NC(=O)c4ccccc4N)c(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E17	compound treatment	1.337	0.0464	0.63	1.493	0.0451	0.62	0.8776	1.0	1775897	CBDivE_006497	OCC1OC(Nc2cc(cc(c2)[N+](=O)[O-])C(=O)O)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E18	compound treatment	1.184	-0.107	-1.44	1.484	0.0361	0.49	-0.6687	-0.44	1515415	CBDivE_006498	Cc1ccc(OCC(=O)Nc2ccc(cc2)C(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E19	compound treatment	1.365	0.0744	1.0	1.532	0.0841	1.15	1.5207	0.9978	1916716	CBDivE_006499	Oc1c(Br)cc(Br)cc1/C=N\Nc2ncnc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	E20	compound treatment	1.226	-0.0646	-0.87	1.486	0.0381	0.52	-0.2488	-0.2452	1916717	CBDivE_006500	CCC1C=C(OC(C1C)N2CCCCC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F01	compound treatment	1.962	0.671	9.06	1.365	-0.0829	-1.13	5.6054	0.6141	1495698	CBDivE_006501	OC(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F02	compound treatment	0.086	-1.2	-16.25	1.363	-0.0849	-1.16	-12.3096	-0.7556	1916718	CBDivE_006502	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(cc2)N3C(=O)C4CCCCC4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F03	compound treatment	1.982	0.691	9.33	1.423	-0.0249	-0.34	6.3555	0.6809	1632880	CBDivE_006503	Cc1ccc(OCC(=O)N2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F04	compound treatment	0.065	-1.23	-16.53	1.044	-0.404	-5.51	-15.5859	-0.8943	1916719	CBDivE_006504	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F05	compound treatment	1.995	0.704	9.5	1.449	0.0011	0.02	6.7302	0.7082	1916720	CBDivE_006505	OC(=O)CCSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F06	compound treatment	0.07	-1.22	-16.47	1.427	-0.0209	-0.28	-11.8452	-0.7192	1080021	CBDivE_006506	OC(=O)C1C(C2CC1C=C2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F07	compound treatment	2.109	0.818	11.04	1.376	-0.0719	-0.98	7.1138	0.6418	1916721	CBDivE_006507	OC(=O)CCCC(=O)Nc1cc(ccc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F08	compound treatment	0.068	-1.22	-16.49	1.498	0.0501	0.68	-11.1796	-0.6772	1203212	CBDivE_006508	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F09	compound treatment	2.056	0.765	10.33	1.466	0.0181	0.25	7.476	0.7238	1660462	CBDivE_006509	COC(=O)c1ccccc1NC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F10	compound treatment	0.062	-1.23	-16.57	1.462	0.0141	0.19	-11.584	-0.6989	1916722	CBDivE_006510	Oc1ccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F11	compound treatment	2.104	0.813	10.97	1.485	0.0371	0.51	8.1171	0.7389	1916723	CBDivE_006511	Brc1ccccc1/C=N/Nc2nc(nc(n2)N3CCOCC3)N(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F12	compound treatment	0.051	-1.24	-16.72	1.405	-0.0429	-0.58	-12.2385	-0.7314	1916724	CBDivE_006512	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)NCc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F13	compound treatment	2.085	0.794	10.72	1.459	0.0111	0.15	7.6851	0.717	1916725	CBDivE_006513	Oc1ccc(cc1/C=N/Nc2ccc(Cl)nn2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F14	compound treatment	0.063	-1.23	-16.56	1.449	0.0011	0.02	-11.6998	-0.7065	1193048	CBDivE_006514	CCC1(CCC(C)C)C(=NC(=O)NC1=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F15	compound treatment	2.102	0.811	10.95	1.474	0.0261	0.36	7.992	0.7297	1345272	CBDivE_006515	CCN(CC)c1ccc2cc(c3nc4ccccc4o3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F16	compound treatment	0.056	-1.23	-16.66	1.445	-0.0029	-0.04	-11.8051	-0.7088	1282636	CBDivE_006516	CCOC(=O)c1ccc(NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F17	compound treatment	2.099	0.808	10.91	1.487	0.0391	0.53	8.0887	0.7408	1916726	CBDivE_006517	Brc1ccc(cc1)C(Nc2ccccn2)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F18	compound treatment	0.072	-1.22	-16.44	1.491	0.0431	0.59	-11.209	-0.6814	1916727	CBDivE_006518	Brc1ccc(cc1)C(=O)NNC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F19	compound treatment	2.079	0.788	10.64	1.462	0.0141	0.19	7.6568	0.7198	1916728	CBDivE_006519	Clc1ccc(CCNC(=O)C(=O)NCc2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	F20	compound treatment	0.067	-1.22	-16.51	1.4	-0.0479	-0.65	-12.1341	-0.7345	1916729	CBDivE_006520	CCOC(=O)C/N=C/c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G01	compound treatment	1.305	0.0144	0.19	1.41	-0.0379	-0.52	-0.228	-0.413	3012483	CBDivE_006521	OC(=O)/C=C/C(=O)O.C1Cn2cccc2CN1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G02	compound treatment	1.174	-0.117	-1.57	1.428	-0.0199	-0.27	-1.3041	-0.817	1916731	CBDivE_006522	CC/1=CCC(C\C1=N\O)C(C)(C)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G03	compound treatment	1.338	0.0474	0.64	1.483	0.0351	0.48	0.7907	0.9898	1916732	CBDivE_006523	COc1ccc(/C=N/NC(=O)Cc2ccccc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G04	compound treatment	1.23	-0.0606	-0.82	1.446	-0.0019	-0.03	-0.5963	-0.7291	1351346	CBDivE_006524	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4ccc5OCOc5c4)ccc6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G05	compound treatment	1.35	0.0594	0.8	1.473	0.0251	0.34	0.8087	0.928	1916733	CBDivE_006525	CCOC(=O)c1c(NC(=O)/C=C/C(=O)O)sc2CCCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G06	compound treatment	1.23	-0.0606	-0.82	1.427	-0.0209	-0.28	-0.7795	-0.9005	1916734	CBDivE_006526	c1n(nc2ncccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G07	compound treatment	1.445	0.154	2.08	1.506	0.0581	0.79	2.0332	0.9123	1916735	CBDivE_006527	CN(C)c1nc(OCC(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G08	compound treatment	1.227	-0.0636	-0.86	1.456	0.0081	0.11	-0.5285	-0.611	1916736	CBDivE_006528	[O-][N+](=O)c1ccccc1NS(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G09	compound treatment	1.398	0.107	1.45	1.546	0.0981	1.34	1.9705	0.9992	1916737	CBDivE_006529	COc1ccc(cc1OC)C2(CC(=O)N3CCOCC3)C(=O)c4ccccc4C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G10	compound treatment	1.248	-0.0426	-0.57	1.521	0.0731	1.0	0.2986	0.2595	1916738	CBDivE_006530	O=C(Nc1ccc(cc1)c2nc3ccc(NC(=O)c4ccc(/N=C/c5ccccc5)cc4)cc3[nH]2)c6ccc(/N=C/c7ccccc7)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G11	compound treatment	1.436	0.145	1.96	1.552	0.104	1.42	2.3909	0.9874	1916739	CBDivE_006531	Oc1ccc2ccccc2c1/C=N/NC(=O)c3cc4ccccc4cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G12	compound treatment	1.276	-0.0146	-0.2	1.484	0.0361	0.49	0.2089	0.394	1776961	CBDivE_006532	OCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G13	compound treatment	1.416	0.125	1.69	1.469	0.0211	0.29	1.3998	0.8157	1916740	CBDivE_006533	Clc1ccc(cc1)c2ccc(cc2)N3C(=O)C4C5CCC(O5)C4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G14	compound treatment	1.167	-0.124	-1.67	1.487	0.0391	0.53	-0.802	-0.4581	1916741	CBDivE_006534	CC(C)(CO)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G15	compound treatment	1.365	0.0744	1.0	1.545	0.0971	1.32	1.6461	0.9907	1913232	CBDivE_006535	OC(=O)CN1C(=O)/C(=C\Nc2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G16	compound treatment	1.218	-0.0726	-0.98	1.513	0.0651	0.89	-0.0648	-0.049	1247505	CBDivE_006536	Nc1cc(C(=O)O)c(N)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G17	compound treatment	1.343	0.0524	0.71	1.482	0.0341	0.47	0.8287	0.9794	1916742	CBDivE_006537	OCC1OC(Nc2ccccc2NC3OC(CO)C(O)C(O)C3O)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G18	compound treatment	1.21	-0.0806	-1.09	1.449	0.0011	0.02	-0.7582	-0.6973	1916743	CBDivE_006538	Cc1ccc(Cl)cc1/N=C/2\C(=O)N(CN3CCC(Cc4ccccc4)CC3)c5ccccc25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G19	compound treatment	1.328	0.0374	0.5	1.427	-0.0209	-0.28	0.1553	0.268	1916744	CBDivE_006539	CC(C)(C)c1ccc(s1)C(N)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	G20	compound treatment	1.176	-0.115	-1.55	1.414	-0.0339	-0.46	-1.42	-0.88	1509225	CBDivE_006540	Cc1ccc(OCC(=O)Nc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H01	compound treatment	1.817	0.526	7.1	1.309	-0.139	-1.89	3.6822	0.501	1916745	CBDivE_006541	OCCNC(=O)Cc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H02	compound treatment	0.093	-1.2	-16.16	1.442	-0.0059	-0.08	-11.4811	-0.7106	1916746	CBDivE_006542	CC/C(=N\NC(=O)Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H03	compound treatment	1.976	0.685	9.25	0.341	-1.11	-15.09	-4.1349	-0.2336	1916747	CBDivE_006543	COC(=O)CNc1nc(Cl)nc(Nc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H04	compound treatment	0.082	-1.21	-16.3	0.565	-0.883	-12.04	-20.0424	-0.9889	1579298	CBDivE_006544	CN(C)c1ccc(cc1)C(N2CCOCC2)c3c(O)ccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H05	compound treatment	2.033	0.742	10.02	1.415	-0.0329	-0.45	6.7648	0.6748	1606363	CBDivE_006545	Cc1ccc(C)c(NC(=O)CCCC(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H06	compound treatment	0.069	-1.22	-16.48	1.397	-0.0509	-0.69	-12.144	-0.7362	1657072	CBDivE_006546	OC(=O)C1C(C2CC1C=C2)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H07	compound treatment	2.077	0.786	10.61	1.411	-0.0369	-0.5	7.146	0.6728	1149938	CBDivE_006547	OC(=O)CCCC(=O)Nc1cccc(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H08	compound treatment	0.061	-1.23	-16.59	1.419	-0.0289	-0.39	-12.0081	-0.7237	1231043	CBDivE_006548	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H09	compound treatment	2.082	0.791	10.68	1.418	-0.0299	-0.41	7.2612	0.6796	1143685	CBDivE_006549	Cc1cccc(NC(=O)CCC(=O)O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H10	compound treatment	0.056	-1.23	-16.66	1.49	0.0421	0.57	-11.3712	-0.6823	1916748	CBDivE_006550	CC(=O)c1ccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H11	compound treatment	2.103	0.812	10.96	1.402	-0.0459	-0.63	7.3072	0.6656	1916749	CBDivE_006551	O=c1cc2oc3c4CCCN5CCCc(cc3nc2c6ccccc16)c54
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H12	compound treatment	0.057	-1.23	-16.64	1.453	0.0051	0.07	-11.7185	-0.7041	1916750	CBDivE_006552	CCC(C)NC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H13	compound treatment	2.057	0.766	10.34	1.511	0.0631	0.86	7.9195	0.7633	1121247	CBDivE_006553	Cc1cc(C)c(NC(=O)CCc2ccccc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H14	compound treatment	0.059	-1.23	-16.62	1.436	-0.0119	-0.16	-11.8633	-0.714	1916751	CBDivE_006554	COc1ccc(NC(=O)/C=C\C(=O)O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H15	compound treatment	2.085	0.794	10.72	1.42	-0.0279	-0.38	7.3091	0.6816	1099026	CBDivE_006555	CCN(CC)c1ccc2cc(c3nc4ccccc4[nH]3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H16	compound treatment	0.068	-1.22	-16.49	1.482	0.0341	0.47	-11.3339	-0.6869	1511782	CBDivE_006556	COc1ccc(NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H17	compound treatment	2.099	0.808	10.91	1.456	0.0081	0.11	7.7898	0.7142	1330892	CBDivE_006557	Oc1ccc2ccccc2c1C(N3CCCCC3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H18	compound treatment	0.06	-1.23	-16.6	1.392	-0.0559	-0.76	-12.278	-0.7388	1916752	CBDivE_006558	O=C(NNC(=O)C1CC1(c2ccccc2)c3ccccc3)C4CC4c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H19	compound treatment	2.059	0.768	10.37	1.49	0.0421	0.57	7.736	0.7451	1781881	CBDivE_006559	CC(=O)Nc1ccc(NC(=O)c2c(cnn2C)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	H20	compound treatment	0.07	-1.22	-16.47	1.404	-0.0439	-0.6	-12.0669	-0.7323	1916753	CBDivE_006560	CC(C)(C)c1cc(/C=N/c2ccc(\N=C\c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)cc2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I01	compound treatment	1.377	0.0864	1.17	1.451	0.0031	0.04	0.8542	0.7323	1165284	CBDivE_006561	Clc1ccc(cc1Cl)C2=NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I02	compound treatment	1.206	-0.0846	-1.14	1.455	0.0071	0.1	-0.7385	-0.6448	1916754	CBDivE_006562	CC1C(CC(C(=O)O)C1(C)C)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I03	compound treatment	1.407	0.116	1.57	1.511	0.0631	0.86	1.7189	0.9599	1916755	CBDivE_006563	Cc1cc(O)c(C(=O)/C=C/c2cccc(O)c2)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I04	compound treatment	1.213	-0.0776	-1.05	1.489	0.0411	0.56	-0.3439	-0.2896	1775154	CBDivE_006564	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4ccc(cc4)[N+](=O)[O-])ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I05	compound treatment	1.339	0.0484	0.65	1.511	0.0631	0.86	1.0702	0.9907	1913934	CBDivE_006565	CCc1nc(C)cc(CN(C)C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I06	compound treatment	1.193	-0.0976	-1.32	1.535	0.0871	1.19	-0.0911	-0.0514	1916756	CBDivE_006566	Nc1nc(Cl)nc(Nc2ccccc2SCCC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I07	compound treatment	1.424	0.133	1.8	1.545	0.0971	1.32	2.2089	0.9886	1472272	CBDivE_006567	CNc1nc(nc(n1)N2CCOCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I08	compound treatment	1.32	0.0294	0.4	1.536	0.0881	1.2	1.13	0.8932	1916757	CBDivE_006568	OCc1cccc(/N=C/c2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I09	compound treatment	1.356	0.0654	0.88	1.439	-0.0089	-0.12	0.5381	0.6042	1774315	CBDivE_006569	COC(=O)c1c(C(=O)OC)c2ccccn2c1C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I10	compound treatment	1.217	-0.0736	-0.99	1.454	0.0061	0.08	-0.6432	-0.6456	1916758	CBDivE_006570	CC(C)(C)c1ccc(OCC(O)CNS(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I11	compound treatment	1.383	0.0924	1.25	1.505	0.0571	0.78	1.4321	0.9743	1916759	CBDivE_006571	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I12	compound treatment	1.222	-0.0686	-0.93	1.486	0.0381	0.52	-0.2869	-0.2704	1588297	CBDivE_006572	CC(=O)N1CN2CN(CN(C1)C2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I13	compound treatment	1.275	-0.0156	-0.21	1.478	0.0301	0.41	0.1415	0.3068	1916760	CBDivE_006573	COc1ccccc1NS(=O)(=O)NC(=O)Nc2nc(C)cc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I14	compound treatment	1.169	-0.122	-1.64	1.409	-0.0389	-0.53	-1.535	-0.8904	1916761	CBDivE_006574	CCOC(=O)c1c(N)sc(N)c1C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I15	compound treatment	1.339	0.0484	0.65	1.509	0.0611	0.83	1.0509	0.9927	1163290	CBDivE_006575	COc1ccccc1NC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I16	compound treatment	1.21	-0.0806	-1.09	1.503	0.0551	0.75	-0.2375	-0.1797	1715417	CBDivE_006576	C(N(Cn1nnc2ccccc12)C3CCCCC3)n4nnc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I17	compound treatment	0.058	-1.23	-16.63	1.495	0.0471	0.64	-11.3039	-0.6793	1916762	CBDivE_006577	OCC1OC(COCC2C(O)C(O)C(Nc3ccccc3)OC2CO)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I18	compound treatment	2.088	0.797	10.76	1.493	0.0451	0.62	8.0416	0.7463	1916763	CBDivE_006578	COc1ccc(/C=C\2/S/C(=N/Nc3ccccc3)/NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I19	compound treatment	1.388	0.0974	1.31	1.442	-0.0059	-0.08	0.8723	0.6626	1569376	CBDivE_006579	CCN(CC)CCN1C(=O)CCCc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	I20	compound treatment	1.22	-0.0706	-0.95	1.478	0.0301	0.41	-0.3832	-0.3695	1074642	CBDivE_006580	CCOC(=O)C(=CNc1cc(C)ccn1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J01	compound treatment	1.893	0.602	8.13	1.398	-0.0499	-0.68	5.2654	0.6456	1916764	CBDivE_006581	Cc1ccc(OCC(=O)O/N=C(\N)/c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J02	compound treatment	0.091	-1.2	-16.18	1.454	0.0061	0.08	-11.3845	-0.7035	1916765	CBDivE_006582	C/C(=N\NC(=O)Cc1ccc(cc1)[N+](=O)[O-])/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J03	compound treatment	1.979	0.688	9.29	0.338	-1.11	-15.14	-4.1352	-0.2329	1916766	CBDivE_006583	Cc1ccccc1NC(=O)C2CC=CCC2C(=O)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J04	compound treatment	0.071	-1.22	-16.45	1.32	-0.128	-1.74	-12.8673	-0.7777	1044055	CBDivE_006584	CCCCCCCCCc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J05	compound treatment	2.021	0.73	9.85	1.433	-0.0149	-0.2	6.8239	0.6924	1410840	CBDivE_006585	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J06	compound treatment	0.064	-1.23	-16.55	1.422	-0.0259	-0.35	-11.9506	-0.722	1190385	CBDivE_006586	Cc1ccc(cc1)C2(CC2C(=O)NCc3ccccc3)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J07	compound treatment	2.04	0.749	10.11	1.404	-0.0439	-0.6	6.7255	0.6641	1775045	CBDivE_006587	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J08	compound treatment	0.061	-1.23	-16.59	1.456	0.0081	0.11	-11.6514	-0.7024	1916767	CBDivE_006588	CC1(C)CC(=O)C/C(=N/NC(=O)c2ccccc2O)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J09	compound treatment	2.041	0.75	10.12	1.434	-0.0139	-0.19	7.0244	0.6937	1916768	CBDivE_006589	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J10	compound treatment	0.053	-1.24	-16.7	1.441	-0.0069	-0.09	-11.8723	-0.7111	1916769	CBDivE_006590	Cc1ccccc1NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J11	compound treatment	2.066	0.775	10.46	1.462	0.0141	0.19	7.5328	0.72	1916770	CBDivE_006591	CCCCOc1ccc(cc1)C2CC(=O)C3=C(C2)c4c(NC3c5ccc(OC)c(OC)c5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J12	compound treatment	0.054	-1.24	-16.68	1.448	1.03E-4	0.0	-11.7953	-0.707	1041869	CBDivE_006592	CN(C)Cc1ccccc1C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J13	compound treatment	2.088	0.797	10.76	1.439	-0.0089	-0.12	7.5209	0.6991	538	CBDivE_006593	CC(CCc1ccccc1)C(=O)NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J14	compound treatment	0.05	-1.24	-16.74	1.398	-0.0499	-0.68	-12.3156	-0.7352	1916771	CBDivE_006594	OC(=O)/C=C\C(=O)Nc1ccc(cc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J15	compound treatment	2.055	0.764	10.31	1.461	0.0131	0.18	7.4183	0.7193	1545717	CBDivE_006595	O=C(Nc1ccccc1)C2CC=CCC2C(=O)OCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J16	compound treatment	0.054	-1.24	-16.68	1.441	-0.0069	-0.09	-11.8628	-0.7111	1916772	CBDivE_006596	OC(=O)COC(c1ccccc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J17	compound treatment	0.059	-1.23	-16.62	1.435	-0.0129	-0.18	-11.8729	-0.7146	1916773	CBDivE_006597	COC(=O)c1ccccc1NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J18	compound treatment	1.893	0.602	8.13	1.42	-0.0279	-0.38	5.4775	0.6733	1199333	CBDivE_006598	O=C(NCc1ccccc1)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J19	compound treatment	2.113	0.822	11.09	1.491	0.0431	0.59	8.2608	0.7435	1916774	CBDivE_006599	Oc1ccccc1C(=O)N/N=C/c2c(OCc3ccccc3Cl)ccc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	J20	compound treatment	0.057	-1.23	-16.64	1.423	-0.0249	-0.34	-12.0077	-0.7214	1916775	CBDivE_006600	CC(C)(C)c1cc(/C=N/c2ccccn2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K01	compound treatment	1.381	0.0904	1.22	1.48	0.0321	0.44	1.172	0.9044	1916776	CBDivE_006601	C1Cn2cccc2C=N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K02	compound treatment	1.177	-0.114	-1.53	1.46	0.0121	0.17	-0.9669	-0.6273	1916777	CBDivE_006602	CC1C/2CC(C(\C2=N\O)S(=O)(=O)N3CCOCC3)C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K03	compound treatment	1.373	0.0824	1.11	1.48	0.0321	0.44	1.0956	0.917	1916778	CBDivE_006603	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K04	compound treatment	1.177	-0.114	-1.53	1.468	0.0201	0.27	-0.8898	-0.5715	1916779	CBDivE_006604	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4ccc5ccccc5n4)ccc6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K05	compound treatment	1.342	0.0514	0.69	1.496	0.0481	0.66	0.9542	0.9996	1417276	CBDivE_006605	CC(C)(C)c1nc(CN2CCOCC2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K06	compound treatment	1.178	-0.113	-1.52	1.446	-0.0019	-0.03	-1.0924	-0.719	1916780	CBDivE_006606	COC(=O)CNC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K07	compound treatment	1.417	0.126	1.71	1.488	0.0401	0.55	1.5925	0.8893	1512025	CBDivE_006607	Cc1ccccc1Nc2nc(Cl)nc(NC(C)(C)C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K08	compound treatment	1.182	-0.109	-1.47	1.477	0.0291	0.4	-0.7553	-0.4976	1442524	CBDivE_006608	Cc1ccc(Nc2nc(Cl)nc(Nc3ccc(C)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K09	compound treatment	1.304	0.0134	0.18	1.491	0.0431	0.59	0.5435	0.8838	1630599	CBDivE_006609	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K10	compound treatment	1.205	-0.0856	-1.15	1.502	0.0541	0.74	-0.2948	-0.2152	1916781	CBDivE_006610	CC(C)(c1ccc(Oc2ccc(cc2)N3C(=O)c4ccccc4C3=O)cc1)c5ccc(Oc6ccc(cc6)N7C(=O)c8ccccc8C7=O)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K11	compound treatment	1.401	0.11	1.49	1.484	0.0361	0.49	1.4013	0.8933	1916782	CBDivE_006611	COc1ccc(cc1OC)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K12	compound treatment	1.338	0.0474	0.64	1.436	-0.0119	-0.16	0.3375	0.5115	1916783	CBDivE_006612	N(=Nc1nonc1[n+]2nc3nonc3[n-]2)c4nonc4[n+]5nc6nonc6[n-]5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K13	compound treatment	1.383	0.0924	1.25	1.515	0.0671	0.92	1.5285	0.9884	1916784	CBDivE_006613	CN(C)c1nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)nc(ON=C(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K14	compound treatment	1.22	-0.0706	-0.95	1.485	0.0371	0.51	-0.3157	-0.2927	1916785	CBDivE_006614	C/C(=N/O)/c1[nH]c(C)c(\C(=N/O)\C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K15	compound treatment	1.328	0.0374	0.5	1.514	0.0661	0.9	0.9942	0.9624	1114807	CBDivE_006615	OC(=O)c1ccccc1C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K16	compound treatment	1.204	-0.0866	-1.17	1.525	0.0771	1.05	-0.0826	-0.0526	1916786	CBDivE_006616	COc1ccc(cc1)C2NCC(CCl)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K17	compound treatment	1.376	0.0854	1.15	1.459	0.0111	0.15	0.9218	0.7932	1224793	CBDivE_006617	COc1ccc(cc1)c2cc(C)c3c(ccc4ccccc43)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K18	compound treatment	1.195	-0.0956	-1.29	1.424	-0.0239	-0.33	-1.1423	-0.8588	1916787	CBDivE_006618	OC(=O)CC1S/C(=N/N=C/c2ccc(Cl)cc2)/NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K19	compound treatment	1.414	0.123	1.66	1.533	0.0851	1.16	1.9978	0.9844	1916788	CBDivE_006619	FC(F)(F)OC(F)(F)C(F)(F)C(=O)N(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	K20	compound treatment	1.213	-0.0776	-1.05	1.521	0.0731	1.0	-0.0353	-0.0244	1916789	CBDivE_006620	Cn1ncc(N)c1C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L01	compound treatment	1.912	0.621	8.38	1.4	-0.0479	-0.65	5.4659	0.65	1916790	CBDivE_006621	COC(=O)CCC(CN1CCOCC1)([N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L02	compound treatment	0.09	-1.2	-16.2	1.372	-0.0759	-1.03	-12.1847	-0.7508	1916791	CBDivE_006622	C/C(=N\NC(=O)Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L03	compound treatment	1.973	0.682	9.21	1.283	-0.165	-2.25	4.9197	0.5191	1916792	CBDivE_006623	[O-][N+](=O)c1ccc(NC(=O)C2CC=CCC2C(=O)NCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L04	compound treatment	0.074	-1.22	-16.41	1.436	-0.0119	-0.16	-11.7202	-0.7141	1916793	CBDivE_006624	CCC/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L05	compound treatment	2.002	0.711	9.6	1.455	0.0071	0.1	6.8548	0.7142	1651382	CBDivE_006625	Brc1ccccc1C(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L06	compound treatment	0.069	-1.22	-16.48	1.414	-0.0339	-0.46	-11.98	-0.7267	1916794	CBDivE_006626	CN1C(=O)/C(=N\NC(=O)Cc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L07	compound treatment	1.982	0.691	9.33	1.438	-0.0099	-0.13	6.5001	0.6968	1916795	CBDivE_006627	OC(=O)CCC(=O)Nc1cc(ccc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L08	compound treatment	0.062	-1.23	-16.57	1.441	-0.0069	-0.09	-11.7865	-0.7111	1916796	CBDivE_006628	[O-][N+](=O)c1ccc2c(=O)[nH][nH]c(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L09	compound treatment	2.03	0.739	9.98	1.398	-0.0499	-0.68	6.5723	0.6573	1301478	CBDivE_006629	OC(=O)CCCC(=O)Nc1ccccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L10	compound treatment	0.053	-1.24	-16.7	1.367	-0.0809	-1.1	-12.5859	-0.7522	1916797	CBDivE_006630	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)NC4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L11	compound treatment	2.093	0.802	10.82	1.467	0.0191	0.26	7.8386	0.7239	1427688	CBDivE_006631	Oc1ccc(cc1O)C2Nc3ccc4ccccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L12	compound treatment	0.051	-1.24	-16.72	1.4	-0.0479	-0.65	-12.2867	-0.7342	1916798	CBDivE_006632	CC(=O)c1c(Nc2ccccc2Cl)nc([nH]c1=S)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L13	compound treatment	2.067	0.776	10.47	1.454	0.0061	0.08	7.4652	0.7127	1122816	CBDivE_006633	COc1ccc(cc1OC)C(C)NC=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L14	compound treatment	0.048	-1.24	-16.76	1.437	-0.0109	-0.15	-11.9586	-0.7133	1916799	CBDivE_006634	Cc1cc(ccc1NC(=O)/C=C\C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L15	compound treatment	2.066	0.775	10.46	1.384	-0.0639	-0.87	6.7807	0.646	3106310	CBDivE_006635	CNCC(O)CNC.OC(=O)c1coc2CCCC(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L16	compound treatment	0.051	-1.24	-16.72	1.404	-0.0439	-0.6	-12.2482	-0.7319	1916801	CBDivE_006636	O=C(CCc1ccccc1)NNC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L17	compound treatment	2.068	0.777	10.49	1.477	0.0291	0.4	7.6965	0.7333	1916802	CBDivE_006637	Nc1cccc(c1)C(=O)/C=C/c2ccc(\C=C\C(=O)c3cccc(N)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L18	compound treatment	0.05	-1.24	-16.74	1.414	-0.0339	-0.46	-12.1613	-0.7264	1636777	CBDivE_006638	CC(=O)Nc1ccc(NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L19	compound treatment	2.128	0.837	11.3	1.478	0.0301	0.41	8.2785	0.7323	1046431	CBDivE_006639	Oc1ccc2ccccc2c1C(N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	L20	compound treatment	0.067	-1.22	-16.51	1.429	-0.0189	-0.26	-11.8545	-0.7181	1916803	CBDivE_006640	CCN(CC)CCOC(=O)c1ccc(NC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M01	compound treatment	1.354	0.0634	0.86	1.442	-0.0059	-0.08	0.548	0.6378	1190958	CBDivE_006641	Cc1cc(=O)n2cccc(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M02	compound treatment	1.214	-0.0766	-1.03	1.431	-0.0169	-0.23	-0.8936	-0.8441	1916804	CBDivE_006642	Cc1cc(nc2ccc3ccccc3c12)c4ccc(NC(=O)CCl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M03	compound treatment	1.355	0.0644	0.87	1.494	0.0461	0.63	1.0589	0.9874	1916805	CBDivE_006643	CCC/C=C/C=N/NC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M04	compound treatment	1.242	-0.0486	-0.66	1.102	-0.346	-4.72	-3.7988	-0.7977	1363179	CBDivE_006644	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4ccc(O)cc4)ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M05	compound treatment	1.225	-0.0656	-0.88	1.418	-0.0299	-0.41	-0.914	-0.9381	1916806	CBDivE_006645	Nc1nc(CCl)nc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M06	compound treatment	1.201	-0.0896	-1.21	1.509	0.0611	0.83	-0.2655	-0.1808	1916807	CBDivE_006646	CCS(=O)(=O)c1ccsc1S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M07	compound treatment	1.343	0.0524	0.71	1.468	0.0201	0.27	0.6937	0.9149	1204303	CBDivE_006647	Cc1ccc(Nc2nc(Cl)nc(n2)N(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M08	compound treatment	1.251	-0.0396	-0.53	1.429	-0.0189	-0.26	-0.5599	-0.9441	3106312	CBDivE_006648	Cc1ccc(cc1)S(=O)(=O)O.C(C[n+]1c(/C=C/Nc2ccccc2)oc3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M09	compound treatment	1.367	0.0764	1.03	1.528	0.0801	1.09	1.5012	0.9996	1916809	CBDivE_006649	Cc1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M10	compound treatment	1.199	-0.0916	-1.24	1.478	0.0301	0.41	-0.5835	-0.4481	1916810	CBDivE_006650	CNc1nc(Cl)nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M11	compound treatment	1.41	0.119	1.61	1.456	0.0081	0.11	1.2172	0.7538	1241676	CBDivE_006651	CC(Cc1c[nH]c2ccccc12)NC(=O)NC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M12	compound treatment	1.189	-0.102	-1.37	1.447	-8.97E-4	-0.01	-0.9778	-0.7134	1376991	CBDivE_006652	C(N1CCCC1)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M13	compound treatment	1.377	0.0864	1.17	1.545	0.0971	1.32	1.7606	0.998	1652384	CBDivE_006653	Cc1cc(C)nc(NC(=O)NS(=O)(=O)Nc2ccccc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M14	compound treatment	1.186	-0.105	-1.41	1.475	0.0271	0.37	-0.7364	-0.5049	1410511	CBDivE_006654	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Cc3ccc(NS(=O)(=O)c4ccc(C)cc4)c(c3)C(=O)O)cc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M15	compound treatment	1.398	0.107	1.45	1.453	0.0051	0.07	1.0738	0.7402	1916811	CBDivE_006655	Brc1ccccc1C(=O)NNC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M16	compound treatment	1.188	-0.103	-1.38	1.438	-0.0099	-0.13	-1.0741	-0.7724	1401373	CBDivE_006656	OC1(CC(=O)c2ccc(Br)cc2)C(=O)Nc3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M17	compound treatment	1.301	0.0104	0.14	1.521	0.0731	1.0	0.8041	0.7988	1867859	CBDivE_006657	Cc1cc(=O)[nH]c2sc(C(=O)c3ccc(Br)cc3)c(N)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M18	compound treatment	1.238	-0.0526	-0.71	1.469	0.0211	0.29	-0.2982	-0.3895	1916812	CBDivE_006658	OC(=O)CC1S/C(=N/N=C/c2ccc(Br)cc2)/NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M19	compound treatment	1.343	0.0524	0.71	1.565	0.117	1.6	1.6291	0.9328	1916813	CBDivE_006659	FC(F)(C(=O)N(Cc1ccccc1)Cc2ccccc2)C3(F)OC(F)(F)C(F)(F)C3(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	M20	compound treatment	1.166	-0.125	-1.68	1.488	0.0401	0.55	-0.8019	-0.4536	1916814	CBDivE_006660	COC(=O)C(Cc1ccccc1)NC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N01	compound treatment	1.86	0.569	7.68	1.427	-0.0209	-0.28	5.2302	0.6804	1916815	CBDivE_006661	Cc1cc(C)c(c(C)c1)S(=O)(=O)N2C(CCC2=O)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N02	compound treatment	0.1	-1.19	-16.06	1.397	-0.0509	-0.69	-11.8482	-0.737	1012677	CBDivE_006662	Cc1ccc(NC(=O)CSC(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N03	compound treatment	1.874	0.583	7.87	1.387	-0.0609	-0.83	4.9781	0.629	1383350	CBDivE_006663	OC(=O)Cc1ccc(NC(=O)c2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N04	compound treatment	0.087	-1.2	-16.24	1.342	-0.106	-1.44	-12.5026	-0.767	1916816	CBDivE_006664	OC(=O)C/N=C/c1ccc(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N05	compound treatment	1.893	0.602	8.13	1.424	-0.0239	-0.33	5.5161	0.6782	1645809	CBDivE_006665	CS(=O)(=O)Nc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N06	compound treatment	0.069	-1.22	-16.48	1.371	-0.0769	-1.05	-12.3947	-0.7506	1916817	CBDivE_006666	C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])/c2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N07	compound treatment	1.913	0.622	8.4	1.432	-0.0159	-0.22	5.784	0.6886	1232703	CBDivE_006667	COC(=O)c1ccc(NC(=O)CCCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N08	compound treatment	0.072	-1.22	-16.44	1.418	-0.0299	-0.41	-11.9129	-0.7244	1916818	CBDivE_006668	CC(=O)c1cc([nH]c1NC(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N09	compound treatment	1.925	0.634	8.56	1.45	0.0021	0.03	6.0721	0.7095	1916819	CBDivE_006669	C/C(=N/NC(=O)N)/c1ccc-2c(Cc3ccccc32)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N10	compound treatment	0.059	-1.23	-16.62	1.43	-0.0179	-0.24	-11.9212	-0.7174	1916820	CBDivE_006670	COc1ccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N11	compound treatment	1.962	0.671	9.06	1.42	-0.0279	-0.38	6.1358	0.6768	1916821	CBDivE_006671	CCCCOc1ccc(cc1)C2CC(=O)C3=C(C2)c4c(NC3c5ccc(OC)cc5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N12	compound treatment	0.055	-1.24	-16.67	1.408	-0.0399	-0.54	-12.1714	-0.7298	1916822	CBDivE_006672	C/C(=N\OC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N13	compound treatment	1.997	0.706	9.53	1.45	0.0021	0.03	6.7589	0.7092	1916823	CBDivE_006673	Oc1ccc(/C=C/2\CC/C(=C/c3ccc(O)cc3)/C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N14	compound treatment	0.065	-1.23	-16.53	1.421	-0.0269	-0.37	-11.9507	-0.7226	1916824	CBDivE_006674	COc1ccc(/C=C/C(=O)\C=C\c2ccc(OC)c(OC)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N15	compound treatment	1.976	0.685	9.25	1.433	-0.0149	-0.2	6.3947	0.6914	1916825	CBDivE_006675	CC(=O)c1ccc(NCN2C(=O)CCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N16	compound treatment	0.054	-1.24	-16.68	1.403	-0.0449	-0.61	-12.2292	-0.7326	1916826	CBDivE_006676	O=C(NNC(=O)C1CC21CCC2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N17	compound treatment	2.038	0.747	10.08	1.38	-0.0679	-0.93	6.475	0.6395	1916827	CBDivE_006677	CCOC(=O)C(N1CCOCC1)(N2CCOCC2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N18	compound treatment	0.057	-1.23	-16.64	1.426	-0.0219	-0.3	-11.9788	-0.7197	1044069	CBDivE_006678	OC(=O)C1CC1(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N19	compound treatment	2.043	0.752	10.15	1.501	0.0531	0.72	7.6895	0.7556	1916828	CBDivE_006679	CC(=O)Nc1cccc(NC(=O)C2C(C3CC2C=C3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	N20	compound treatment	0.056	-1.23	-16.66	1.383	-0.0649	-0.88	-12.403	-0.7436	1916829	CBDivE_006680	Cn1c(nc2ccccc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O01	compound treatment	1.383	0.0924	1.25	1.452	0.0041	0.06	0.921	0.7381	1002219	CBDivE_006681	CCOC(=O)CNS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O02	compound treatment	1.198	-0.0926	-1.25	1.462	0.0141	0.19	-0.7473	-0.5913	1916830	CBDivE_006682	Cc1cc(nc2ccc3ccccc3c12)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O03	compound treatment	1.379	0.0884	1.19	1.505	0.0571	0.78	1.3939	0.9787	1666691	CBDivE_006683	COc1c(Cl)cc(Cl)cc1C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O04	compound treatment	1.216	-0.0746	-1.01	1.461	0.0131	0.18	-0.5852	-0.5726	1916831	CBDivE_006684	[O-][N+](=O)c1cccc(/C=N/c2ccc3ncccc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O05	compound treatment	1.362	0.0714	0.96	1.462	0.0141	0.19	0.8171	0.8319	1916623	CBDivE_006685	CCc1nc(C)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O06	compound treatment	1.221	-0.0696	-0.94	1.386	-0.0619	-0.84	-1.2607	-0.9986	1916832	CBDivE_006686	Cc1cc(C)nc(NC(=O)NC(=O)C(Cl)(Cl)Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O07	compound treatment	1.438	0.147	1.99	1.452	0.0041	0.06	1.4457	0.7267	1402459	CBDivE_006687	CC(C)(C)Nc1nc(NC(C)(C)C)nc(n1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O08	compound treatment	1.206	-0.0846	-1.14	1.512	0.0641	0.87	-0.1889	-0.1314	1916833	CBDivE_006688	CCN1/C(=C/C=N/c2ccccc2)/Oc3ccc(cc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O09	compound treatment	1.259	-0.0316	-0.43	1.451	0.0031	0.04	-0.2715	-0.6338	1916834	CBDivE_006689	O=C(c1ccccc1)n2nc(c3ccccc3)c4cccc4c2c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O10	compound treatment	1.235	-0.0556	-0.75	1.436	-0.0119	-0.16	-0.6451	-0.8406	1916835	CBDivE_006690	COc1ccc(cc1)N2C(=O)C3C(N4C5C(C(N4C3C2=O)c6ccccc6)C(=O)N(C5=O)c7ccc(OC)cc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O11	compound treatment	1.333	0.0424	0.57	1.46	0.0121	0.17	0.5212	0.8754	1916836	CBDivE_006691	[O-][N+](=O)c1ccccc1NC(=O)NS(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O12	compound treatment	1.272	-0.0186	-0.25	1.493	0.0451	0.62	0.2575	0.3877	1264401	CBDivE_006692	C(N(Cn1nnc2ccccc12)Cn3nnc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O13	compound treatment	1.389	0.0984	1.33	1.472	0.0241	0.33	1.1711	0.8563	1916837	CBDivE_006693	COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2cc(ccc2C)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O14	compound treatment	1.238	-0.0526	-0.71	1.449	0.0011	0.02	-0.4911	-0.692	1198185	CBDivE_006694	CC(C)C1(CN2CN3C1)C(=O)C(C2)(C3)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O15	compound treatment	1.358	0.0674	0.91	1.462	0.0141	0.19	0.779	0.8381	1371709	CBDivE_006695	CN1C(=O)C(Cc2c[nH]c3ccccc23)NC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O16	compound treatment	1.217	-0.0736	-0.99	1.461	0.0131	0.18	-0.5757	-0.5707	1411307	CBDivE_006696	O=C1CCC(=O)N1CN2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O17	compound treatment	1.379	0.0884	1.19	1.522	0.0741	1.01	1.5579	0.9966	1916838	CBDivE_006697	Cc1cc(C)c2c(N)c(sc2n1)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O18	compound treatment	1.206	-0.0846	-1.14	1.455	0.0071	0.1	-0.7385	-0.6448	1916839	CBDivE_006698	COc1ccc(/C=N/N=C/2\NC(=O)C(CC(=O)O)S2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O19	compound treatment	1.34	0.0494	0.67	1.499	0.0511	0.7	0.964	0.9998	1083238	CBDivE_006699	CN(CCN(C)S(=O)(=O)c1ccccc1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	O20	compound treatment	1.212	-0.0786	-1.06	1.457	0.0091	0.12	-0.662	-0.6201	1370023	CBDivE_006700	COc1ccc(NC(=O)c2nn(C)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P01	compound treatment	1.882	0.591	7.98	1.404	-0.0439	-0.6	5.2183	0.6522	1916840	CBDivE_006701	CC(=O)NCC(CN1CCOCC1)([N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P02	compound treatment	0.1	-1.19	-16.06	1.392	-0.0559	-0.76	-11.8965	-0.7398	1916841	CBDivE_006702	OS(=O)(=O)c1ccc(Nc2cc3[n+](c4ccccc4)c5ccccc5nc3c6ccccc26)c(c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P03	compound treatment	1.879	0.588	7.94	1.356	-0.0919	-1.25	4.7269	0.5882	1916842	CBDivE_006703	Cc1cccc(C)c1NC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P04	compound treatment	0.084	-1.21	-16.28	1.392	-0.0559	-0.76	-12.0491	-0.7394	1916843	CBDivE_006704	Cc1cccc(c1)C2(CC2C(=O)N/N=C/c3ccc(cc3)[N+](=O)[O-])c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P05	compound treatment	1.874	0.583	7.87	1.384	-0.0639	-0.87	4.9492	0.625	1916844	CBDivE_006705	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Oc2cccc(OS(=O)(=O)c3ccc(cc3)[N+](=O)[O-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P06	compound treatment	0.056	-1.23	-16.66	1.361	-0.0869	-1.18	-12.6151	-0.7555	1411157	CBDivE_006706	Cc1ccc(cc1)C2(CC2C(=O)Nc3ccc(C)c(C)c3)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P07	compound treatment	1.878	0.587	7.92	1.403	-0.0449	-0.61	5.1705	0.6505	1545446	CBDivE_006707	OC(=O)c1ccccc1n2c(=O)c3cc4c(=O)n(c5ccccc5C(=O)O)c(=O)c4cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P08	compound treatment	0.064	-1.23	-16.55	1.38	-0.0679	-0.93	-12.3556	-0.7455	1730525	CBDivE_006708	Cc1nc(nc2[nH]c(cc12)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P09	compound treatment	1.771	0.48	6.48	1.329	-0.119	-1.62	3.4363	0.5144	1301683	CBDivE_006709	Cc1ccc(CCSc2ccc(F)cc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P10	compound treatment	0.066	-1.22	-16.52	0.646	-0.802	-10.94	-19.414	-0.9799	1916845	CBDivE_006710	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)NCC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P11	compound treatment	1.891	0.6	8.1	1.362	-0.0859	-1.17	4.8992	0.5986	1916846	CBDivE_006711	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4cc(Br)ccc4O)ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P12	compound treatment	0.056	-1.23	-16.66	1.362	-0.0859	-1.17	-12.6055	-0.755	1780966	CBDivE_006712	CCc1nnc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P13	compound treatment	1.928	0.637	8.6	1.412	-0.0359	-0.49	5.7343	0.6658	1916847	CBDivE_006713	COC(=O)c1ccc(cc1C(=O)OC)c2ncc(o2)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P14	compound treatment	0.059	-1.23	-16.62	1.405	-0.0429	-0.58	-12.1622	-0.7315	1200666	CBDivE_006714	O=C(Nc1cccc2ccccc12)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P15	compound treatment	2.012	0.721	9.73	1.41	-0.0379	-0.52	6.5163	0.6686	1586062	CBDivE_006715	COc1ccccc1NCN2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P16	compound treatment	0.053	-1.24	-16.7	1.381	-0.0669	-0.91	-12.4509	-0.7446	1041866	CBDivE_006716	CN(C)Cc1ccccc1C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P17	compound treatment	2.042	0.751	10.14	1.349	-0.0989	-1.35	6.2143	0.6077	1172871	CBDivE_006717	COc1cccc2c(Cl)c3n(C)ncc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P18	compound treatment	0.057	-1.23	-16.64	1.432	-0.0159	-0.22	-11.9209	-0.7163	1916848	CBDivE_006718	CC(=O)c1cc2OCCOc2c([N+](=O)[O-])c1N=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P19	compound treatment	2.061	0.77	10.39	1.431	-0.0169	-0.23	7.1862	0.6913	1429601	CBDivE_006719	COc1ccc(cc1)C(N2CCOCC2)c3c(O)ccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.21	P20	compound treatment	0.061	-1.23	-16.59	1.356	-0.0919	-1.25	-12.6156	-0.7584	1916849	CBDivE_006720	COc1cc(/C=N/NC(=O)c2ccncc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A01	compound treatment	1.14	0.0105	0.14	1.405	-0.0358	-0.49	-0.2445	-0.4814	1249397	CBDivE_006721	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCC2(OC3C=C2)C4C3C(=O)N(C4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A02	compound treatment	1.174	0.0445	0.6	1.414	-0.0268	-0.36	0.1666	0.2371	1167639	CBDivE_006722	C(Cc1ccccc1)C2NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A03	compound treatment	1.164	0.0345	0.47	1.446	0.00524	0.07	0.3798	0.8061	1683790	CBDivE_006723	CCOC(=O)CNc1nc(Cl)nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A04	compound treatment	1.17	0.0405	0.55	1.432	-0.00876	-0.12	0.302	0.5397	1569049	CBDivE_006724	COc1ccc(cc1)C(CC(=O)c2ccccc2)Nc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A05	compound treatment	1.182	0.0525	0.71	1.498	0.0572	0.78	1.0529	0.9988	1916850	CBDivE_006725	CS(=Nc1no[n+]([O-])c1c2ccccc2)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A06	compound treatment	1.15	0.0205	0.28	1.386	-0.0548	-0.75	-0.3323	-0.4172	1916851	CBDivE_006726	O=C(/C=C(\Nc1ccc(cc1)S(=O)(=O)Nc2ccc3ccccc3c2)/c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A07	compound treatment	1.207	0.0775	1.05	1.49	0.0492	0.67	1.2142	0.977	1364989	CBDivE_006727	O=C(NCN(Cc1ccccc1)Cc2ccccc2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A08	compound treatment	1.196	0.0665	0.9	1.502	0.0612	0.84	1.225	0.9994	1916852	CBDivE_006728	Oc1ccc(cc1)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A09	compound treatment	1.209	0.0795	1.07	1.407	-0.0338	-0.46	0.433	0.3709	1916853	CBDivE_006729	Cc1[nH]c2ccccc2c1/C=C/C(=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A10	compound treatment	1.202	0.0725	0.98	1.407	-0.0338	-0.46	0.3662	0.3387	1916854	CBDivE_006730	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A11	compound treatment	1.189	0.0595	0.8	1.527	0.0862	1.18	1.3993	0.9827	1916855	CBDivE_006731	Brc1ccc2[nH]cc(/C=C/C(=O)c3ccncc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A12	compound treatment	1.155	0.0255	0.34	1.464	0.0232	0.32	0.4675	0.9991	1447844	CBDivE_006732	Clc1nc(NCC=C)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A13	compound treatment	1.188	0.0585	0.79	1.489	0.0482	0.66	1.0233	0.9959	1387536	CBDivE_006733	OC(=O)c1ccc(NC(=O)c2cccc(c2)C(=O)Nc3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A14	compound treatment	1.146	0.0165	0.22	1.456	0.0152	0.21	0.3045	0.9994	1030356	CBDivE_006734	O=C(Nc1ccccc1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A15	compound treatment	1.134	0.00452	0.06	1.491	0.0502	0.69	0.5275	0.767	1916856	CBDivE_006735	OC(=O)c1ccc(cc1NC(=O)c2ccc(cc2)C(=O)Nc3cc(ccc3C(=O)O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A16	compound treatment	1.127	-0.00248	-0.03	1.445	0.00424	0.06	0.0172	0.2575	1437742	CBDivE_006736	CC(C)(C)c1ccc(cc1)C(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A17	compound treatment	1.219	0.0895	1.21	1.478	0.0372	0.51	1.213	0.9259	1916857	CBDivE_006737	COC(=O)NCCOC(=O)Nc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A18	compound treatment	1.167	0.0375	0.51	1.383	-0.0578	-0.79	-0.1991	-0.2126	1916858	CBDivE_006738	O=C(NCC/N=C/c1cccnc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A19	compound treatment	1.144	0.0145	0.2	1.481	0.0402	0.55	0.5265	0.9037	1916859	CBDivE_006739	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	A20	compound treatment	1.109	-0.0205	-0.28	1.415	-0.0258	-0.35	-0.4438	-0.9929	1304739	CBDivE_006740	COc1cc(OC)cc(c1)C(=O)NCC2(OC3C=C2)C4C3C(=O)N(C4=O)c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B01	compound treatment	1.147	0.0175	0.24	1.353	-0.0878	-1.2	-0.6791	-0.5567	1916860	CBDivE_006741	Clc1cccc(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B02	compound treatment	1.129	-4.8E-4	-0.01	1.462	0.0212	0.29	0.2002	0.6911	1916861	CBDivE_006742	Cc1ccc(cc1)S(=O)(=O)/N=C(/N=S(=O)(c2ccccc2)c3ccccc3)\c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B03	compound treatment	1.143	0.0135	0.18	1.42	-0.0208	-0.28	-0.0712	-0.2115	1916862	CBDivE_006743	O/N=C(\c1ccc-2c(Cc3ccccc32)c1)/c4ccccc4C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B04	compound treatment	1.125	-0.00448	-0.06	1.449	0.00824	0.11	0.0367	0.2876	1916863	CBDivE_006744	CCN(CC)CCCOC(=O)C(OC)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B05	compound treatment	1.115	-0.0145	-0.2	1.465	0.0242	0.33	0.0956	0.2489	1916864	CBDivE_006745	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2ccc(N=Nc3ccccc3)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B06	compound treatment	1.089	-0.0405	-0.55	1.42	-0.0208	-0.28	-0.5864	-0.9532	1916865	CBDivE_006746	OS(=O)(=O)CCC[n+]1c(/C=C/Nc2ccccc2)oc3ccc4ccccc4c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B07	compound treatment	1.144	0.0145	0.2	1.473	0.0322	0.44	0.4493	0.9337	1916866	CBDivE_006747	CCOC(=O)c1c(NC(=O)CN2CCN(C)CC2)sc(Br)c1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B08	compound treatment	1.2	0.0705	0.95	1.408	-0.0328	-0.45	0.3568	0.3395	1101400	CBDivE_006748	OC(=O)c1ccccc1NSc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B09	compound treatment	1.116	-0.0135	-0.18	1.466	0.0252	0.34	0.1147	0.2948	1916867	CBDivE_006749	OCCCCCCNc1ncnc2n(cnc12)C3OC(CO)C(O)C3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B10	compound treatment	1.201	0.0715	0.96	1.467	0.0262	0.36	0.9352	0.9088	1440548	CBDivE_006750	Cc1oc2cc(OC(=O)c3ccccc3)ccc2c(=O)c1c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B11	compound treatment	1.09	-0.0395	-0.53	1.4	-0.0408	-0.56	-0.7697	-0.9998	1916868	CBDivE_006751	FC(F)(F)c1ccc(Cl)c(NC(NC(=O)c2cccnc2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B12	compound treatment	1.109	-0.0205	-0.28	1.437	-0.00376	-0.05	-0.2317	-0.8244	1400582	CBDivE_006752	COc1ccc(NC(=O)COc2cc(C)ccc2C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B13	compound treatment	1.146	0.0165	0.22	1.396	-0.0448	-0.61	-0.274	-0.4217	1916869	CBDivE_006753	OC(=O)CCCCCN1C(=O)/C(=C/2\SC(=S)N(CCCCCC(=O)O)C2=O)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B14	compound treatment	1.103	-0.0265	-0.36	1.461	0.0202	0.28	-0.0575	-0.1273	1112779	CBDivE_006754	COc1ccc(NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B15	compound treatment	1.103	-0.0265	-0.36	1.424	-0.0168	-0.23	-0.4143	-0.9767	1916870	CBDivE_006755	NC(=O)CC(N1C(=O)/C(=C\2/C(=O)Nc3ccccc23)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B16	compound treatment	1.097	-0.0325	-0.44	1.426	-0.0148	-0.2	-0.4522	-0.9378	1916871	CBDivE_006756	C/C(=N\OC(=O)c1cccc(c1)[N+](=O)[O-])/c2nonc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B17	compound treatment	1.152	0.0225	0.3	1.437	-0.00376	-0.05	0.1785	0.5794	1916872	CBDivE_006757	Oc1ccccc1NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B18	compound treatment	1.114	-0.0155	-0.21	1.433	-0.00776	-0.11	-0.2225	-0.9504	1916873	CBDivE_006758	O=C(N/N=C/c1ccc2OCOc2c1)[C@H]3C[C@@H]3C(=O)N/N=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B19	compound treatment	1.121	-0.00848	-0.11	1.349	-0.0918	-1.25	-0.9657	-0.7685	1916874	CBDivE_006759	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2cc(Cl)ccc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	B20	compound treatment	1.074	-0.0555	-0.75	1.442	0.00124	0.02	-0.5173	-0.691	1916875	CBDivE_006760	[O-][N+](=O)c1cccc(/C=N/OC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C01	compound treatment	1.099	-0.0305	-0.41	1.425	-0.0158	-0.21	-0.4428	-0.9542	1681363	CBDivE_006761	O=C(Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C02	compound treatment	1.12	-0.00948	-0.13	1.413	-0.0278	-0.38	-0.3581	-0.8962	1630369	CBDivE_006762	C(Cc1ccco1)C2=NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C03	compound treatment	1.268	0.139	1.87	1.484	0.0432	0.59	1.7383	0.8871	1214076	CBDivE_006763	Clc1ccc(OCC(=O)OCC(=O)c2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C04	compound treatment	1.151	0.0215	0.29	1.41	-0.0308	-0.42	-0.0914	-0.1791	1916876	CBDivE_006764	Fc1c(F)c(F)c(C(=O)Nc2ccc(cc2)C(=O)Nc3ccc4ccccc4c3)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C05	compound treatment	1.154	0.0245	0.33	1.504	0.0632	0.86	0.8436	0.9135	1916877	CBDivE_006765	Clc1ccc(NC(=O)ON=c2cc(oc3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C06	compound treatment	1.157	0.0275	0.37	1.441	2.35E-4	0.0	0.2648	0.7132	1916878	CBDivE_006766	C(=N/c1ccc2ncccc2c1)\c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C07	compound treatment	1.186	0.0565	0.76	1.476	0.0352	0.48	0.8789	0.9752	1173637	CBDivE_006767	Oc1ccc2ccccc2c1CN3CCC(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C08	compound treatment	1.142	0.0125	0.17	1.452	0.0112	0.15	0.2278	0.9988	1916879	CBDivE_006768	Oc1ccccc1/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C09	compound treatment	1.127	-0.00248	-0.03	1.46	0.0192	0.26	0.1618	0.612	1561683	CBDivE_006769	C(Nc1nc2ccccc2s1)n3cnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C10	compound treatment	1.152	0.0225	0.3	1.476	0.0352	0.48	0.5546	0.9756	1916880	CBDivE_006770	COc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C11	compound treatment	1.258	0.129	1.73	1.477	0.0362	0.49	1.5754	0.8738	1608001	CBDivE_006771	OC(=O)c1ccccc1NCn2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C12	compound treatment	1.142	0.0125	0.17	1.441	2.35E-4	0.0	0.1217	0.7204	1226428	CBDivE_006772	COC(=O)C(Cc1ccccc1)NC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C13	compound treatment	1.174	0.0445	0.6	1.546	0.105	1.44	1.4394	0.9253	1916881	CBDivE_006773	OC(=O)c1ccc(cc1NC(=O)c2cccc3ccccc23)C(=O)c4ccc(C(=O)O)c(NC(=O)c5cccc6ccccc56)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C14	compound treatment	1.167	0.0375	0.51	1.486	0.0452	0.62	0.7941	0.9952	1333275	CBDivE_006774	Brc1ccc(NC(=O)c2ccco2)c3ncccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C15	compound treatment	1.204	0.0745	1.01	1.492	0.0512	0.7	1.2049	0.9842	1916882	CBDivE_006775	Nc1ccc2c3nc4cc(Cc5ccc6c(c5)nc7c8ccc(N)c9cccc(c(=O)n67)c98)ccc4n3c(=O)c%10cccc1c%102
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C16	compound treatment	1.15	0.0205	0.28	1.436	-0.00476	-0.06	0.1498	0.5268	1916883	CBDivE_006776	CCCCN1C(=O)C2Cc3c([nH]c4ccccc34)C(N2C1=O)c5cccc(O)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C17	compound treatment	1.183	0.0535	0.72	1.454	0.0132	0.18	0.6382	0.8575	1916884	CBDivE_006777	Cc1ccc(cc1[N+](=O)[O-])c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C18	compound treatment	1.138	0.00852	0.11	1.445	0.00424	0.06	0.1221	0.9493	1259789	CBDivE_006778	Ic1ccc(cc1)C(=O)Cn2c3CCCCc3sc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C19	compound treatment	1.205	0.0755	1.02	1.461	0.0202	0.28	0.9155	0.8674	1916885	CBDivE_006779	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	C20	compound treatment	1.121	-0.00848	-0.11	1.437	-0.00376	-0.05	-0.1172	-0.9346	1916886	CBDivE_006780	Clc1ccc(cc1Cl)c2cn3ccsc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D01	compound treatment	1.101	-0.0285	-0.38	1.376	-0.0648	-0.88	-0.8962	-0.9305	1916887	CBDivE_006781	CC(C)C(N1C(=O)/C(=C\2/C(=O)Nc3ccc(Br)cc23)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D02	compound treatment	1.097	-0.0325	-0.44	1.38	-0.0608	-0.83	-0.8958	-0.9556	1916888	CBDivE_006782	[O-][N+](=O)c1ccc(o1)C2Nc3cc4Nc5nonc5Nc4cc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D03	compound treatment	1.017	-0.112	-1.52	1.435	-0.00576	-0.08	-1.1286	-0.7427	1916889	CBDivE_006783	NS(=O)(=O)c1ccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D04	compound treatment	1.127	-0.00248	-0.03	1.399	-0.0418	-0.57	-0.4264	-0.7474	1916890	CBDivE_006784	CCC(=O)NC(NC(=S)Nc1sc2CCCCc2c1C(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D05	compound treatment	1.071	-0.0585	-0.79	1.444	0.00324	0.04	-0.5267	-0.6665	1916891	CBDivE_006785	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2ccc(Br)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D06	compound treatment	1.146	0.0165	0.22	1.435	-0.00576	-0.08	0.102	0.4316	1916892	CBDivE_006786	CCO/C(=C\c1oc2ccc(OC)cc2[n+]1CCCS(=O)(=O)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D07	compound treatment	1.128	-0.00148	-0.02	1.444	0.00324	0.04	0.0171	0.3527	1916893	CBDivE_006787	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2cccc(Cl)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D08	compound treatment	1.092	-0.0375	-0.51	1.41	-0.0308	-0.42	-0.6542	-0.9957	1916894	CBDivE_006788	COC(=O)C(C)NC(=O)COc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D09	compound treatment	1.098	-0.0315	-0.42	1.423	-0.0178	-0.24	-0.4716	-0.9646	1916895	CBDivE_006789	O=C(COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)NNC(=S)Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D10	compound treatment	1.075	-0.0545	-0.73	1.442	0.00124	0.02	-0.5078	-0.6907	1916896	CBDivE_006790	O=C(NCCCN1CCCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D11	compound treatment	1.101	-0.0285	-0.38	1.501	0.0602	0.82	0.3091	0.3409	1916897	CBDivE_006791	O=C(Nc1ccccc1)C(C(=O)c2ccccc2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D12	compound treatment	1.151	0.0215	0.29	1.46	0.0192	0.26	0.3908	0.9987	1916898	CBDivE_006792	Cc1ccc(OCC(=O)Nc2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D13	compound treatment	1.173	0.0435	0.59	1.408	-0.0328	-0.45	0.0992	0.1345	1916899	CBDivE_006793	OC(=O)CCN1C(=O)/C(=C/2\SC(=S)N(CCC(=O)O)C2=O)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D14	compound treatment	1.111	-0.0185	-0.25	1.395	-0.0458	-0.62	-0.6176	-0.919	1619574	CBDivE_006794	Cc1ccc(OCC(=O)Nc2cccc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D15	compound treatment	1.089	-0.0405	-0.55	1.463	0.0222	0.3	-0.1717	-0.275	1916900	CBDivE_006795	Oc1cccc(NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4cccc(O)c4)C3=O)/SC2=S)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D16	compound treatment	1.117	-0.0125	-0.17	1.352	-0.0888	-1.21	-0.975	-0.7978	1916901	CBDivE_006796	C/C(=N\OC(=O)Nc1ccccc1)/c2nonc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D17	compound treatment	1.094	-0.0355	-0.48	1.446	0.00524	0.07	-0.288	-0.5951	1916902	CBDivE_006797	OC(=O)CC(N1C(=O)/C(=C/C=C/c2ccccc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D18	compound treatment	1.076	-0.0535	-0.72	1.426	-0.0148	-0.2	-0.6525	-0.8712	1738152	CBDivE_006798	CC(=O)Nc1ccccc1c2n[nH]c(=S)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D19	compound treatment	1.164	0.0345	0.47	1.477	0.0362	0.49	0.6787	0.9996	1916903	CBDivE_006799	FC(F)(F)c1cccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	D20	compound treatment	1.098	-0.0315	-0.42	1.454	0.0132	0.18	-0.1727	-0.3742	1916904	CBDivE_006800	C/C(=N\OC(=O)Nc1ccccc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E01	compound treatment	1.164	0.0345	0.47	1.417	-0.0238	-0.32	0.1002	0.1765	1916905	CBDivE_006801	O=C(NN=C(/C=C/c1ccccc1)/C=C/c2ccccc2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E02	compound treatment	1.124	-0.00548	-0.07	1.403	-0.0378	-0.51	-0.4164	-0.8004	1342401	CBDivE_006802	COc1ccc(CCC2=NCCn3cccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E03	compound treatment	1.141	0.0115	0.16	1.441	2.35E-4	0.0	0.1122	0.7215	1568691	CBDivE_006803	CC(C)(CO)Nc1nc(Cl)nc(n1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E04	compound treatment	1.156	0.0265	0.36	1.447	0.00624	0.09	0.3131	0.8514	1344158	CBDivE_006804	OC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)Nc5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E05	compound treatment	1.172	0.0425	0.57	1.495	0.0542	0.74	0.9286	0.9921	1916906	CBDivE_006805	Clc1ccc(NC(=O)O/N=C/2\CCc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E06	compound treatment	1.124	-0.00548	-0.07	1.434	-0.00676	-0.09	-0.1175	-0.994	1368977	CBDivE_006806	Brc1ccc(OCC(=O)N2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E07	compound treatment	1.124	-0.00548	-0.07	1.517	0.0762	1.04	0.6828	0.6552	1916907	CBDivE_006807	CC(=O)C1=C(C)NC(NC1c2cccc(c2)[N+](=O)[O-])c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E08	compound treatment	1.182	0.0525	0.71	1.502	0.0612	0.84	1.0915	0.9967	1916908	CBDivE_006808	Oc1ccccc1/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E09	compound treatment	1.258	0.129	1.73	1.453	0.0122	0.17	1.344	0.7716	1551516	CBDivE_006809	CN1CCC(=CC1)CNc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E10	compound treatment	1.17	0.0405	0.55	1.471	0.0302	0.41	0.6781	0.9903	1916909	CBDivE_006810	Oc1ccc(cc1)C(=O)N/N=C\c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E11	compound treatment	1.184	0.0545	0.74	1.538	0.0972	1.33	1.4577	0.9613	1916910	CBDivE_006811	O(c1ccccc1)c2ccc(cc2)c3cc(cc(c3)c4ccc(Oc5ccccc5)cc4)c6ccc(Oc7ccccc7)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E12	compound treatment	1.094	-0.0355	-0.48	1.413	-0.0278	-0.38	-0.6062	-0.9933	1916911	CBDivE_006812	CCCCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E13	compound treatment	1.152	0.0225	0.3	1.445	0.00424	0.06	0.2557	0.8267	1689523	CBDivE_006813	OP(=O)(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E14	compound treatment	1.087	-0.0425	-0.57	1.445	0.00424	0.06	-0.3644	-0.6326	1916912	CBDivE_006814	COC(=O)/C(=C\c1c[nH]c2ccccc12)/NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E15	compound treatment	1.197	0.0675	0.91	1.458	0.0172	0.24	0.8103	0.8613	1916913	CBDivE_006815	Oc1ccccc1/C=N/c2ccc(Cc3ccc(\N=C\c4ccccc4O)c(O)c3)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E16	compound treatment	1.124	-0.00548	-0.07	1.442	0.00124	0.02	-0.0404	-0.5324	1916914	CBDivE_006816	Cc1cccn(CC(=O)c2ccc(Cl)c(Cl)c2)c1=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E17	compound treatment	1.21	0.0805	1.09	1.498	0.0572	0.78	1.32	0.9868	1916915	CBDivE_006817	CCOC(=O)c1c(NC(=O)CNC2CCCCC2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E18	compound treatment	1.145	0.0155	0.21	1.445	0.00424	0.06	0.1889	0.8697	1916916	CBDivE_006818	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E19	compound treatment	1.221	0.0915	1.23	1.532	0.0912	1.24	1.7528	1.0	1916917	CBDivE_006819	Oc1ccc(cc1)C(=O)N/N=C/c2cccc(I)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	E20	compound treatment	1.175	0.0455	0.61	1.468	0.0272	0.37	0.6968	0.971	1446258	CBDivE_006820	COC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F01	compound treatment	1.09	-0.0395	-0.53	1.326	-0.115	-1.56	-1.4832	-0.8972	1916918	CBDivE_006821	CC(=O)c1ccc(NC(=O)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F02	compound treatment	1.091	-0.0385	-0.52	1.356	-0.0848	-1.16	-1.1844	-0.9347	1916919	CBDivE_006822	Cc1cc(ccc1NC(=O)COc2ccc(Cl)cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F03	compound treatment	1.062	-0.0675	-0.91	1.402	-0.0388	-0.53	-1.0175	-0.9666	1916920	CBDivE_006823	CC(C)(C)C(=O)NC(NC(=S)Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F04	compound treatment	1.086	-0.0435	-0.59	1.381	-0.0598	-0.81	-0.991	-0.987	1916921	CBDivE_006824	CC(C)C(=O)NC(NC(=S)Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F05	compound treatment	1.09	-0.0395	-0.53	1.445	0.00424	0.06	-0.3358	-0.6268	1916922	CBDivE_006825	Cc1ccc(cc1)S(=O)(=O)NNC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F06	compound treatment	1.118	-0.0115	-0.15	1.418	-0.0228	-0.31	-0.329	-0.9484	1916923	CBDivE_006826	CC/C(=C/c1sc2cc(OC)c3ccsc3c2[n+]1CCCS(=O)(=O)O)/SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F07	compound treatment	1.157	0.0275	0.37	1.371	-0.0698	-0.95	-0.4102	-0.4017	1916924	CBDivE_006827	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2ccc(Cl)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F08	compound treatment	1.126	-0.00348	-0.05	1.465	0.0242	0.33	0.2005	0.6006	1916925	CBDivE_006828	COc1ccccc1NC(=S)NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F09	compound treatment	1.059	-0.0705	-0.95	1.467	0.0262	0.36	-0.4194	-0.4128	1916926	CBDivE_006829	[O-][N+](=O)c1cccc(c1)C(=O)NC(NC(=S)Nc2ccc(N=Nc3ccccc3)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F10	compound treatment	1.126	-0.00348	-0.05	1.451	0.0102	0.14	0.0655	0.4448	1565414	CBDivE_006830	O=C(NCC1(OC2C=C1)C3C2C(=O)N(C3=O)c4ccccc4)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F11	compound treatment	1.087	-0.0425	-0.57	1.496	0.0552	0.75	0.1274	0.1346	1916927	CBDivE_006831	Nc1nc2n(C3OC(CO)C(O)C3O)c(=O)[nH]c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F12	compound treatment	1.033	-0.0965	-1.3	1.399	-0.0418	-0.57	-1.3231	-0.9313	1154870	CBDivE_006832	COc1ccc(NC(=O)COc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F13	compound treatment	1.097	-0.0325	-0.44	1.447	0.00624	0.09	-0.2497	-0.5595	1916928	CBDivE_006833	ClC(Cl)(Cl)C(NC(=O)c1ccccc1)n2cnc3c(ncnc23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F14	compound treatment	1.092	-0.0375	-0.51	1.436	-0.00476	-0.06	-0.4035	-0.7915	1916929	CBDivE_006834	[O-][N+](=O)c1ccc(OCC(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F15	compound treatment	1.138	0.00852	0.11	1.487	0.0462	0.63	0.5271	0.8225	1916930	CBDivE_006835	OC(=O)c1ccccc1NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccccc4C(=O)O)C3=O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F16	compound treatment	1.106	-0.0235	-0.32	1.414	-0.0268	-0.36	-0.4821	-0.9975	1916931	CBDivE_006836	COc1cccc(/C=N/OC(=O)c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F17	compound treatment	1.082	-0.0475	-0.64	1.462	0.0212	0.29	-0.2482	-0.353	1916932	CBDivE_006837	Oc1c(CC=C)cccc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F18	compound treatment	1.118	-0.0115	-0.15	1.444	0.00324	0.04	-0.0783	-0.4863	1916933	CBDivE_006838	FC(F)(F)C(=O)NC(CC(=O)NCC=C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F19	compound treatment	1.073	-0.0565	-0.76	1.443	0.00224	0.03	-0.5172	-0.6783	1916934	CBDivE_006839	CC(=O)c1cccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	F20	compound treatment	1.068	-0.0615	-0.83	1.388	-0.0528	-0.72	-1.0953	-0.9975	1916935	CBDivE_006840	Oc1ccc(/C=N/OC(=O)Nc2ccccc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G01	compound treatment	1.131	0.00152	0.02	1.398	-0.0428	-0.58	-0.3979	-0.6818	1916936	CBDivE_006841	COc1ccc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G02	compound treatment	1.072	-0.0575	-0.78	1.419	-0.0218	-0.3	-0.7582	-0.9131	1588520	CBDivE_006842	C(Cc1ccccc1)C2=NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G03	compound treatment	1.224	0.0945	1.28	1.451	0.0102	0.14	1.0004	0.7798	1916937	CBDivE_006843	COC(=O)CNC(=O)COc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G04	compound treatment	1.15	0.0205	0.28	1.461	0.0202	0.28	0.3909	1.0	1916938	CBDivE_006844	OS(=O)(=O)c1ccc(Cl)c(c1)N2N=C(CC2=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G05	compound treatment	1.159	0.0295	0.4	1.443	0.00224	0.03	0.3032	0.759	1336210	CBDivE_006845	COc1ccc(cc1)C2Nc3ccc4ccccc4c3C5=C2C(=O)CC(C)(C)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G06	compound treatment	1.146	0.0165	0.22	1.417	-0.0238	-0.32	-0.0716	-0.1819	1916939	CBDivE_006846	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G07	compound treatment	1.166	0.0365	0.49	1.449	0.00824	0.11	0.4278	0.8466	1916940	CBDivE_006847	[O-][N+](=O)c1ccc(cc1)c2n[nH]c(=S)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G08	compound treatment	1.135	0.00552	0.07	1.45	0.00924	0.13	0.1417	0.9686	1916941	CBDivE_006848	[O-][N+](=O)c1ccccc1/C=N/NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G09	compound treatment	1.167	0.0375	0.51	1.512	0.0712	0.97	1.0448	0.9538	1777881	CBDivE_006849	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Oc3cccc(Oc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G10	compound treatment	1.143	0.0135	0.18	1.506	0.0652	0.89	0.758	0.8347	1916942	CBDivE_006850	COc1cc(/C=C\2/SC(=S)N(CO)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G11	compound treatment	1.209	0.0795	1.07	1.521	0.0802	1.09	1.5322	1.0	1697196	CBDivE_006851	C(Nc1cccc2ccccc12)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G12	compound treatment	1.069	-0.0605	-0.82	1.474	0.0332	0.45	-0.2565	-0.2748	1916943	CBDivE_006852	CC(C)C(NC(=O)OCc1ccccc1)C(=O)OCC2OC(O)C(O)C(O)C2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G13	compound treatment	1.158	0.0285	0.38	1.447	0.00624	0.09	0.3322	0.843	1916944	CBDivE_006853	CN(CC(O)COc1cccc(Br)c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G14	compound treatment	1.102	-0.0275	-0.37	1.473	0.0322	0.44	0.0487	0.0847	1916945	CBDivE_006854	CN(C)Cc1c(Oc2ccco2)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G15	compound treatment	1.181	0.0515	0.7	1.559	0.118	1.61	1.6315	0.9293	1916946	CBDivE_006855	Oc1ccccc1/C=N/c2cccc(c2)C3(c4ccccc4-c5ccccc53)c6cccc(\N=C\c7ccccc7O)c6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G16	compound treatment	1.117	-0.0125	-0.17	1.493	0.0522	0.71	0.3846	0.5255	1222728	CBDivE_006856	OC(=O)c1cccc(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G17	compound treatment	1.179	0.0495	0.67	1.492	0.0512	0.7	0.9664	0.9997	1916947	CBDivE_006857	C/C(=N/NC(=O)c1ccccc1)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G18	compound treatment	1.11	-0.0195	-0.26	1.43	-0.0108	-0.15	-0.2896	-0.9622	1916948	CBDivE_006858	CCCCNS(=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G19	compound treatment	1.213	0.0835	1.13	1.446	0.00524	0.07	0.8472	0.7504	1916949	CBDivE_006859	CN(C)c1ccc(cc1)/C(=N\NC(=O)c2ccc(O)cc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	G20	compound treatment	1.147	0.0175	0.24	1.415	-0.0258	-0.35	-0.0813	-0.192	1119693	CBDivE_006860	Clc1ccccc1C(=O)Nc2nnn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H01	compound treatment	1.1	-0.0295	-0.4	1.293	-0.148	-2.01	-1.706	-0.8306	1710305	CBDivE_006861	COC(=O)c1ccc(NC(=O)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H02	compound treatment	1.103	-0.0265	-0.36	1.436	-0.00476	-0.06	-0.2985	-0.8222	1151728	CBDivE_006862	COc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H03	compound treatment	1.155	0.0255	0.34	1.377	-0.0638	-0.87	-0.3714	-0.3971	1916950	CBDivE_006863	Oc1ccccc1NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H04	compound treatment	1.14	0.0105	0.14	1.451	0.0102	0.14	0.199	1.0	1916951	CBDivE_006864	NC(=O)c1c(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H05	compound treatment	1.076	-0.0535	-0.72	1.408	-0.0328	-0.45	-0.8261	-0.9735	1916952	CBDivE_006865	O=C(CCN1C(=O)/C(=C/c2ccccc2)/SC1=S)NNS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H06	compound treatment	1.111	-0.0185	-0.25	1.395	-0.0458	-0.62	-0.6176	-0.919	1916953	CBDivE_006866	OC(C(=O)OCCCN1CCCC1)(c2ccc(Br)cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H07	compound treatment	1.082	-0.0475	-0.64	1.41	-0.0308	-0.42	-0.7496	-0.979	1916954	CBDivE_006867	OC(=O)c1cccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H08	compound treatment	1.11	-0.0195	-0.26	1.424	-0.0168	-0.23	-0.3475	-0.9976	1916955	CBDivE_006868	O=Cc1ccc(OC2OCCOC2Oc3ccc(C=O)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H09	compound treatment	1.082	-0.0475	-0.64	1.407	-0.0338	-0.46	-0.7785	-0.9869	1916956	CBDivE_006869	Cc1cccc(c1)C(=O)NC(NC(=S)Nc2ccc(cc2)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H10	compound treatment	1.099	-0.0305	-0.41	1.489	0.0482	0.66	0.1743	0.2248	1774376	CBDivE_006870	OC(=O)c1cccc(c1)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H11	compound treatment	1.192	0.0625	0.84	1.392	-0.0488	-0.66	0.1262	0.1175	1916957	CBDivE_006871	CC(C)(CNCC(O)COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)NCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H12	compound treatment	1.111	-0.0185	-0.25	1.455	0.0142	0.19	-0.039	-0.1235	1916958	CBDivE_006872	OC(=O)c1cccc(NSc2ccccc2[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H13	compound treatment	1.176	0.0465	0.63	1.539	0.0982	1.34	1.391	0.9403	1916959	CBDivE_006873	COC(=O)c1ccccc1NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H14	compound treatment	1.111	-0.0185	-0.25	1.434	-0.00676	-0.09	-0.2415	-0.9086	1916960	CBDivE_006874	[O-][N+](=O)c1ccc(OCC(=O)NCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H15	compound treatment	1.089	-0.0405	-0.55	1.439	-0.00176	-0.02	-0.4032	-0.7376	1916961	CBDivE_006875	Oc1cccc(NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4cccc(O)c4)C3=O)/SC2=S)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H16	compound treatment	1.065	-0.0645	-0.87	1.468	0.0272	0.37	-0.3525	-0.3727	1614802	CBDivE_006876	Oc1ccc(Oc2ccc(cc2)C(=O)OCC(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H17	compound treatment	1.09	-0.0395	-0.53	1.457	0.0162	0.22	-0.2201	-0.3815	1916962	CBDivE_006877	OC(=O)c1ccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H18	compound treatment	1.123	-0.00648	-0.09	1.379	-0.0618	-0.84	-0.6574	-0.7763	1648122	CBDivE_006878	CN(c1ccc2cccc(O)c2n1)c3ccc4cccc(O)c4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H19	compound treatment	1.11	-0.0195	-0.26	1.455	0.0142	0.19	-0.0486	-0.1486	1608971	CBDivE_006879	Clc1ccccc1NC(=O)CN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	H20	compound treatment	1.089	-0.0405	-0.55	1.405	-0.0358	-0.49	-0.731	-0.9984	1916963	CBDivE_006880	COc1ccc(O)c(/C=N/OC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I01	compound treatment	1.149	0.0195	0.26	1.423	-0.0178	-0.24	0.0149	0.0417	1916964	CBDivE_006881	O=C(COc1ccccc1)NNC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I02	compound treatment	1.083	-0.0465	-0.63	1.436	-0.00476	-0.06	-0.4893	-0.7762	1336005	CBDivE_006882	COc1ccc(cc1)C2NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I03	compound treatment	1.173	0.0435	0.59	1.478	0.0372	0.51	0.7742	0.9974	1916965	CBDivE_006883	Nc1ccc2c3nc4cc(Oc5ccc6c(c5)nc7c8ccc(N)c9cccc(c(=O)n67)c98)ccc4n3c(=O)c%10cccc1c%102
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I04	compound treatment	1.104	-0.0255	-0.34	1.417	-0.0238	-0.32	-0.4722	-0.9996	1916966	CBDivE_006884	Oc1ccc2ccccc2c1/C=N/c3ccc4ncccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I05	compound treatment	1.133	0.00352	0.05	1.451	0.0102	0.14	0.1323	0.8972	1358660	CBDivE_006885	COc1nc(Nc2ccc(C)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I06	compound treatment	1.126	-0.00348	-0.05	1.467	0.0262	0.36	0.2198	0.6091	1916967	CBDivE_006886	CC(=O)N/N=C(\C)/c1cc(O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I07	compound treatment	1.153	0.0235	0.32	1.514	0.0732	1.0	0.9305	0.888	1916968	CBDivE_006887	CCOC(=O)c1ccccc1NCn2nc(oc2=S)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I08	compound treatment	1.107	-0.0225	-0.3	1.529	0.0882	1.2	0.6364	0.5128	1916969	CBDivE_006888	[O-][N+](=O)c1ccc(/C=N/NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I09	compound treatment	1.207	0.0775	1.05	1.462	0.0212	0.29	0.9442	0.8702	1375425	CBDivE_006889	CCCC1(CN2CN3C1)C(=O)C(CCC)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I10	compound treatment	1.174	0.0445	0.6	1.475	0.0342	0.47	0.7548	0.9922	1916970	CBDivE_006890	OC(=O)CCNc1c(cc([N+](=O)[O-])c2ccccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I11	compound treatment	1.163	0.0335	0.45	1.49	0.0492	0.67	0.7945	0.9815	1916971	CBDivE_006891	COc1nc(NCCCN2CCOCC2)nc(n1)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I12	compound treatment	1.138	0.00852	0.11	1.467	0.0262	0.36	0.3342	0.8895	1916972	CBDivE_006892	CCOC(=O)CN1CCOCCOCCN(CC(=O)OCC)CCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I13	compound treatment	1.218	0.0885	1.19	1.47	0.0292	0.4	1.1263	0.8946	1916973	CBDivE_006893	Oc1ccccc1/C=N/c2ccc(cc2)C3(NC(=O)c4ccccc43)c5ccc(\N=C\c6ccccc6O)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I14	compound treatment	1.176	0.0465	0.63	1.47	0.0292	0.4	0.7257	0.976	1916974	CBDivE_006894	[O-][N+](=O)c1ccccc1/C=N/NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I15	compound treatment	1.158	0.0285	0.38	1.544	0.103	1.41	1.2675	0.8685	1916975	CBDivE_006895	Cc1cc(CSC(=N)N)c(O)c(C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I16	compound treatment	1.159	0.0295	0.4	1.422	-0.0188	-0.26	0.1007	0.2127	1157157	CBDivE_006896	Cc1ccc(C)n1c2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I17	compound treatment	1.187	0.0575	0.78	1.488	0.0472	0.64	1.0042	0.9957	1916976	CBDivE_006897	OCCCNC(=O)c1cccc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I18	compound treatment	1.111	-0.0185	-0.25	1.468	0.0272	0.37	0.0863	0.193	1916977	CBDivE_006898	COC(=O)NCCOC(=O)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I19	compound treatment	1.186	0.0565	0.76	1.47	0.0292	0.4	0.8211	0.9543	1916978	CBDivE_006899	Oc1ccc(cc1)C(=O)N/N=C\c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	I20	compound treatment	1.153	0.0235	0.32	1.428	-0.0128	-0.17	0.1013	0.2799	1916979	CBDivE_006900	COc1ccc(CCNC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J01	compound treatment	1.093	-0.0365	-0.49	1.356	-0.0848	-1.16	-1.1653	-0.9276	1481630	CBDivE_006901	COc1ccc(cc1)C2CC(=NN2S(=O)(=O)c3ccc(C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J02	compound treatment	1.096	-0.0335	-0.45	1.451	0.0102	0.14	-0.2207	-0.4668	1916980	CBDivE_006902	OC(=O)C1CSC(N1)c2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J03	compound treatment	1.071	-0.0585	-0.79	1.35	-0.0908	-1.24	-1.433	-0.9763	1916981	CBDivE_006903	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J04	compound treatment	1.094	-0.0355	-0.48	1.447	0.00624	0.09	-0.2783	-0.5725	1916982	CBDivE_006904	CCCC(=O)NC(Nc1ccc2ccccc2c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J05	compound treatment	1.097	-0.0325	-0.44	1.429	-0.0118	-0.16	-0.4233	-0.9071	1916983	CBDivE_006905	CC(C)C(N1C(=O)/C(=C/c2ccccc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J06	compound treatment	1.083	-0.0465	-0.63	1.398	-0.0428	-0.58	-0.8557	-0.9993	1188899	CBDivE_006906	O=C(CN1C(=O)c2ccccc2C1=O)NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J07	compound treatment	1.121	-0.00848	-0.11	1.405	-0.0358	-0.49	-0.4257	-0.8499	1916984	CBDivE_006907	O=C(OCC1OC(C(OC(=O)c2ccccc2)C1OC(=O)c3ccccc3)n4nnc5cc6nc7ccccc7nc6cc45)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J08	compound treatment	1.124	-0.00548	-0.07	1.42	-0.0208	-0.28	-0.2525	-0.8628	1916985	CBDivE_006908	C/C(=N/O)/c1ccc(OCCO)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J09	compound treatment	1.106	-0.0235	-0.32	1.452	0.0112	0.15	-0.1156	-0.3287	1916986	CBDivE_006909	Cc1cccc(c1)C(=O)NC(NC(=S)Nc2ccccc2C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J10	compound treatment	1.069	-0.0605	-0.82	1.426	-0.0148	-0.2	-0.7193	-0.8559	1514986	CBDivE_006910	Cc1ccccc1NC(=O)c2ccc(N)cc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J11	compound treatment	1.117	-0.0125	-0.17	1.471	0.0302	0.41	0.1725	0.3873	1916987	CBDivE_006911	OC(=O)c1cc(N=Nc2nnn[nH]2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J12	compound treatment	1.091	-0.0385	-0.52	1.453	0.0122	0.17	-0.2491	-0.4568	1916988	CBDivE_006912	CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J13	compound treatment	1.127	-0.00248	-0.03	1.466	0.0252	0.34	0.2197	0.6354	1916989	CBDivE_006913	OC(=O)c1ccccc1NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J14	compound treatment	1.079	-0.0505	-0.68	1.369	-0.0718	-0.98	-1.1735	-0.9843	1916990	CBDivE_006914	Clc1cccc(c1)C(=O)NC(NC2CCS(=O)(=O)C2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J15	compound treatment	1.109	-0.0205	-0.28	1.488	0.0472	0.64	0.2601	0.3711	1916991	CBDivE_006915	Oc1ccc(NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4ccc(O)cc4)C3=O)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J16	compound treatment	1.036	-0.0935	-1.26	1.431	-0.00976	-0.13	-0.9859	-0.7774	1916992	CBDivE_006916	O=C(NC1c2ccccc2Oc3ccccc13)c4ccc(cc4)C(=O)NC5c6ccccc6Oc7ccccc57
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J17	compound treatment	1.083	-0.0465	-0.63	1.442	0.00124	0.02	-0.4315	-0.6879	1916993	CBDivE_006917	Clc1ccc(OS(=O)(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J18	compound treatment	1.049	-0.0805	-1.09	1.396	-0.0448	-0.61	-1.1994	-0.9629	1341633	CBDivE_006918	Cc1cc(C)c2ccc(NN)nc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J19	compound treatment	1.072	-0.0575	-0.78	1.456	0.0152	0.21	-0.4014	-0.5	1916994	CBDivE_006919	FC(F)(F)c1cccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	J20	compound treatment	1.137	0.00752	0.1	1.416	-0.0248	-0.34	-0.1671	-0.4738	1916995	CBDivE_006920	[O-][N+](=O)c1ccc(/C=N/OC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K01	compound treatment	1.178	0.0485	0.65	1.447	0.00624	0.09	0.523	0.7923	1465032	CBDivE_006921	Cc1ccc(OCC(=O)Nc2ncccc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K02	compound treatment	1.121	-0.00848	-0.11	1.41	-0.0308	-0.42	-0.3775	-0.8682	1916996	CBDivE_006922	[O-][N+](=O)c1cccc(c1)C(=O)CCNc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K03	compound treatment	1.125	-0.00448	-0.06	1.469	0.0282	0.39	0.2295	0.5889	1551493	CBDivE_006923	C1CN(CCO1)c2nc(Nc3ccccc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K04	compound treatment	1.125	-0.00448	-0.06	1.431	-0.00976	-0.13	-0.1369	-0.9361	1916997	CBDivE_006924	[O-][N+](=O)C(=C1Nc2ccccc2N1)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K05	compound treatment	1.176	0.0465	0.63	1.495	0.0542	0.74	0.9667	0.9967	1522901	CBDivE_006925	Cc1ccc(cc1)S(=O)(=O)NCC2(OC3C=C2)C4C3C(=O)N(Cc5ccccc5)C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K06	compound treatment	1.121	-0.00848	-0.11	1.442	0.00124	0.02	-0.069	-0.5966	1916998	CBDivE_006926	Oc1ccc(cc1)C(=O)N/N=C\c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K07	compound treatment	1.105	-0.0245	-0.33	1.466	0.0252	0.34	0.0098	0.0206	1916999	CBDivE_006927	Oc1ccccc1c2nn(CNc3ccc(cc3)[N+](=O)[O-])c(=S)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K08	compound treatment	1.118	-0.0115	-0.15	1.479	0.0382	0.52	0.2592	0.4765	1052238	CBDivE_006928	COc1ccc(C=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K09	compound treatment	1.124	-0.00548	-0.07	1.461	0.0202	0.28	0.1428	0.5	1327894	CBDivE_006929	OC(=O)C1CN(CCc2c[nH]c3ccccc23)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K10	compound treatment	1.125	-0.00448	-0.06	1.513	0.0722	0.99	0.6538	0.6625	1917000	CBDivE_006930	OCCCNCC(O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K11	compound treatment	1.152	0.0225	0.3	1.461	0.0202	0.28	0.4099	0.9988	1785286	CBDivE_006931	C1Oc2ccc(/C=C/c3ccncc3)cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K12	compound treatment	1.095	-0.0345	-0.47	1.454	0.0132	0.18	-0.2013	-0.4034	1917001	CBDivE_006932	[O-][N+](=O)c1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K13	compound treatment	1.132	0.00252	0.03	1.534	0.0932	1.27	0.9231	0.7258	1917002	CBDivE_006933	OC(=O)Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K14	compound treatment	1.105	-0.0245	-0.33	1.477	0.0362	0.49	0.1159	0.195	1916610	CBDivE_006934	OC(=O)c1cc(ccc1C(=O)Nc2cccc(O)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K15	compound treatment	1.152	0.0225	0.3	1.506	0.0652	0.89	0.8439	0.8977	1917003	CBDivE_006935	Cc1ccc(O)c(CCc2ccc(O)c(c2)S(=O)(=O)O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K16	compound treatment	1.185	0.0555	0.75	1.495	0.0542	0.74	1.0526	1.0	1917004	CBDivE_006936	CCCCCCc1ccc(cc1)C(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K17	compound treatment	1.192	0.0625	0.84	1.464	0.0232	0.32	0.8204	0.9106	1917005	CBDivE_006937	OCCC(NC1CCCCC1)C(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K18	compound treatment	1.143	0.0135	0.18	1.388	-0.0528	-0.72	-0.3798	-0.5117	1917006	CBDivE_006938	Cc1cc([N+](=O)[O-])c(NCCCO)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K19	compound treatment	1.175	0.0455	0.61	1.574	0.133	1.82	1.7189	0.8963	1256297	CBDivE_006939	C(Cc1ccco1)C2NCCn3cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	K20	compound treatment	1.167	0.0375	0.51	1.489	0.0482	0.66	0.823	0.9916	1917007	CBDivE_006940	[O-][N+](=O)c1cccc(c1)S(=O)(=O)NCCOC(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L01	compound treatment	1.12	-0.00948	-0.13	1.394	-0.0468	-0.64	-0.5414	-0.8323	1917008	CBDivE_006941	CN(N=Nc1ccc2ccccc2c1)c3c(C)n(C)n(c4ccccc4)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L02	compound treatment	1.082	-0.0475	-0.64	1.362	-0.0788	-1.07	-1.2124	-0.9695	1917009	CBDivE_006942	Clc1ccccc1C(=O)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L03	compound treatment	1.138	0.00852	0.11	1.399	-0.0418	-0.57	-0.3214	-0.5532	1917010	CBDivE_006943	Clc1ccc(OS(=O)(=O)CCN2C(=O)NC3(CCCCC3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L04	compound treatment	1.072	-0.0575	-0.78	1.41	-0.0308	-0.42	-0.845	-0.9584	1917011	CBDivE_006944	[O-][N+](=O)c1ccc(OCCOC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L05	compound treatment	1.038	-0.0915	-1.23	1.433	-0.00776	-0.11	-0.9475	-0.765	1917012	CBDivE_006945	NNc1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L06	compound treatment	1.112	-0.0175	-0.24	1.411	-0.0298	-0.41	-0.4537	-0.9666	1580685	CBDivE_006946	CCc1ccccc1NC(=O)C(C(C)C)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L07	compound treatment	1.096	-0.0335	-0.45	1.421	-0.0198	-0.27	-0.51	-0.9696	1917013	CBDivE_006947	CC[n+]1c2ccccc2nc3ccc(NCCC(=O)O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L08	compound treatment	1.064	-0.0655	-0.88	1.432	-0.00876	-0.12	-0.7091	-0.7955	1176613	CBDivE_006948	CC(C)C(N1C(=O)c2ccccc2C1=O)C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L09	compound treatment	1.123	-0.00648	-0.09	1.434	-0.00676	-0.09	-0.127	-0.9996	1917014	CBDivE_006949	Cc1ccccc1C(=O)NC(NC(=S)Nc2cccc(c2)C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L10	compound treatment	1.1	-0.0295	-0.4	1.368	-0.0728	-0.99	-0.9828	-0.9194	1775328	CBDivE_006950	OC(=O)c1ccccc1N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L11	compound treatment	1.089	-0.0405	-0.55	1.417	-0.0238	-0.32	-0.6153	-0.969	1917015	CBDivE_006951	CCOC(=O)c1sc(N/N=C/2\C(=NN(C2=O)c3ccccc3)N)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L12	compound treatment	1.092	-0.0375	-0.51	1.428	-0.0128	-0.17	-0.4806	-0.8988	1248505	CBDivE_006952	Oc1ccc2ccccc2c1C(NC(=O)c3ccc(Cl)cc3Cl)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L13	compound treatment	1.147	0.0175	0.24	1.473	0.0322	0.44	0.478	0.9577	1917016	CBDivE_006953	Oc1ccc(NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccc(O)cc4)C3=O)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L14	compound treatment	1.106	-0.0235	-0.32	1.415	-0.0258	-0.35	-0.4724	-0.9987	1917017	CBDivE_006954	COc1ccc(/C=N/OC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L15	compound treatment	1.179	0.0495	0.67	1.363	-0.0778	-1.06	-0.2775	-0.2214	1917018	CBDivE_006955	CN1CCN(CC1)C(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L16	compound treatment	1.133	0.00352	0.05	1.39	-0.0508	-0.69	-0.4559	-0.6571	1917019	CBDivE_006956	Cc1ccc(cc1)S(=O)(=O)NNc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L17	compound treatment	1.125	-0.00448	-0.06	1.464	0.0232	0.32	0.1813	0.5621	1917020	CBDivE_006957	NS(=O)(=O)c1ccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L18	compound treatment	1.086	-0.0435	-0.59	1.388	-0.0528	-0.72	-0.9235	-0.9949	1730515	CBDivE_006958	CNc1ccc2cccc(Oc3ccc4cccc(O)c4n3)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L19	compound treatment	1.108	-0.0215	-0.29	1.446	0.00524	0.07	-0.1544	-0.5174	1083894	CBDivE_006959	Clc1ccc(cc1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	L20	compound treatment	1.066	-0.0635	-0.86	1.432	-0.00876	-0.12	-0.6901	-0.7981	1917021	CBDivE_006960	[O-][N+](=O)c1ccc(/C=N/OC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M01	compound treatment	1.184	0.0545	0.74	1.423	-0.0178	-0.24	0.3488	0.4504	1917022	CBDivE_006961	OCCNc1nc(Cl)nc(NCC=C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M02	compound treatment	1.078	-0.0515	-0.69	1.424	-0.0168	-0.23	-0.6527	-0.8927	1774941	CBDivE_006962	OCC1OC(Nc2ccc(cc2)C(=O)O)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M03	compound treatment	1.128	-0.00148	-0.02	1.467	0.0262	0.36	0.2389	0.6666	1917023	CBDivE_006963	O/N=C(\NCc1ccccc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M04	compound treatment	1.114	-0.0155	-0.21	1.44	-7.65E-4	-0.01	-0.155	-0.7415	1917024	CBDivE_006964	Cc1ccccc1N/C(=C(/C(=C(Cl)Cl)Cl)\[N+](=O)[O-])/n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M05	compound treatment	1.211	0.0815	1.1	1.407	-0.0338	-0.46	0.4521	0.3792	1012100	CBDivE_006965	COC(=O)CN(CC(=O)OC)C(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M06	compound treatment	1.116	-0.0135	-0.18	1.462	0.0212	0.29	0.0762	0.2228	1917025	CBDivE_006966	Oc1ccc(Cl)cc1/C=N/NC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M07	compound treatment	1.158	0.0285	0.38	1.476	0.0352	0.48	0.6118	0.9939	1917026	CBDivE_006967	Cc1cccc(NCn2nc(oc2=S)c3ccc(O)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M08	compound treatment	1.146	0.0165	0.22	1.418	-0.0228	-0.31	-0.0619	-0.162	1917027	CBDivE_006968	COc1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M09	compound treatment	1.204	0.0745	1.01	1.53	0.0892	1.22	1.5713	0.9955	1209447	CBDivE_006969	CC(Cc1c[nH]c2ccccc12)N3CC(CC3=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M10	compound treatment	1.117	-0.0125	-0.17	1.461	0.0202	0.28	0.0761	0.2353	1917028	CBDivE_006970	Brc1ccc(OCC(=O)NN=C2CCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M11	compound treatment	1.146	0.0165	0.22	1.429	-0.0118	-0.16	0.0442	0.1608	1604566	CBDivE_006971	COc1nc(nc(n1)N2CCCCCC2)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M12	compound treatment	1.112	-0.0175	-0.24	1.421	-0.0198	-0.27	-0.3573	-0.9978	1917029	CBDivE_006972	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M13	compound treatment	1.119	-0.0105	-0.14	1.517	0.0762	1.04	0.6351	0.6054	1917030	CBDivE_006973	OCCNC(=O)c1cc(cc(c1)C(=O)NCCO)C(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M14	compound treatment	1.119	-0.0105	-0.14	1.437	-0.00376	-0.05	-0.1363	-0.906	1917031	CBDivE_006974	OC(=O)c1cc(ccc1C(=O)Nc2ccc(cc2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M15	compound treatment	1.174	0.0445	0.6	1.421	-0.0198	-0.27	0.2341	0.3556	1917032	CBDivE_006975	COc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M16	compound treatment	1.17	0.0405	0.55	1.458	0.0172	0.24	0.5527	0.9289	1381357	CBDivE_006976	OC(=O)c1ccc(cc1)C(=O)c2ccc(C(=O)O)c(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M17	compound treatment	1.201	0.0715	0.96	1.513	0.0722	0.99	1.3788	0.9999	1917033	CBDivE_006977	OCCC(Nc1ccccc1)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M18	compound treatment	1.113	-0.0165	-0.22	1.454	0.0132	0.18	-0.0296	-0.1033	1917034	CBDivE_006978	[O-][N+](=O)c1cccc(c1)C(C2C(=O)c3ccccc3C2=O)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M19	compound treatment	1.201	0.0715	0.96	1.552	0.111	1.52	1.7548	0.9761	1550023	CBDivE_006979	COc1ccc(CCC2NCCn3cccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	M20	compound treatment	1.155	0.0255	0.34	1.449	0.00824	0.11	0.3229	0.8915	1416659	CBDivE_006980	COc1ccc(CCNC(=O)CN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N01	compound treatment	1.091	-0.0385	-0.52	1.394	-0.0468	-0.64	-0.818	-0.9948	1917035	CBDivE_006981	Cc1c(NC(=N)NC(=N)Nc2ccc(cc2)[N+](=O)[O-])c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N02	compound treatment	1.071	-0.0585	-0.79	1.403	-0.0378	-0.51	-0.922	-0.9786	1161181	CBDivE_006982	O=C(NCCc1nc2ccccc2[nH]1)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N03	compound treatment	1.152	0.0225	0.3	1.362	-0.0788	-1.07	-0.5447	-0.4879	1917036	CBDivE_006983	CN1CCN(CC(=O)Nc2sc3CCCCc3c2C(=O)N)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N04	compound treatment	1.08	-0.0495	-0.67	1.346	-0.0948	-1.29	-1.3858	-0.9528	1917037	CBDivE_006984	CCCC(=O)NC(Nc1cccc2cccnc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N05	compound treatment	1.144	0.0145	0.2	1.379	-0.0618	-0.84	-0.457	-0.5285	3106485	CBDivE_006985	Cc1n[n+]2cc(c3ccccc3)n(C)c2s1.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N06	compound treatment	1.127	-0.00248	-0.03	1.388	-0.0528	-0.72	-0.5324	-0.7392	1917039	CBDivE_006986	[O-][N+](=O)c1cccc(/C=C\2/SC(=S)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N07	compound treatment	1.053	-0.0765	-1.03	1.472	0.0312	0.43	-0.4284	-0.3838	1917040	CBDivE_006987	COc1ccc(cc1)C(OCC2OC(C(O)C2O)n3cnc4c(O)ncnc34)(c5ccccc5)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N08	compound treatment	1.057	-0.0725	-0.98	1.401	-0.0398	-0.54	-1.0748	-0.9613	1345497	CBDivE_006988	Cc1oc2cc(OCc3ccccc3)ccc2c(=O)c1c4ccc5OCCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N09	compound treatment	1.052	-0.0775	-1.05	1.447	0.00624	0.09	-0.679	-0.6474	1917041	CBDivE_006989	Cc1ccccc1C(=O)NC(NC(=S)Nc2ccccc2C(=O)O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N10	compound treatment	1.085	-0.0445	-0.6	1.435	-0.00576	-0.08	-0.4799	-0.793	1710716	CBDivE_006990	COc1ccccc1NC(=O)C(C)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N11	compound treatment	1.077	-0.0525	-0.71	1.414	-0.0268	-0.36	-0.7587	-0.9525	1917042	CBDivE_006991	Clc1ccc(NC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N12	compound treatment	1.07	-0.0595	-0.8	1.393	-0.0478	-0.65	-1.028	-0.9946	1304387	CBDivE_006992	Oc1ccc2ccccc2c1C(NC(=O)c3ccccc3Br)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N13	compound treatment	1.118	-0.0115	-0.15	1.449	0.00824	0.11	-0.0301	-0.1574	1917043	CBDivE_006993	OC(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccc(cc4)C(=O)O)C3=O)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N14	compound treatment	1.075	-0.0545	-0.73	1.414	-0.0268	-0.36	-0.7778	-0.9478	1917044	CBDivE_006994	[O-][N+](=O)c1cccc(c1)C(=O)O/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N15	compound treatment	1.1	-0.0295	-0.4	1.425	-0.0158	-0.21	-0.4332	-0.9583	1917045	CBDivE_006995	OC(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N16	compound treatment	1.116	-0.0135	-0.18	1.396	-0.0448	-0.61	-0.5602	-0.8796	1740754	CBDivE_006996	O=c1[nH]n(c2cccc3cccnc23)c(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N17	compound treatment	1.072	-0.0575	-0.78	1.424	-0.0168	-0.23	-0.71	-0.8782	1917046	CBDivE_006997	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(Nc2cc(ccc2Cl)C(F)(F)F)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N18	compound treatment	1.13	5.2E-4	0.01	1.413	-0.0278	-0.38	-0.2628	-0.6939	1917047	CBDivE_006998	Oc1cccc2ccc(N=Nc3ccc4ccccc4c3O)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N19	compound treatment	1.103	-0.0265	-0.36	1.492	0.0512	0.7	0.2414	0.3077	1917048	CBDivE_006999	ClC(Cl)(Cl)C(NC(=O)/C=C/c1ccccc1)NC(=S)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	N20	compound treatment	1.098	-0.0315	-0.42	1.376	-0.0648	-0.88	-0.9248	-0.9437	1538415	CBDivE_007000	Cc1cc(C)c2ccc(nc2c1O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O01	compound treatment	1.17	0.0405	0.55	1.461	0.0202	0.28	0.5817	0.9499	1917049	CBDivE_007001	CN(CC(=O)n1nc(C)cc1C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O02	compound treatment	1.147	0.0175	0.24	1.441	2.35E-4	0.0	0.1694	0.7166	1917050	CBDivE_007002	C/C(=C\C(=O)c1ccccc1)/Nc2ccc(cc2)C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O03	compound treatment	1.161	0.0315	0.43	1.509	0.0682	0.93	0.9586	0.937	1398132	CBDivE_007003	CC(=O)Nc1sc2CCCCCc2c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O04	compound treatment	1.154	0.0245	0.33	1.436	-0.00476	-0.06	0.188	0.5576	1917051	CBDivE_007004	Cc1cc(C)n(n1)C(=C(C(=C(Cl)Cl)Cl)[N+](=O)[O-])n2nc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O05	compound treatment	1.133	0.00352	0.05	1.445	0.00424	0.06	0.0744	0.9953	1917052	CBDivE_007005	COC(=O)C(NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O06	compound treatment	1.12	-0.00948	-0.13	1.41	-0.0308	-0.42	-0.3871	-0.8826	1917053	CBDivE_007006	Cc1ccc(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O07	compound treatment	1.137	0.00752	0.1	1.453	0.0122	0.17	0.1897	0.9716	1917054	CBDivE_007007	Oc1ccc(cc1)c2nn(CNc3ccccc3)c(=S)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O08	compound treatment	1.142	0.0125	0.17	1.493	0.0522	0.71	0.6231	0.8512	1917055	CBDivE_007008	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O09	compound treatment	1.227	0.0975	1.32	1.475	0.0342	0.47	1.2604	0.9029	1277363	CBDivE_007009	OC(=O)c1cccc(NCn2cnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O10	compound treatment	1.084	-0.0455	-0.61	1.425	-0.0158	-0.21	-0.5859	-0.9011	1917056	CBDivE_007010	FC(F)(F)COc1nc(nc(n1)N2CCCCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O11	compound treatment	1.199	0.0695	0.94	1.471	0.0302	0.41	0.9547	0.9319	1200506	CBDivE_007011	OC(=O)c1cccc(NC(=O)c2ccc(cc2)C(=O)Nc3cccc(c3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O12	compound treatment	1.157	0.0275	0.37	1.481	0.0402	0.55	0.6505	0.9819	1917057	CBDivE_007012	CCCCCC(=O)N/N=C(\C)/c1ccc2ccccc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O13	compound treatment	1.189	0.0595	0.8	1.472	0.0312	0.43	0.869	0.956	1917058	CBDivE_007013	OC(=O)c1ccc(/N=C/c2ccc(Br)cc2)c(/N=C/c3ccc(Br)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O14	compound treatment	1.104	-0.0255	-0.34	1.44	-7.65E-4	-0.01	-0.2504	-0.7282	1774504	CBDivE_007014	OC(=O)c1cc(ccc1C(=O)Nc2cccc3ccccc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O15	compound treatment	1.212	0.0825	1.11	1.424	-0.0168	-0.23	0.6255	0.5504	1917059	CBDivE_007015	CCOC(=O)c1c(/N=C/c2ccc(cc2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O16	compound treatment	1.159	0.0295	0.4	1.468	0.0272	0.37	0.5442	0.9994	1913420	CBDivE_007016	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O17	compound treatment	1.193	0.0635	0.86	1.58	0.139	1.9	1.9485	0.9354	1917060	CBDivE_007017	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(C)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O18	compound treatment	1.139	0.00952	0.13	1.48	0.0392	0.54	0.4691	0.8526	1917061	CBDivE_007018	Oc1c(C(C2C(=O)c3ccccc3C2=O)c4ccc(Oc5ccccc5[N+](=O)[O-])cc4)c(=O)oc6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O19	compound treatment	1.198	0.0685	0.92	1.506	0.0652	0.89	1.2827	0.9998	1179968	CBDivE_007019	COc1ccc(CCC2NCCn3cccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	O20	compound treatment	1.099	-0.0305	-0.41	1.445	0.00424	0.06	-0.2499	-0.6019	1917062	CBDivE_007020	CC(=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P01	compound treatment	1.108	-0.0215	-0.29	1.427	-0.0138	-0.19	-0.3376	-0.9779	1917063	CBDivE_007021	Cc1ccc(C)c(c1)/C(=N\O)/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P02	compound treatment	1.09	-0.0395	-0.53	1.396	-0.0448	-0.61	-0.8083	-0.9977	1269861	CBDivE_007022	Cc1ccc(NC(=O)COc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P03	compound treatment	1.153	0.0235	0.32	1.326	-0.115	-1.56	-0.8822	-0.5525	1363512	CBDivE_007023	CN1CCN(CC1)c2ncnc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P04	compound treatment	1.076	-0.0535	-0.72	1.405	-0.0358	-0.49	-0.855	-0.9818	1401349	CBDivE_007024	COc1ccc(OCC(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P05	compound treatment	1.113	-0.0165	-0.22	1.361	-0.0798	-1.09	-0.9263	-0.8344	1917064	CBDivE_007025	S=c1nc2[nH]c3ccccc3c2n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P06	compound treatment	1.079	-0.0505	-0.68	1.378	-0.0628	-0.86	-1.0867	-0.9936	1653702	CBDivE_007026	OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P07	compound treatment	1.089	-0.0405	-0.55	1.401	-0.0398	-0.54	-0.7696	-1.0	1917065	CBDivE_007027	OCC1OC(C(O)C1O)n2cnc3c(NCCCC(=O)O)ncnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P08	compound treatment	1.096	-0.0335	-0.45	1.403	-0.0378	-0.51	-0.6835	-0.9979	1640339	CBDivE_007028	Cc1oc2cc(OC(=O)c3ccccc3)ccc2c(=O)c1c4ccc5OCCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P09	compound treatment	1.041	-0.0885	-1.19	1.317	-0.124	-1.69	-2.0374	-0.9856	1917066	CBDivE_007029	COc1ccccc1NC(=S)NC(NC(=O)c2cccc(C)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P10	compound treatment	0.643	-0.486	-6.56	1.001	-0.44	-6.0	-8.8811	-0.999	1655144	CBDivE_007030	CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P11	compound treatment	1.113	-0.0165	-0.22	1.365	-0.0758	-1.03	-0.8878	-0.84	1917067	CBDivE_007031	Oc1ccccc1NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4ccccc4O)C3=O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P12	compound treatment	1.106	-0.0235	-0.32	1.329	-0.112	-1.52	-1.3017	-0.8362	1917068	CBDivE_007032	CCCCC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P13	compound treatment	1.091	-0.0385	-0.52	1.422	-0.0188	-0.26	-0.548	-0.9469	1917069	CBDivE_007033	Oc1ccccc1NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccccc4O)C3=O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P14	compound treatment	1.109	-0.0205	-0.28	1.408	-0.0328	-0.45	-0.5113	-0.9733	1917070	CBDivE_007034	[O-][N+](=O)c1ccccc1/C=N/OC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P15	compound treatment	1.185	0.0555	0.75	1.418	-0.0228	-0.31	0.3101	0.3825	1917071	CBDivE_007035	OC(=O)c1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P16	compound treatment	1.113	-0.0165	-0.22	1.378	-0.0628	-0.86	-0.7624	-0.8622	1369308	CBDivE_007036	Clc1ccc(cc1)S(=O)(=O)Nc2ccc(Br)cc2C(=O)N3CCN(CC3)S(=O)(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P17	compound treatment	1.091	-0.0385	-0.52	1.349	-0.0918	-1.25	-1.2519	-0.9241	1917072	CBDivE_007037	CN1CCN(Cc2c(NC(=O)C)sc3CCCCc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P18	compound treatment	1.039	-0.0905	-1.22	1.46	0.0192	0.26	-0.6776	-0.5428	1917073	CBDivE_007038	COc1ccc(C)cc1N=Nc2ccc(O)c3ncccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P19	compound treatment	1.148	0.0185	0.25	1.427	-0.0138	-0.19	0.0439	0.1406	1917074	CBDivE_007039	ClC(Cl)(Cl)C(NC(=O)/C=C/c1ccccc1)NC(=S)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.22	P20	compound treatment	1.09	-0.0395	-0.53	1.39	-0.0508	-0.69	-0.8661	-0.9916	1251947	CBDivE_007040	Nc1c(NCCc2ccccc2)c3ccccc3oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A01	compound treatment	1.224	0.0845	1.14	1.403	-0.0152	-0.21	0.6598	0.5696	1546939	CBDivE_007041	COc1cccc(c1)C(=O)OCc2ccc(OC(=O)c3cccc(OC)c3)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A02	compound treatment	1.177	0.0375	0.51	1.423	0.00484	0.07	0.4043	0.7927	1917075	CBDivE_007042	CCCCc1noc2CC(C)(C)C/C(=N/O)/c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A03	compound treatment	1.183	0.0435	0.59	1.449	0.0308	0.42	0.7123	0.9867	1303306	CBDivE_007043	CCC1(C(=O)N(Cc2ccccc2)C(=O)N(Cc3ccccc3)C1=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A04	compound treatment	1.175	0.0355	0.48	1.408	-0.0102	-0.14	0.2406	0.4827	1917076	CBDivE_007044	Cc1ccc(/C=N/NC(=O)COc2ccc3ccccc3c2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A05	compound treatment	1.19	0.0505	0.68	1.487	0.0688	0.94	1.1454	0.9876	1917077	CBDivE_007045	OC(=O)C1C(C2C=CC1C32CC3)C(=O)Nc4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A06	compound treatment	1.136	-0.00351	-0.05	1.382	-0.0362	-0.49	-0.3821	-0.7714	1917078	CBDivE_007046	OC(=O)/C=C/C(=O)N1CCCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A07	compound treatment	1.203	0.0635	0.86	1.541	0.123	1.68	1.7901	0.9515	1593587	CBDivE_007047	OC(=O)c1cc2ccc3cccnc3c2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A08	compound treatment	1.187	0.0475	0.64	1.509	0.0908	1.24	1.329	0.9529	1917079	CBDivE_007048	COc1cccc(/C=N/NC(=O)c2ccc(OCc3cccc(Br)c3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A09	compound treatment	1.183	0.0435	0.59	1.379	-0.0392	-0.53	0.0373	0.047	1917080	CBDivE_007049	Oc1ccccc1/C=N/c2ccc(Oc3cccc(Oc4ccc(\N=C\c5ccccc5O)cc4)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A10	compound treatment	1.171	0.0315	0.42	1.363	-0.0552	-0.75	-0.2315	-0.2679	1917081	CBDivE_007050	Cc1ccc(OCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A11	compound treatment	1.169	0.0295	0.4	1.487	0.0688	0.94	0.9451	0.927	1561412	CBDivE_007051	Clc1ccc(cc1)C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A12	compound treatment	1.144	0.00449	0.06	1.468	0.0498	0.68	0.5234	0.7671	1460903	CBDivE_007052	Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A13	compound treatment	1.211	0.0715	0.96	1.417	-0.00116	-0.02	0.6708	0.6954	1917082	CBDivE_007053	CC(Oc1ccc(cc1)c2ccccc2)C(=O)N/N=C\c3cc(ccc3O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A14	compound treatment	1.157	0.0175	0.24	1.413	-0.00516	-0.07	0.1171	0.4756	1774689	CBDivE_007054	OC(=O)c1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(c3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A15	compound treatment	1.141	0.00149	0.02	1.463	0.0448	0.61	0.4466	0.73	1917083	CBDivE_007055	CCCc1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A16	compound treatment	1.114	-0.0255	-0.34	1.428	0.00984	0.13	-0.1484	-0.4019	1774452	CBDivE_007056	[O-][N+](=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)Nc3cccc(c3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A17	compound treatment	1.168	0.0285	0.38	1.438	0.0198	0.27	0.4631	0.9852	1917084	CBDivE_007057	CC(C)(C)c1cc(/C=N/NC(=O)c2ccc(N)cc2)cc(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A18	compound treatment	1.16	0.0205	0.28	1.359	-0.0592	-0.81	-0.375	-0.4397	1523374	CBDivE_007058	Brc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A19	compound treatment	1.148	0.00849	0.11	1.418	-1.6E-4	0.0	0.0795	0.6935	1917085	CBDivE_007059	CC(Oc1ccc(Cl)cc1)C(=O)N/N=C\c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	A20	compound treatment	1.074	-0.0655	-0.88	1.398	-0.0202	-0.27	-0.8193	-0.8852	1406063	CBDivE_007060	Cc1cccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B01	compound treatment	1.183	0.0435	0.59	1.345	-0.0732	-1.0	-0.2906	-0.251	1917086	CBDivE_007061	Clc1ccc(cc1)S(=O)(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B02	compound treatment	1.187	0.0475	0.64	1.448	0.0298	0.41	0.7408	0.976	1917087	CBDivE_007062	Clc1cccc(c1)C(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B03	compound treatment	1.149	0.00949	0.13	1.415	-0.00316	-0.04	0.0601	0.4447	1567025	CBDivE_007063	COC(=O)C(Cc1ccccc1)NC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B04	compound treatment	1.131	-0.00851	-0.11	1.436	0.0178	0.24	0.0909	0.3378	1917088	CBDivE_007064	CC(=O)NC/C(=N\NC(=O)c1cccc(Cl)c1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B05	compound treatment	1.106	-0.0335	-0.45	1.481	0.0628	0.86	0.2863	0.2955	1917089	CBDivE_007065	COC(=O)C1C(=O)c2c(C)noc2CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B06	compound treatment	1.096	-0.0435	-0.59	1.401	-0.0172	-0.23	-0.5805	-0.9187	1203654	CBDivE_007066	CC(C)CC(=O)Nc1cccc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B07	compound treatment	1.176	0.0365	0.49	1.43	0.0118	0.16	0.4623	0.8923	1917090	CBDivE_007067	[O-][N+](=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B08	compound treatment	1.195	0.0555	0.75	1.377	-0.0412	-0.56	0.1325	0.1416	1917091	CBDivE_007068	Clc1cccc(c1)C(=O)NN=C2CCC(=NNC(=O)c3cccc(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B09	compound treatment	1.088	-0.0515	-0.69	1.426	0.00784	0.11	-0.4158	-0.5914	1568492	CBDivE_007069	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B10	compound treatment	1.181	0.0415	0.56	1.428	0.00984	0.13	0.4907	0.8525	1434539	CBDivE_007070	O=C(Nc1ccccc1NC(=O)c2ccco2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B11	compound treatment	1.102	-0.0375	-0.51	1.35	-0.0682	-0.93	-1.015	-0.9591	1612586	CBDivE_007071	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B12	compound treatment	1.104	-0.0355	-0.48	1.386	-0.0322	-0.44	-0.6488	-0.999	1917092	CBDivE_007072	CC/C(=N\NC(=O)COc1ccc(C)cc1C)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B13	compound treatment	1.115	-0.0245	-0.33	1.329	-0.0892	-1.22	-1.0935	-0.8679	1774498	CBDivE_007073	[O-][N+](=O)c1cccc(c1)S(=O)(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B14	compound treatment	1.097	-0.0425	-0.57	1.438	0.0198	0.27	-0.2142	-0.3378	1917093	CBDivE_007074	CC(C)C1CCC(C)CC1OC(=O)C[n+]2csc(CCO)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B15	compound treatment	1.117	-0.0225	-0.3	1.389	-0.0292	-0.4	-0.4959	-0.9911	1363843	CBDivE_007075	OC(=O)c1ccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B16	compound treatment	1.106	-0.0335	-0.45	1.414	-0.00416	-0.06	-0.3598	-0.7896	1917094	CBDivE_007076	[O-][N+](=O)c1cccc(NC(=O)c2cc(ccc2Cl)S(=O)(=O)Nc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B17	compound treatment	1.124	-0.0155	-0.21	1.406	-0.0122	-0.17	-0.2652	-0.9934	1242795	CBDivE_007077	OC(=O)c1cccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B18	compound treatment	1.128	-0.0115	-0.16	1.422	0.00384	0.05	-0.0727	-0.444	1070364	CBDivE_007078	O=C(Cc1ccccn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B19	compound treatment	1.103	-0.0365	-0.49	1.365	-0.0532	-0.72	-0.8608	-0.9823	1774407	CBDivE_007079	[O-][N+](=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)Nc3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	B20	compound treatment	1.067	-0.0725	-0.98	1.386	-0.0322	-0.44	-1.0018	-0.9345	1917095	CBDivE_007080	C(=N/c1cccc2c(\N=C\c3ccc[nH]3)cccc12)\c4ccc[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C01	compound treatment	1.124	-0.0155	-0.21	1.415	-0.00316	-0.04	-0.1784	-0.8352	1425651	CBDivE_007081	O=C(Nc1c[nH]c(=O)[nH]c1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C02	compound treatment	1.12	-0.0195	-0.26	1.431	0.0128	0.18	-0.0623	-0.197	1917096	CBDivE_007082	CCC/C(=N\OCC)/C1C(=O)CC(C)(C)C(C1=O)c2cc(C)no2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C03	compound treatment	1.271	0.131	1.77	1.458	0.0398	0.54	1.6385	0.8832	1610590	CBDivE_007083	CCC1(CC(=O)c2ccccc2)C(=O)NC(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C04	compound treatment	1.135	-0.00451	-0.06	1.395	-0.0232	-0.32	-0.2663	-0.8281	1917097	CBDivE_007084	COc1cccc(/C=N/NC(=O)COc2ccc3ccccc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C05	compound treatment	1.158	0.0185	0.25	1.53	0.112	1.53	1.2548	0.812	1917098	CBDivE_007085	Cc1ccc(O)c2nc(/C=C/c3ccccc3[N+](=O)[O-])ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C06	compound treatment	1.153	0.0135	0.18	1.476	0.0578	0.79	0.6864	0.848	1917099	CBDivE_007086	C/C(=C/1\C(=O)CSC1=O)/Nc2ccc(C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C07	compound treatment	1.179	0.0395	0.53	1.48	0.0618	0.84	0.973	0.9755	1917100	CBDivE_007087	Brc1ccc(NS(=O)(=O)c2cccc3cccnc23)c4ncccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C08	compound treatment	1.135	-0.00451	-0.06	1.433	0.0148	0.2	0.1001	0.4737	1917101	CBDivE_007088	N/C(=C\C(=O)c1ccccc1O)/C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C09	compound treatment	1.142	0.00249	0.03	1.447	0.0288	0.39	0.3019	0.7648	1663122	CBDivE_007089	Clc1ccc(cc1)C(N2CCCCC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C10	compound treatment	1.16	0.0205	0.28	1.471	0.0528	0.72	0.705	0.9135	1917102	CBDivE_007090	CC(Oc1ccc2ccccc2c1)C(=O)N/N=C/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C11	compound treatment	1.213	0.0735	0.99	1.424	0.00584	0.08	0.7574	0.7615	1917103	CBDivE_007091	N(/N=C/C=N/Nc1cccc2cccnc12)c3cccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C12	compound treatment	1.151	0.0115	0.16	1.413	-0.00516	-0.07	0.0599	0.3517	1917104	CBDivE_007092	CC(Oc1cccc2ccccc12)C(=O)N/N=C/c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C13	compound treatment	1.186	0.0465	0.63	1.458	0.0398	0.54	0.8277	0.9974	1917105	CBDivE_007093	CCc1ccc(OCC(=O)N/N=C/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C14	compound treatment	1.192	0.0525	0.71	1.453	0.0348	0.48	0.8367	0.9811	1239053	CBDivE_007094	Cc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C15	compound treatment	1.18	0.0405	0.55	1.473	0.0548	0.75	0.9151	0.9881	1917106	CBDivE_007095	CCOc1ccc(OC)cc1/C=N/NC(=O)C(O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C16	compound treatment	1.144	0.00449	0.06	1.432	0.0138	0.19	0.1763	0.8894	1517497	CBDivE_007096	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C17	compound treatment	1.154	0.0145	0.2	1.489	0.0708	0.97	0.8213	0.8333	1682270	CBDivE_007097	OC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)NCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C18	compound treatment	1.118	-0.0215	-0.29	1.421	0.00284	0.04	-0.1778	-0.6073	1917107	CBDivE_007098	Cc1cc(C)c(c(C)c1S(=O)(=O)Nc2ccc(NC(=O)c3ccccc3)cc2)S(=O)(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C19	compound treatment	1.13	-0.00951	-0.13	1.45	0.0318	0.43	0.2163	0.4778	1917108	CBDivE_007099	CCN(CC)CCN/C=C\1/C(=O)Nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	C20	compound treatment	1.12	-0.0195	-0.26	1.42	0.00184	0.03	-0.1683	-0.6368	1575086	CBDivE_007100	OC(=O)c1cccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D01	compound treatment	1.102	-0.0375	-0.51	1.365	-0.0532	-0.72	-0.8704	-0.9846	1662889	CBDivE_007101	C(C#Cc1ccccc1)N2CCN(CC2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D02	compound treatment	1.122	-0.0175	-0.24	1.373	-0.0452	-0.62	-0.6025	-0.9134	1917109	CBDivE_007102	C/C(=N\NC(=O)c1cccc(Cl)c1)/c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D03	compound treatment	1.015	-0.125	-1.68	1.419	8.4E-4	0.01	-1.1796	-0.7023	1917110	CBDivE_007103	CC(=O)c1ccc(NS(=O)(=O)c2cc(ccc2C)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D04	compound treatment	1.113	-0.0265	-0.36	1.396	-0.0222	-0.3	-0.4665	-0.9965	1917111	CBDivE_007104	Clc1cccc(c1)C(=O)N/N=C/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D05	compound treatment	1.092	-0.0475	-0.64	1.401	-0.0172	-0.23	-0.6187	-0.9067	1391336	CBDivE_007105	OC(CNC(=O)c1ccc(Br)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D06	compound treatment	1.183	0.0435	0.59	1.426	0.00784	0.11	0.4905	0.8224	1917112	CBDivE_007106	OC(=O)c1ccc(Cn2c(csc2=Nc3ccccc3)c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D07	compound treatment	1.121	-0.0185	-0.25	1.45	0.0318	0.43	0.1305	0.2605	1130069	CBDivE_007107	Clc1ccc(cc1Cl)S(=O)(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D08	compound treatment	1.106	-0.0335	-0.45	1.4	-0.0182	-0.25	-0.4947	-0.9599	1080023	CBDivE_007108	O=C1C2C3CC(C=C3)C2C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D09	compound treatment	1.085	-0.0545	-0.74	1.353	-0.0652	-0.89	-1.1483	-0.9956	1286113	CBDivE_007109	Oc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D10	compound treatment	1.081	-0.0585	-0.79	1.367	-0.0512	-0.7	-1.0514	-0.9981	1917113	CBDivE_007110	Oc1c(/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4)cc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D11	compound treatment	1.114	-0.0255	-0.34	1.465	0.0468	0.64	0.2083	0.2871	1693038	CBDivE_007111	Cc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D12	compound treatment	1.151	0.0115	0.16	1.442	0.0238	0.33	0.3395	0.9426	1917114	CBDivE_007112	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D13	compound treatment	1.182	0.0425	0.57	1.404	-0.0142	-0.19	0.2688	0.4444	1917115	CBDivE_007113	CC(=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(cc3)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D14	compound treatment	1.136	-0.00351	-0.05	1.36	-0.0582	-0.79	-0.5943	-0.748	1917116	CBDivE_007114	Cc1cccc(N=c2[nH]c(cs2)c3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D15	compound treatment	1.081	-0.0585	-0.79	1.4	-0.0182	-0.25	-0.7332	-0.8864	1577630	CBDivE_007115	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D16	compound treatment	1.098	-0.0415	-0.56	1.349	-0.0692	-0.94	-1.0628	-0.969	1711532	CBDivE_007116	OC(=O)c1ccccc1NC(=O)c2cc(ccc2Cl)S(=O)(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D17	compound treatment	1.092	-0.0475	-0.64	1.368	-0.0502	-0.68	-0.9369	-0.9995	1917117	CBDivE_007117	COc1ccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D18	compound treatment	1.096	-0.0435	-0.59	1.387	-0.0312	-0.42	-0.7155	-0.9874	1917118	CBDivE_007118	Cc1ccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D19	compound treatment	1.186	0.0465	0.63	1.452	0.0338	0.46	0.7698	0.9886	1917119	CBDivE_007119	OC(=O)c1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	D20	compound treatment	1.114	-0.0255	-0.34	1.423	0.00484	0.07	-0.1967	-0.5613	1917120	CBDivE_007120	COc1ccccc1c2cc(nc3sc(C(=O)c4ccc(cc4)c5ccccc5)c(N)c23)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E01	compound treatment	1.17	0.0305	0.41	1.41	-0.00816	-0.11	0.2122	0.4979	1118144	CBDivE_007121	CC(=O)Oc1ccc(cc1)c2cccc(c2)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E02	compound treatment	1.139	-5.08E-4	-0.01	1.395	-0.0232	-0.32	-0.2282	-0.7223	1715180	CBDivE_007122	CCCc1n[nH]c2CC(CC(C)SCC)CC(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E03	compound treatment	1.142	0.00249	0.03	1.412	-0.00616	-0.08	-0.0356	-0.3937	1479926	CBDivE_007123	Cc1cc(C)n(n1)c2ccc3cccc(O)c3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E04	compound treatment	1.119	-0.0205	-0.28	1.464	0.0458	0.63	0.2464	0.3604	1917121	CBDivE_007124	COc1ccc(/C=N/NC(=O)C(C)Oc2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E05	compound treatment	1.198	0.0585	0.79	1.466	0.0478	0.65	1.0193	0.9955	1917122	CBDivE_007125	Oc1cccc2ccc(/C=N/Nc3cccc4cccnc34)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E06	compound treatment	1.124	-0.0155	-0.21	1.427	0.00884	0.12	-0.0627	-0.2597	1917123	CBDivE_007126	Cc1ccc(cc1/N=C/c2ccc(C#Cc3ccccc3)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E07	compound treatment	1.164	0.0245	0.33	1.502	0.0838	1.14	1.0421	0.8756	1671484	CBDivE_007127	Nc1ccccc1S(=O)(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E08	compound treatment	1.155	0.0155	0.21	1.455	0.0368	0.5	0.503	0.9245	1917124	CBDivE_007128	COc1cccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E09	compound treatment	1.219	0.0795	1.07	1.379	-0.0392	-0.53	0.3807	0.3178	1917125	CBDivE_007129	COC(=O)CN(C)C(=O)Oc1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E10	compound treatment	1.172	0.0325	0.44	1.405	-0.0132	-0.18	0.1831	0.3865	1917126	CBDivE_007130	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(OCc3cccc(Br)c3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E11	compound treatment	1.204	0.0645	0.87	1.45	0.0318	0.43	0.9222	0.9484	1917127	CBDivE_007131	C/C(=N/Nc1cccc2cccnc12)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E12	compound treatment	1.112	-0.0275	-0.37	1.425	0.00684	0.09	-0.1965	-0.5134	1917128	CBDivE_007132	CC(Oc1ccc(Br)cc1)C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E13	compound treatment	1.129	-0.0105	-0.14	1.412	-0.00616	-0.08	-0.1596	-0.9688	1917129	CBDivE_007133	COc1cccc(/C=C/C(=N\NC(=O)COc2ccc(Br)cc2)/C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E14	compound treatment	1.084	-0.0555	-0.75	1.426	0.00784	0.11	-0.4539	-0.6001	1372433	CBDivE_007134	Cc1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E15	compound treatment	1.197	0.0575	0.78	1.439	0.0208	0.28	0.7494	0.9072	1917130	CBDivE_007135	CCCOc1ccccc1/C=N/NC(=O)C(O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E16	compound treatment	1.14	4.92E-4	0.01	1.412	-0.00616	-0.08	-0.0547	-0.6492	1917131	CBDivE_007136	[O-][N+](=O)c1cccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E17	compound treatment	1.235	0.0955	1.29	1.41	-0.00816	-0.11	0.8322	0.6436	1239628	CBDivE_007137	Oc1ccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5ccc(O)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E18	compound treatment	1.158	0.0185	0.25	1.445	0.0268	0.37	0.4352	0.9825	1917132	CBDivE_007138	COC(=O)c1ccc(COc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E19	compound treatment	1.201	0.0615	0.83	1.488	0.0698	0.95	1.26	0.9976	1917133	CBDivE_007139	Clc1ccc(NC(=O)NNC(=O)CCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	E20	compound treatment	1.196	0.0565	0.76	1.44	0.0218	0.3	0.7495	0.916	1726527	CBDivE_007140	OC(=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F01	compound treatment	1.094	-0.0455	-0.61	1.372	-0.0462	-0.63	-0.8792	-0.9999	1269159	CBDivE_007141	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F02	compound treatment	1.093	-0.0465	-0.63	1.377	-0.0412	-0.56	-0.8405	-0.9985	1917134	CBDivE_007142	C/C(=N\NC(=O)c1cccc(Cl)c1)/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F03	compound treatment	1.08	-0.0595	-0.8	1.405	-0.0132	-0.18	-0.6946	-0.8443	1917135	CBDivE_007143	OC(=O)CCCCCNC(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F04	compound treatment	1.107	-0.0325	-0.44	1.375	-0.0432	-0.59	-0.7263	-0.9895	1917136	CBDivE_007144	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F05	compound treatment	1.085	-0.0545	-0.74	1.445	0.0268	0.37	-0.2612	-0.318	1299687	CBDivE_007145	COc1ccc(NC(=O)c2ccc(Br)cc2)c3cccnc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F06	compound treatment	1.144	0.00449	0.06	1.386	-0.0322	-0.44	-0.2672	-0.6037	1452238	CBDivE_007146	O=C(Nc1nccs1)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F07	compound treatment	1.156	0.0165	0.22	1.372	-0.0462	-0.63	-0.2878	-0.431	1709148	CBDivE_007147	OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F08	compound treatment	1.149	0.00949	0.13	1.448	0.0298	0.41	0.3783	0.8868	1917137	CBDivE_007148	[O-][N+](=O)c1cc(ccc1Br)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F09	compound treatment	1.053	-0.0865	-1.17	1.375	-0.0432	-0.59	-1.2414	-0.9498	1282145	CBDivE_007149	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F10	compound treatment	1.103	-0.0365	-0.49	1.437	0.0188	0.26	-0.1666	-0.2999	1917138	CBDivE_007150	OC(=O)c1cccc(c1)c2ccc(/C=N/Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F11	compound treatment	1.121	-0.0185	-0.25	1.46	0.0418	0.57	0.2269	0.3643	1917139	CBDivE_007151	OCCN(CCO)S(=O)(=O)c1cccc(c1)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F12	compound treatment	1.037	-0.103	-1.38	1.382	-0.0362	-0.49	-1.3265	-0.9035	1917140	CBDivE_007152	Cc1ccc(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F13	compound treatment	1.102	-0.0375	-0.51	1.444	0.0258	0.35	-0.1086	-0.1762	1917141	CBDivE_007153	Cc1ccc(cc1S(=O)(=O)Nc2cccc(c2)C(=O)O)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F14	compound treatment	1.099	-0.0405	-0.55	1.418	-1.6E-4	0.0	-0.388	-0.7099	1917142	CBDivE_007154	Cc1ccc(OCC(=O)N/N=C/c2cc(Br)cc(Br)c2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F15	compound treatment	1.142	0.00249	0.03	1.446	0.0278	0.38	0.2922	0.7667	1479135	CBDivE_007155	O=C(Nc1ccccc1)c2cccc(c2)S(=O)(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F16	compound treatment	1.109	-0.0305	-0.41	1.403	-0.0152	-0.21	-0.4372	-0.9493	1917143	CBDivE_007156	Cc1cc(C)c(NC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F17	compound treatment	1.093	-0.0465	-0.63	1.448	0.0298	0.41	-0.1559	-0.2085	1287341	CBDivE_007157	O=S(=O)(N1CCOCC1)c2cccc(c2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F18	compound treatment	1.12	-0.0195	-0.26	1.417	-0.00116	-0.02	-0.1973	-0.7483	1727735	CBDivE_007158	O=C1c2ccccc2-c3nnc(cc13)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F19	compound treatment	1.075	-0.0645	-0.87	1.439	0.0208	0.28	-0.4144	-0.4527	1676282	CBDivE_007159	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	F20	compound treatment	1.074	-0.0655	-0.88	1.359	-0.0592	-0.81	-1.1953	-0.999	1305993	CBDivE_007160	Cc1sc(N)nc1C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G01	compound treatment	1.121	-0.0185	-0.25	1.398	-0.0202	-0.27	-0.3709	-0.9988	1532082	CBDivE_007161	Cc1ccc(OCC(=O)Nc2ccc(cc2)C(=O)O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G02	compound treatment	1.095	-0.0445	-0.6	1.398	-0.0202	-0.27	-0.619	-0.9373	1917144	CBDivE_007162	Cc1cc(on1)C2C(=O)CC(=O)CC2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G03	compound treatment	1.226	0.0865	1.17	1.406	-0.0122	-0.17	0.7078	0.6006	1917145	CBDivE_007163	Clc1ccc(cc1)C(=O)COC(=O)CCC(=O)C(=O)OCC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G04	compound treatment	1.163	0.0235	0.32	1.439	0.0208	0.28	0.425	0.9985	1917146	CBDivE_007164	CC(Oc1ccc2ccccc2c1)C(=O)N/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G05	compound treatment	1.152	0.0125	0.17	1.421	0.00284	0.04	0.1466	0.8475	1917147	CBDivE_007165	Cc1cc(C)c2ccc(C)[n+]([O-])c2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G06	compound treatment	1.158	0.0185	0.25	1.394	-0.0242	-0.33	-0.0566	-0.1369	1917148	CBDivE_007166	O=c1[nH]c2ccc(/N=C/c3ccc(C#Cc4ccccc4)cc3)cc2o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G07	compound treatment	1.163	0.0235	0.32	1.418	-1.6E-4	0.0	0.2226	0.7022	1917149	CBDivE_007167	OC(=O)c1cccc2c(Sc3ccc(Oc4ccc(Sc5ccc(C(=O)O)c6c(cccc56)C(=O)O)cc4)cc3)ccc(C(=O)O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G08	compound treatment	1.144	0.00449	0.06	1.403	-0.0152	-0.21	-0.1033	-0.4796	1917150	CBDivE_007168	CCOC(=O)C(C1CCCCC1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G09	compound treatment	1.167	0.0275	0.37	1.448	0.0298	0.41	0.55	0.9989	1917151	CBDivE_007169	COC(=O)CCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G10	compound treatment	1.133	-0.00651	-0.09	1.469	0.0508	0.69	0.4281	0.6127	1917152	CBDivE_007170	Cc1ccc(/C=N/NC(=O)COc2ccccc2C)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G11	compound treatment	1.206	0.0665	0.9	1.469	0.0508	0.69	1.1245	0.9919	1459606	CBDivE_007171	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G12	compound treatment	1.107	-0.0325	-0.44	1.451	0.0328	0.45	0.0066	0.0105	1917153	CBDivE_007172	CC(Oc1cccc2ccccc12)C(=O)N/N=C/c3cccc(CC=C)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G13	compound treatment	1.174	0.0345	0.47	1.408	-0.0102	-0.14	0.2311	0.4759	1917154	CBDivE_007173	CCc1ccc(OCC(=O)N/N=C(/C)\C=C\c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G14	compound treatment	1.153	0.0135	0.18	1.457	0.0388	0.53	0.5032	0.8985	1332606	CBDivE_007174	Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G15	compound treatment	1.194	0.0545	0.74	1.52	0.102	1.39	1.5018	0.9558	1917155	CBDivE_007175	Brc1cccc(COc2ccc3ccccc3c2/C=N/NC(=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G16	compound treatment	1.149	0.00949	0.13	1.476	0.0578	0.79	0.6483	0.8113	1917156	CBDivE_007176	Cc1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G17	compound treatment	1.179	0.0395	0.53	1.455	0.0368	0.5	0.732	0.9996	1437632	CBDivE_007177	CC(C)(C)C(=O)Nc1ccc(cc1)c2cnc(nc2)c3ccc(NC(=O)C(C)(C)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G18	compound treatment	1.142	0.00249	0.03	1.423	0.00484	0.07	0.0704	0.951	1917157	CBDivE_007178	[O-][N+](=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G19	compound treatment	1.208	0.0685	0.92	1.484	0.0658	0.9	1.2882	0.9999	1917158	CBDivE_007179	Clc1ccc(NC(=O)NNC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	G20	compound treatment	1.168	0.0285	0.38	1.405	-0.0132	-0.18	0.1449	0.3416	1917159	CBDivE_007180	[O-][N+](=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H01	compound treatment	1.096	-0.0435	-0.59	1.295	-0.123	-1.68	-1.6026	-0.9008	1120757	CBDivE_007181	O=C(NCc1ccccc1)c2cccc(c2)S(=O)(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H02	compound treatment	1.127	-0.0125	-0.17	1.409	-0.00916	-0.12	-0.2076	-0.989	1640191	CBDivE_007182	OC(=O)c1cccc(NS(=O)(=O)c2ccc(cc2)C3CCCCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H03	compound treatment	1.147	0.00749	0.1	1.359	-0.0592	-0.81	-0.499	-0.6137	1612979	CBDivE_007183	Cc1cc(on1)C2C(=O)C(C(=O)c3ccc(Cl)cc3)C(=O)CC2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H04	compound treatment	1.153	0.0135	0.18	1.399	-0.0192	-0.26	-0.056	-0.176	1913395	CBDivE_007184	O=C(Nc1ccc2ccccc2c1)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H05	compound treatment	1.085	-0.0545	-0.74	1.401	-0.0172	-0.23	-0.6854	-0.8882	1917160	CBDivE_007185	CC1(C)CC(=O)C(=CNc2ccc(cc2)c3ccc(NC=C4C(=O)CC(C)(C)CC4=O)cc3)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H06	compound treatment	1.12	-0.0195	-0.26	1.406	-0.0122	-0.17	-0.3033	-0.9752	1689619	CBDivE_007186	Cc1ccc(cc1)C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H07	compound treatment	1.112	-0.0275	-0.37	1.408	-0.0102	-0.14	-0.3604	-0.9098	1630968	CBDivE_007187	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H08	compound treatment	1.145	0.00549	0.07	1.37	-0.0482	-0.66	-0.412	-0.6234	1484947	CBDivE_007188	CC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H09	compound treatment	1.066	-0.0735	-0.99	1.374	-0.0442	-0.6	-1.127	-0.9714	1917161	CBDivE_007189	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H10	compound treatment	1.127	-0.0125	-0.17	1.453	0.0348	0.48	0.2166	0.4297	1917162	CBDivE_007190	Cc1ccc(OCC(=O)N/N=C/c2ccc(o2)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H11	compound treatment	1.205	0.0655	0.88	1.351	-0.0672	-0.92	-0.0228	-0.0179	1917163	CBDivE_007191	OCCN(CCO)S(=O)(=O)c1cccc(c1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H12	compound treatment	1.133	-0.00651	-0.09	1.407	-0.0112	-0.15	-0.1697	-0.9658	1873890	CBDivE_007192	Clc1ccc(N=c2scc(c3ccccc3)n2Cc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H13	compound treatment	1.178	0.0385	0.52	1.491	0.0728	0.99	1.0695	0.9542	1917164	CBDivE_007193	OC(=O)c1ccccc1NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H14	compound treatment	1.108	-0.0315	-0.43	1.413	-0.00516	-0.07	-0.3503	-0.8131	1917165	CBDivE_007194	Cc1ccc(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H15	compound treatment	1.111	-0.0285	-0.38	1.381	-0.0372	-0.51	-0.6303	-0.9907	1642349	CBDivE_007195	COc1ccc(cc1)c2csc(=Nc3ccccc3)n2C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H16	compound treatment	1.085	-0.0545	-0.74	1.434	0.0158	0.22	-0.3672	-0.4792	1620480	CBDivE_007196	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H17	compound treatment	1.116	-0.0235	-0.32	1.427	0.00884	0.12	-0.139	-0.4097	1376326	CBDivE_007197	O=S(=O)(N1CCCCC1)c2cccc(c2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H18	compound treatment	1.156	0.0165	0.22	1.349	-0.0692	-0.94	-0.5095	-0.5259	1418813	CBDivE_007198	CC1CCN(CC(O)COCc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H19	compound treatment	1.125	-0.0145	-0.2	1.448	0.0298	0.41	0.1493	0.3307	1662144	CBDivE_007199	O=S(=O)(N1CCCCC1)c2ccc(Cc3ccc(cc3)S(=O)(=O)N4CCCCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	H20	compound treatment	1.077	-0.0625	-0.84	1.403	-0.0152	-0.21	-0.7425	-0.8551	1917166	CBDivE_007200	C/C(=C/1\C(=O)OC(C1=O)c2ccccc2)/NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I01	compound treatment	1.162	0.0225	0.3	1.406	-0.0122	-0.17	0.0973	0.2814	1917167	CBDivE_007201	COc1ccc(/C=N/O)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I02	compound treatment	1.128	-0.0115	-0.16	1.426	0.00784	0.11	-0.0342	-0.1813	1629497	CBDivE_007202	COC(=O)C1C(CC(=O)CC1=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I03	compound treatment	1.196	0.0565	0.76	1.479	0.0608	0.83	1.1255	0.9991	1917168	CBDivE_007203	CCCCOc1ccc(cc1)C(=O)Nc2ccc(cc2)C(=O)OCC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I04	compound treatment	1.092	-0.0475	-0.64	1.429	0.0108	0.15	-0.3487	-0.5301	1311196	CBDivE_007204	OC(=O)c1ccc(NC(=O)CCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I05	compound treatment	1.156	0.0165	0.22	1.419	8.4E-4	0.01	0.1654	0.7425	1917169	CBDivE_007205	CCOC(=O)C(C(=O)OCC)c1ccc2cccc(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I06	compound treatment	1.104	-0.0355	-0.48	1.452	0.0338	0.46	-0.0124	-0.0187	1917170	CBDivE_007206	C/C(=C/1\C(=O)CSC1=O)/Nc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I07	compound treatment	1.174	0.0345	0.47	1.454	0.0358	0.49	0.6746	0.9997	1559243	CBDivE_007207	CC(C)COC(=O)NCC1(OC2C=C1)C3C2C(=O)N(Cc4ccccc4)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I08	compound treatment	1.171	0.0315	0.42	1.5	0.0818	1.12	1.0896	0.9124	1917171	CBDivE_007208	COc1ccc(O)c(/C=N/NC(=O)COc2ccccc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I09	compound treatment	1.135	-0.00451	-0.06	1.468	0.0498	0.68	0.4376	0.6413	1917172	CBDivE_007209	COc1ccc(COC(=O)N/N=C(\C)/C(=N\O)/C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I10	compound treatment	1.164	0.0245	0.33	1.439	0.0208	0.28	0.4346	0.9972	1917173	CBDivE_007210	[O-][N+](=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I11	compound treatment	1.207	0.0675	0.91	1.464	0.0458	0.63	1.0858	0.9832	1917174	CBDivE_007211	Cc1cc(C)n(n1)c2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I12	compound treatment	1.118	-0.0215	-0.29	1.493	0.0748	1.02	0.5165	0.4868	1917175	CBDivE_007212	CC(Oc1ccc(Br)cc1)C(=O)N/N=C/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I13	compound treatment	1.204	0.0645	0.87	1.456	0.0378	0.52	0.9801	0.9689	1917176	CBDivE_007213	Brc1cccc(COc2ccc3ccccc3c2/C=N/NC(=O)c4ccccc4I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I14	compound treatment	1.166	0.0265	0.36	1.447	0.0288	0.39	0.5308	0.9989	1917177	CBDivE_007214	Cc1ccc(cc1NS(=O)(=O)c2cc(Cl)ccc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I15	compound treatment	1.173	0.0335	0.45	1.454	0.0358	0.49	0.6651	0.9992	1917178	CBDivE_007215	CC(C)c1ccc(C)c(OCC(=O)N/N=C\c2cc(ccc2O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I16	compound treatment	1.16	0.0205	0.28	1.426	0.00784	0.11	0.2711	0.9146	1372824	CBDivE_007216	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I17	compound treatment	1.205	0.0655	0.88	1.459	0.0408	0.56	1.0185	0.9752	1917179	CBDivE_007217	OC(=O)c1ccc2C(=O)N(NC(=O)c3cccc(c3)C(=O)NN4C(=O)c5ccc(cc5C4=O)C(=O)O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I18	compound treatment	1.137	-0.00251	-0.03	1.472	0.0538	0.73	0.4952	0.6738	1917180	CBDivE_007218	[O-][N+](=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I19	compound treatment	1.18	0.0405	0.55	1.42	0.00184	0.03	0.404	0.7388	1917181	CBDivE_007219	COc1ccc(NC(=O)Nc2ccc(Cl)cc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	I20	compound treatment	1.173	0.0335	0.45	1.444	0.0258	0.35	0.5687	0.9924	1179938	CBDivE_007220	Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J01	compound treatment	1.093	-0.0465	-0.63	1.378	-0.0402	-0.55	-0.8309	-0.9977	1289923	CBDivE_007221	Cc1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J02	compound treatment	1.121	-0.0185	-0.25	1.464	0.0458	0.63	0.2655	0.3944	1917182	CBDivE_007222	Cc1cc(C)c(cc1S(=O)(=O)Nc2cccc(c2)[N+](=O)[O-])S(=O)(=O)Nc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J03	compound treatment	1.068	-0.0715	-0.96	1.337	-0.0812	-1.11	-1.4647	-0.9977	1917183	CBDivE_007223	CC1(C)CC(=O)C(=CNc2ccccc2O)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J04	compound treatment	1.112	-0.0275	-0.37	1.431	0.0128	0.18	-0.1386	-0.3378	1917184	CBDivE_007224	COc1ccc(cc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J05	compound treatment	1.082	-0.0575	-0.78	1.407	-0.0112	-0.15	-0.6562	-0.83	1917185	CBDivE_007225	CC1(C)CC(=O)C(=CNc2cccc3ccccc23)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J06	compound treatment	1.119	-0.0205	-0.28	1.39	-0.0282	-0.38	-0.4672	-0.9871	1917186	CBDivE_007226	Cc1c(CCOC(=O)C2(CC3CC4CC(C3)C2)C4)sc[n+]1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J07	compound treatment	1.147	0.00749	0.1	1.397	-0.0212	-0.29	-0.1326	-0.4336	1643064	CBDivE_007227	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J08	compound treatment	1.15	0.0105	0.14	1.432	0.0138	0.19	0.2335	0.9899	1775239	CBDivE_007228	CC(=O)Nc1ccc(NC(=O)c2ccc(C)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J09	compound treatment	1.094	-0.0455	-0.61	1.411	-0.00716	-0.1	-0.5032	-0.8094	1917187	CBDivE_007229	Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J10	compound treatment	1.12	-0.0195	-0.26	1.414	-0.00416	-0.06	-0.2262	-0.8402	1917188	CBDivE_007230	Oc1c(Cl)cc(Cl)cc1/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J11	compound treatment	1.135	-0.00451	-0.06	1.436	0.0178	0.24	0.129	0.5145	1917189	CBDivE_007231	OC(=O)c1cc(SCCS(=O)(=O)c2ccc(Cl)cc2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J12	compound treatment	1.107	-0.0325	-0.44	1.422	0.00384	0.05	-0.2731	-0.6183	1447645	CBDivE_007232	COc1ccccc1Nc2nc(C)cs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J13	compound treatment	1.149	0.00949	0.13	1.356	-0.0622	-0.85	-0.5088	-0.5935	1311336	CBDivE_007233	Nc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(N)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J14	compound treatment	1.106	-0.0335	-0.45	1.336	-0.0822	-1.12	-1.1119	-0.9203	1917190	CBDivE_007234	CCOc1cccc(/C=N/NC(=O)CNc2ccc(C)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J15	compound treatment	1.109	-0.0305	-0.41	1.414	-0.00416	-0.06	-0.3311	-0.797	1596569	CBDivE_007235	OCCn1c(csc1=Nc2ccccc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J16	compound treatment	1.084	-0.0555	-0.75	1.428	0.00984	0.13	-0.4346	-0.5713	1917191	CBDivE_007236	FC(F)C(F)(F)COC(=O)/C=C/C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J17	compound treatment	1.115	-0.0245	-0.33	1.463	0.0448	0.61	0.1986	0.2857	1917192	CBDivE_007237	OC(=O)CSc1cccc(c1)C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J18	compound treatment	1.052	-0.0875	-1.18	1.38	-0.0382	-0.52	-1.2027	-0.9322	1917193	CBDivE_007238	CC(=O)N1C(=O)/C(=N/O)/c2c1ccc(C)c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J19	compound treatment	1.094	-0.0455	-0.61	1.448	0.0298	0.41	-0.1464	-0.1987	1917194	CBDivE_007239	[O-][N+](=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	J20	compound treatment	1.119	-0.0205	-0.28	1.411	-0.00716	-0.1	-0.2647	-0.9021	1917195	CBDivE_007240	C/C(=C/1\C(=O)OC(C1=O)c2ccccc2)/NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K01	compound treatment	1.179	0.0395	0.53	1.446	0.0278	0.38	0.6452	0.9862	1917196	CBDivE_007241	FC(F)(F)C(=O)NCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K02	compound treatment	1.149	0.00949	0.13	1.389	-0.0292	-0.4	-0.1906	-0.4563	1917197	CBDivE_007242	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccccc2OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K03	compound treatment	1.177	0.0375	0.51	1.433	0.0148	0.2	0.5007	0.9192	1917198	CBDivE_007243	Brc1ccc(cc1)C(=O)COC(=O)c2ccc(cc2C(=O)OCC(=O)c3ccc(Br)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K04	compound treatment	1.15	0.0105	0.14	1.424	0.00584	0.08	0.1564	0.963	1018435	CBDivE_007244	O=C(C(c1ccccc1)c2ccccc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K05	compound treatment	1.231	0.0915	1.23	1.46	0.0418	0.57	1.2762	0.9385	1917199	CBDivE_007245	[O-][N+](=O)c1ccccc1S(=O)(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K06	compound treatment	1.12	-0.0195	-0.26	1.444	0.0258	0.35	0.0631	0.1434	1360399	CBDivE_007246	O=C1CC(CC(=C1)NCCc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K07	compound treatment	1.181	0.0415	0.56	1.394	-0.0242	-0.33	0.1628	0.2507	1917200	CBDivE_007247	O=C(Nc1ccc(cc1)C2(c3ccc(NC(=O)c4cccc5ccccc45)cc3)c6ccccc6C(=O)c7ccccc72)c8cccc9ccccc89
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K08	compound treatment	1.13	-0.00951	-0.13	1.446	0.0278	0.38	0.1777	0.4436	1917201	CBDivE_007248	COc1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K09	compound treatment	1.147	0.00749	0.1	1.444	0.0258	0.35	0.3206	0.8747	1917202	CBDivE_007249	NCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K10	compound treatment	1.186	0.0465	0.63	1.483	0.0648	0.88	1.0687	0.9859	1917203	CBDivE_007250	OC(=O)c1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K11	compound treatment	1.192	0.0525	0.71	1.431	0.0128	0.18	0.6245	0.8562	1559871	CBDivE_007251	Cc1cc(C)n(n1)c2ccc3cccc(NS(=O)(=O)c4ccc(C)cc4)c3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K12	compound treatment	1.116	-0.0235	-0.32	1.417	-0.00116	-0.02	-0.2354	-0.7415	1917204	CBDivE_007252	CC(C)c1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K13	compound treatment	1.159	0.0195	0.26	1.47	0.0518	0.71	0.6858	0.9093	1917205	CBDivE_007253	CC(Oc1cccc(Cl)c1)C(=O)N/N=C/c2cc(ccc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K14	compound treatment	1.103	-0.0365	-0.49	1.435	0.0168	0.23	-0.1859	-0.3421	1917206	CBDivE_007254	Brc1ccc(cc1)S(=O)(=O)Cc2ccc(cc2)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K15	compound treatment	1.203	0.0635	0.86	1.453	0.0348	0.48	0.9416	0.9613	1917207	CBDivE_007255	Cc1cc(C(=O)N/N=C/c2cc(ccc2O)[N+](=O)[O-])c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K16	compound treatment	1.181	0.0415	0.56	1.485	0.0668	0.91	1.0403	0.9726	1917208	CBDivE_007256	CC(=O)c1ccc(NS(=O)(=O)c2ccc(Oc3ccc(cc3)[N+](=O)[O-])cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K17	compound treatment	1.186	0.0465	0.63	1.45	0.0318	0.43	0.7505	0.9839	1457595	CBDivE_007257	OC(=O)c1ccc2C(=O)N(NC(=O)c3ccncc3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K18	compound treatment	1.126	-0.0135	-0.18	1.422	0.00384	0.05	-0.0918	-0.4843	1561172	CBDivE_007258	OC(=O)c1cccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K19	compound treatment	1.172	0.0325	0.44	1.521	0.103	1.4	1.3016	0.8859	1917209	CBDivE_007259	Oc1ccccc1CNC(Cc2ccccc2)C(O)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	K20	compound treatment	1.194	0.0545	0.74	1.518	0.0998	1.36	1.4825	0.9582	1254971	CBDivE_007260	OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(I)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L01	compound treatment	1.128	-0.0115	-0.16	1.394	-0.0242	-0.33	-0.3427	-0.9411	1917210	CBDivE_007261	[O-][N+](=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L02	compound treatment	1.117	-0.0225	-0.3	1.357	-0.0612	-0.83	-0.8044	-0.9063	1287384	CBDivE_007262	O=S(=O)(N1CCOCC1)c2ccc(cc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L03	compound treatment	1.166	0.0265	0.36	1.401	-0.0172	-0.23	0.0873	0.2043	1703172	CBDivE_007263	CCCc1noc2CC(C)(C)C(C(=O)OC)C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L04	compound treatment	1.098	-0.0415	-0.56	1.415	-0.00316	-0.04	-0.4264	-0.7593	1917211	CBDivE_007264	Cc1ccc(cc1C)S(=O)(=O)Cc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L05	compound treatment	1.047	-0.0925	-1.25	1.44	0.0218	0.3	-0.6719	-0.5237	1917212	CBDivE_007265	CCC(=O)C1C(=O)CC(C)(C)C(C1=O)c2cc(C)no2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L06	compound treatment	1.128	-0.0115	-0.16	1.403	-0.0152	-0.21	-0.256	-0.99	1917213	CBDivE_007266	OC(/C(=N\NC(=O)c1cccc(Cl)c1)/c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L07	compound treatment	1.108	-0.0315	-0.43	1.413	-0.00516	-0.07	-0.3503	-0.8131	1129564	CBDivE_007267	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L08	compound treatment	1.088	-0.0515	-0.69	1.421	0.00284	0.04	-0.464	-0.6667	1917214	CBDivE_007268	Cc1c(CCOC(=O)C2(CC3CC4CC(C)(C3)C2)C4)sc[n+]1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L09	compound treatment	1.134	-0.00551	-0.07	1.429	0.0108	0.15	0.052	0.3142	1256778	CBDivE_007269	Cc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L10	compound treatment	1.094	-0.0455	-0.61	1.373	-0.0452	-0.62	-0.8696	-1.0	1917215	CBDivE_007270	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L11	compound treatment	1.114	-0.0255	-0.34	1.416	-0.00216	-0.03	-0.2642	-0.7648	1329558	CBDivE_007271	Clc1ccc(cc1)S(=O)(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L12	compound treatment	1.11	-0.0295	-0.4	1.38	-0.0382	-0.52	-0.6494	-0.9913	1917216	CBDivE_007272	O=C1NN=C2C1CC3CC2CC4C(=O)NN=C43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L13	compound treatment	1.156	0.0165	0.22	1.405	-0.0132	-0.18	0.0304	0.1065	1168477	CBDivE_007273	Cc1ccccc1NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3cccc(c3)S(=O)(=O)Nc4ccccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L14	compound treatment	1.116	-0.0235	-0.32	1.369	-0.0492	-0.67	-0.6983	-0.9416	1917217	CBDivE_007274	C/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L15	compound treatment	1.142	0.00249	0.03	1.331	-0.0872	-1.19	-0.8167	-0.6868	1917218	CBDivE_007275	Cc1cccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L16	compound treatment	1.089	-0.0505	-0.68	1.372	-0.0462	-0.63	-0.9269	-0.9992	1917219	CBDivE_007276	CCN(CC)CC(=O)Nc1ccc2CCc3ccccc3N(C(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L17	compound treatment	1.127	-0.0125	-0.17	1.421	0.00284	0.04	-0.0919	-0.531	1160479	CBDivE_007277	Oc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(O)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L18	compound treatment	1.088	-0.0515	-0.69	1.398	-0.0202	-0.27	-0.6857	-0.9177	1917220	CBDivE_007278	CC(=O)N1C(=O)/C(=N/NC(=O)COc2ccccc2)/c3cc(C)c(Br)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L19	compound treatment	1.125	-0.0145	-0.2	1.46	0.0418	0.57	0.265	0.4394	1579338	CBDivE_007279	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	L20	compound treatment	1.097	-0.0425	-0.57	1.442	0.0238	0.33	-0.1756	-0.2664	1917221	CBDivE_007280	COC(=O)c1cccc(SCCS(=O)(=O)c2ccc(C)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M01	compound treatment	1.188	0.0485	0.65	1.384	-0.0342	-0.47	0.1332	0.1659	1917222	CBDivE_007281	C/C(=N\Nc1ccc(cc1)S(=O)(=O)O)/c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M02	compound treatment	1.111	-0.0285	-0.38	1.398	-0.0202	-0.27	-0.4663	-0.9865	1917223	CBDivE_007282	CC(Oc1cccc(Cl)c1)C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M03	compound treatment	1.188	0.0485	0.65	1.421	0.00284	0.04	0.49	0.7477	1917224	CBDivE_007283	CC(C)C(=O)NC(NC1CCS(=O)(=O)C1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M04	compound treatment	1.138	-0.00151	-0.02	1.451	0.0328	0.45	0.3023	0.6743	1917225	CBDivE_007284	Brc1cccc(NC(=O)CCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M05	compound treatment	1.245	0.105	1.42	1.388	-0.0302	-0.41	0.7155	0.483	1917226	CBDivE_007285	Oc1c(N=Nc2ccccn2)ccc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M06	compound treatment	1.123	-0.0165	-0.22	1.45	0.0318	0.43	0.1495	0.3065	1321366	CBDivE_007286	NNC(=O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M07	compound treatment	1.119	-0.0205	-0.28	1.295	-0.123	-1.68	-1.3832	-0.8126	1917227	CBDivE_007287	COC(=O)c1cc(ccc1C(=O)O)C(O)c2ccc(C(=O)O)c(c2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M08	compound treatment	1.128	-0.0115	-0.16	1.4	-0.0182	-0.25	-0.2849	-0.9747	1917228	CBDivE_007288	COc1ccccc1OCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M09	compound treatment	1.166	0.0265	0.36	1.436	0.0178	0.24	0.4247	0.9824	1917229	CBDivE_007289	Cc1ccc(cc1)C2(CC2C(=O)Nc3ccc(cc3)[N+](=O)[O-])c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M10	compound treatment	1.172	0.0325	0.44	1.451	0.0328	0.45	0.6266	0.9999	1917230	CBDivE_007290	[O-][N+](=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M11	compound treatment	1.177	0.0375	0.51	1.402	-0.0162	-0.22	0.2018	0.3658	1917231	CBDivE_007291	Oc1ccc(cc1/C=N\NC(=O)COc2ccc(Br)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M12	compound treatment	1.12	-0.0195	-0.26	1.398	-0.0202	-0.27	-0.3805	-0.9998	1917232	CBDivE_007292	CC(C)c1ccc(OCC(=O)N/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M13	compound treatment	1.143	0.00349	0.05	1.446	0.0278	0.38	0.3018	0.7888	1917233	CBDivE_007293	CCCc1ccc(OCC(=O)N/N=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M14	compound treatment	1.134	-0.00551	-0.07	1.397	-0.0212	-0.29	-0.2566	-0.8611	1213607	CBDivE_007294	Brc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M15	compound treatment	1.218	0.0785	1.06	1.42	0.00184	0.03	0.7665	0.7237	1917234	CBDivE_007295	CC(Oc1ccc2ccccc2c1)C(=O)N/N=C\c3cc(ccc3O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M16	compound treatment	1.132	-0.00751	-0.1	1.468	0.0498	0.68	0.409	0.5952	1774408	CBDivE_007296	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M17	compound treatment	1.231	0.0915	1.23	1.458	0.0398	0.54	1.2569	0.9321	1263685	CBDivE_007297	OC(=O)c1ccc(Oc2ccc3C(=O)N(C(=O)c3c2)c4nccs4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M18	compound treatment	1.168	0.0285	0.38	1.464	0.0458	0.63	0.7138	0.9727	1325660	CBDivE_007298	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M19	compound treatment	1.206	0.0665	0.9	1.504	0.0858	1.17	1.462	0.9914	1917235	CBDivE_007299	OC(=O)C(CC(=O)c1ccsc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	M20	compound treatment	1.168	0.0285	0.38	1.452	0.0338	0.46	0.5981	0.9959	1224058	CBDivE_007300	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N01	compound treatment	1.118	-0.0215	-0.29	1.371	-0.0472	-0.64	-0.6599	-0.9353	1654382	CBDivE_007301	COC(=O)C1C(=O)C(C(=O)c2cc(C)no2)C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N02	compound treatment	1.103	-0.0365	-0.49	1.403	-0.0152	-0.21	-0.4944	-0.9257	1208765	CBDivE_007302	CCN(CC)S(=O)(=O)c1cccc(c1)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N03	compound treatment	1.14	4.92E-4	0.01	1.339	-0.0792	-1.08	-0.7586	-0.7027	1917236	CBDivE_007303	Cc1cc(on1)C2C(CC(=O)C(C(=O)c3ccc(Cl)cc3)C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N04	compound treatment	1.113	-0.0265	-0.36	1.308	-0.11	-1.5	-1.3151	-0.8516	1169741	CBDivE_007304	Brc1ccc(cc1)S(=O)(=O)c2cc(OC(=O)c3ccccc3)ccc2OC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N05	compound treatment	1.175	0.0355	0.48	1.378	-0.0402	-0.55	-0.0487	-0.0669	1774496	CBDivE_007305	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)NCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N06	compound treatment	1.158	0.0185	0.25	1.374	-0.0442	-0.6	-0.2494	-0.3826	1917237	CBDivE_007306	Clc1cccc(c1)C(=O)NN=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N07	compound treatment	1.089	-0.0505	-0.68	1.417	-0.00116	-0.02	-0.493	-0.7233	1210598	CBDivE_007307	CCN(CC)S(=O)(=O)c1cccc(c1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N08	compound treatment	1.095	-0.0445	-0.6	1.388	-0.0302	-0.41	-0.7154	-0.983	1481089	CBDivE_007308	COc1cccc(c1)C(=O)Nc2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N09	compound treatment	1.134	-0.00551	-0.07	1.392	-0.0262	-0.36	-0.3048	-0.8364	1583185	CBDivE_007309	Cc1cccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(c3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N10	compound treatment	1.111	-0.0285	-0.38	1.391	-0.0272	-0.37	-0.5338	-0.9998	1917238	CBDivE_007310	Cc1ccc(OCC(=O)N/N=C/c2ccc(cc2)C(=O)O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N11	compound treatment	1.115	-0.0245	-0.33	1.386	-0.0322	-0.44	-0.5439	-0.9903	1678621	CBDivE_007311	Clc1ccc(cc1S(=O)(=O)N2CCOCC2)S(=O)(=O)c3cccc(c3)S(=O)(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N12	compound treatment	1.097	-0.0425	-0.57	1.362	-0.0562	-0.77	-0.947	-0.9898	1917239	CBDivE_007312	Cc1ccc(cc1)n2c(csc2=NC(C)(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N13	compound treatment	1.136	-0.00351	-0.05	1.377	-0.0412	-0.56	-0.4303	-0.764	1646379	CBDivE_007313	OC(=O)c1cccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N14	compound treatment	1.119	-0.0205	-0.28	1.378	-0.0402	-0.55	-0.5829	-0.95	1917240	CBDivE_007314	C/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N15	compound treatment	1.11	-0.0295	-0.4	1.364	-0.0542	-0.74	-0.8037	-0.9579	1917241	CBDivE_007315	Cc1ccc(N=c2scc(c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)n2CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N16	compound treatment	1.11	-0.0295	-0.4	1.37	-0.0482	-0.66	-0.7459	-0.9712	1917242	CBDivE_007316	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNC(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N17	compound treatment	1.07	-0.0695	-0.94	1.428	0.00984	0.13	-0.5682	-0.5998	1530401	CBDivE_007317	Brc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N18	compound treatment	1.137	-0.00251	-0.03	1.372	-0.0462	-0.63	-0.469	-0.744	1917243	CBDivE_007318	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N19	compound treatment	1.098	-0.0415	-0.56	1.445	0.0268	0.37	-0.1372	-0.205	1704106	CBDivE_007319	CCc1ccccc1NC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	N20	compound treatment	1.124	-0.0155	-0.21	1.427	0.00884	0.12	-0.0627	-0.2597	1917244	CBDivE_007320	[O-][N+](=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O01	compound treatment	1.203	0.0635	0.86	1.439	0.0208	0.28	0.8066	0.8938	1739322	CBDivE_007321	CC(C)(C)c1cc(CCC(=O)NN)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O02	compound treatment	1.142	0.00249	0.03	1.439	0.0208	0.28	0.2247	0.7853	1917245	CBDivE_007322	Oc1c(CC=C)cccc1/C=N/NC(=O)COc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O03	compound treatment	1.159	0.0195	0.26	1.492	0.0738	1.01	0.8979	0.8628	1236436	CBDivE_007323	OC1(CC(=O)c2ccc3ccccc3c2)C(=O)Nc4ccccc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O04	compound treatment	1.173	0.0335	0.45	1.44	0.0218	0.3	0.5301	0.9795	1917246	CBDivE_007324	CCOC(=O)C(C1CCCCC1)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O05	compound treatment	1.167	0.0275	0.37	1.421	0.00284	0.04	0.2896	0.7767	1917247	CBDivE_007325	OC(=O)/C(=N\Nc1cccc2cccnc12)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O06	compound treatment	1.142	0.00249	0.03	1.419	8.4E-4	0.01	0.0319	0.8974	1917248	CBDivE_007326	Oc1ccccc1/C=N/NC(=O)c2ccc(OCc3cccc(Br)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O07	compound treatment	1.179	0.0395	0.53	1.384	-0.0342	-0.47	0.0473	0.0669	1917249	CBDivE_007327	Oc1ccccc1/C=N/c2ccc(cc2\N=C\c3ccccc3O)S(=O)(=O)c4ccc(\N=C\c5ccccc5O)c(\N=C\c6ccccc6O)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O08	compound treatment	1.152	0.0125	0.17	1.459	0.0408	0.56	0.513	0.8816	1917250	CBDivE_007328	COc1ccccc1OCC(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O09	compound treatment	1.204	0.0645	0.87	1.446	0.0278	0.38	0.8837	0.9309	1110028	CBDivE_007329	NC(CC(=O)O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O10	compound treatment	1.096	-0.0435	-0.59	1.396	-0.0222	-0.3	-0.6287	-0.9523	1133217	CBDivE_007330	OC(=O)c1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O11	compound treatment	1.215	0.0755	1.02	1.457	0.0388	0.53	1.0947	0.9536	1917251	CBDivE_007331	CC(Oc1ccc(Cl)cc1)C(=O)N/N=C\c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O12	compound treatment	1.18	0.0405	0.55	1.446	0.0278	0.38	0.6547	0.9842	1689464	CBDivE_007332	Cc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O13	compound treatment	1.164	0.0245	0.33	1.433	0.0148	0.2	0.3767	0.9723	1917252	CBDivE_007333	Cc1cccc(OCC(=O)N/N=C/c2cc(Br)cc(Br)c2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O14	compound treatment	1.127	-0.0125	-0.17	1.427	0.00884	0.12	-0.0341	-0.1643	1917253	CBDivE_007334	COc1ccc(OCc2ccc(cc2)C(=O)Nc3cccc(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O15	compound treatment	1.182	0.0425	0.57	1.428	0.00984	0.13	0.5002	0.8497	1917254	CBDivE_007335	CC(C)c1ccc(C)c(OCC(=O)N/N=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O16	compound treatment	1.149	0.00949	0.13	1.454	0.0358	0.49	0.4361	0.8632	1321434	CBDivE_007336	O=C(N1CCOCC1)c2ccc(CSc3ccc(Oc4ccccc4)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O17	compound treatment	1.183	0.0435	0.59	1.504	0.0858	1.17	1.2426	0.949	1917255	CBDivE_007337	CC(=C)C(=O)Nc1cc(NC(=O)C(=C)C)cc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O18	compound treatment	1.175	0.0355	0.48	1.503	0.0848	1.16	1.1566	0.9238	1330381	CBDivE_007338	Cc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O19	compound treatment	1.244	0.104	1.41	1.446	0.0278	0.38	1.2652	0.8667	1917256	CBDivE_007339	OC(=O)CCCCc1ccc(s1)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	O20	compound treatment	1.104	-0.0355	-0.48	1.463	0.0448	0.61	0.0936	0.1206	1917257	CBDivE_007340	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(Br)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P01	compound treatment	1.142	0.00249	0.03	1.401	-0.0172	-0.23	-0.1417	-0.5994	1448803	CBDivE_007341	O=S(=O)(N1CCCCC1)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P02	compound treatment	1.132	-0.00751	-0.1	1.38	-0.0382	-0.52	-0.4396	-0.8292	1917258	CBDivE_007342	C/C(=N/NC(=O)c1cccc(Cl)c1)/c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P03	compound treatment	1.207	0.0675	0.91	1.291	-0.127	-1.73	-0.5823	-0.2973	1917259	CBDivE_007343	CC(CNC=C1C(=O)CC(C)(C)CC1=O)NC=C2C(=O)CC(C)(C)CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P04	compound treatment	1.106	-0.0335	-0.45	1.38	-0.0382	-0.52	-0.6876	-0.9975	1917260	CBDivE_007344	CC(=O)OCS(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P05	compound treatment	1.13	-0.00951	-0.13	1.384	-0.0342	-0.47	-0.4201	-0.8695	1917261	CBDivE_007345	Clc1ccc(cc1S(=O)(=O)Nc2ccccc2)S(=O)(=O)c3cccc(c3)S(=O)(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P06	compound treatment	1.1	-0.0395	-0.53	1.367	-0.0512	-0.7	-0.8702	-0.9912	1917262	CBDivE_007346	Oc1ccc(cc1/C=N/NC(=O)c2cccc(Cl)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P07	compound treatment	1.125	-0.0145	-0.2	1.365	-0.0532	-0.72	-0.651	-0.867	1303161	CBDivE_007347	Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)Nc3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P08	compound treatment	1.142	0.00249	0.03	1.358	-0.0602	-0.82	-0.5563	-0.6776	1345449	CBDivE_007348	Oc1ccccc1NC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P09	compound treatment	1.076	-0.0635	-0.86	1.278	-0.14	-1.91	-1.9573	-0.9345	1624988	CBDivE_007349	Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3cccc(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P10	compound treatment	0.767	-0.373	-5.03	0.903	-0.515	-7.02	-8.5209	-0.9865	1917263	CBDivE_007350	COc1ccc(/C=N/NC(=O)CNc2ccc(C)cc2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P11	compound treatment	1.126	-0.0135	-0.18	1.339	-0.0792	-1.08	-0.8921	-0.8149	1249059	CBDivE_007351	Oc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P12	compound treatment	1.108	-0.0315	-0.43	1.333	-0.0852	-1.16	-1.1217	-0.9071	1079144	CBDivE_007352	Cc1c(CCO)sc[n+]1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P13	compound treatment	1.122	-0.0175	-0.24	1.384	-0.0342	-0.47	-0.4964	-0.9504	1547530	CBDivE_007353	O=S(=O)(N1CCCCC1)c2cccc(c2)S(=O)(=O)c3cccc(c3)S(=O)(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P14	compound treatment	1.109	-0.0305	-0.41	1.415	-0.00316	-0.04	-0.3215	-0.7769	1917264	CBDivE_007354	[O-][N+](=O)c1ccccc1NC(=O)c2cc(ccc2Cl)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P15	compound treatment	1.18	0.0405	0.55	1.373	-0.0452	-0.62	-0.0492	-0.0597	1917265	CBDivE_007355	Cc1ccccc1NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P16	compound treatment	1.104	-0.0355	-0.48	1.371	-0.0472	-0.64	-0.7935	-0.9895	1627173	CBDivE_007356	OC(=O)CCCC(=O)Nc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P17	compound treatment	1.094	-0.0455	-0.61	1.348	-0.0702	-0.96	-1.1106	-0.977	1917266	CBDivE_007357	OC(=O)CSc1cccc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P18	compound treatment	1.047	-0.0925	-1.25	1.399	-0.0192	-0.26	-1.0672	-0.837	1917267	CBDivE_007358	C(=N/c1ccc(\N=C\c2ccc[nH]2)cc1)\c3ccc[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P19	compound treatment	1.166	0.0265	0.36	1.383	-0.0352	-0.48	-0.0863	-0.1443	1917268	CBDivE_007359	OC(COCCC1(CC2CC3CC(C2)C1)C3)CN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.23	P20	compound treatment	1.112	-0.0275	-0.37	1.364	-0.0542	-0.74	-0.7846	-0.9493	1917269	CBDivE_007360	COc1ccc(cc1Cl)c2ccc(/C=N/Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A01	compound treatment	0.074	-1.11	-14.95	1.419	-0.00482	-0.07	-10.6172	-0.7102	1917270	CBDivE_007361	COc1cc(Br)c(Br)c(/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A02	compound treatment	0.07	-1.11	-15.0	1.431	0.00718	0.1	-10.5397	-0.7025	1917271	CBDivE_007362	O=C(CCc1ccccc1)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A03	compound treatment	1.173	-0.00912	-0.12	1.458	0.0342	0.47	0.2425	0.5032	1917272	CBDivE_007363	Cc1ccc(OCC(=O)N/N=C/c2cc(Br)c(O)c(Br)c2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A04	compound treatment	1.232	0.0499	0.67	1.441	0.0172	0.23	0.6414	0.9003	1917273	CBDivE_007364	Cc1ccc(/N=C/c2ccc[nH]2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A05	compound treatment	1.639	0.457	6.16	1.481	0.0572	0.78	4.9097	0.7903	1675948	CBDivE_007365	OC(=O)C(NC(=O)c1ccc(F)cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A06	compound treatment	0.065	-1.12	-15.07	1.379	-0.0448	-0.61	-11.0888	-0.7352	1356818	CBDivE_007366	Clc1ccc(cc1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A07	compound treatment	1.565	0.383	5.17	1.536	0.112	1.53	4.7341	0.8788	1917274	CBDivE_007367	NC(=O)C1CC=CCC1C(=O)OCC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A08	compound treatment	0.052	-1.13	-15.25	1.522	0.0982	1.34	-9.8339	-0.6425	1917275	CBDivE_007368	Cc1ccc(cc1)C(=O)NC(N2CCCCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A09	compound treatment	1.197	0.0149	0.2	1.398	-0.0258	-0.35	-0.1071	-0.2641	1917276	CBDivE_007369	CCOc1ccc2n(C)c(=NC(=O)c3ccc(cc3)[N+](=O)[O-])sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A10	compound treatment	1.258	0.0759	1.02	1.395	-0.0288	-0.39	0.4459	0.4067	1917277	CBDivE_007370	CN(C)c1ccc(cc1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A11	compound treatment	1.588	0.406	5.48	1.523	0.0992	1.35	4.8281	0.856	1917278	CBDivE_007371	OC(=O)C1SCC(NC(=O)c2ccccc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A12	compound treatment	0.074	-1.11	-14.95	1.483	0.0592	0.81	-10.0001	-0.668	1917279	CBDivE_007372	CCOc1ccc(cc1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A13	compound treatment	1.197	0.0149	0.2	1.501	0.0772	1.05	0.8861	0.8271	1917280	CBDivE_007373	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-])C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A14	compound treatment	1.175	-0.00712	-0.1	1.442	0.0182	0.25	0.1073	0.4038	1602465	CBDivE_007374	Cc1cc(nc2ccc3ccccc3c12)c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A15	compound treatment	1.157	-0.0251	-0.34	1.474	0.0502	0.68	0.2442	0.3198	1917281	CBDivE_007375	CC(C)(C)C(=O)OCCCN1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A16	compound treatment	1.141	-0.0411	-0.55	1.429	0.00518	0.07	-0.3423	-0.6122	1917282	CBDivE_007376	CC(=O)c1c(C)n(c2ccccc2)c(=O)nc1NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A17	compound treatment	1.154	-0.0281	-0.38	1.508	0.0842	1.15	0.5434	0.4495	1917283	CBDivE_007377	COc1cccc(/C=N/c2ccc3ncccc3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A18	compound treatment	1.226	0.0439	0.59	1.386	-0.0378	-0.52	0.0539	0.0686	1564642	CBDivE_007378	COc1ccc(Cl)cc1N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A19	compound treatment	1.225	0.0429	0.58	1.503	0.0792	1.08	1.1725	0.9572	1917284	CBDivE_007379	O=C1C(C(=O)c2ccccc12)C3=CC(C(N=N3)c4c[nH]c5ccccc45)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	A20	compound treatment	1.179	-0.00312	-0.04	1.418	-0.00582	-0.08	-0.0859	-0.956	1917285	CBDivE_007380	CCN(CC)S(=O)(=O)c1ccc(Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B01	compound treatment	0.06	-1.12	-15.14	1.348	-0.0758	-1.03	-11.4354	-0.7536	1917286	CBDivE_007381	COc1ccc(O)c(/C=N/NC(=O)c2ccccc2OCc3cccc(Br)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B02	compound treatment	0.062	-1.12	-15.11	1.453	0.0292	0.4	-10.4039	-0.6882	1917287	CBDivE_007382	Nc1ccc(/C=C/c2ccccc2)c(c1)S(=O)(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B03	compound treatment	1.196	0.0139	0.19	1.452	0.0282	0.38	0.4041	0.9454	1035314	CBDivE_007383	Nc1ccc(NC(=O)c2ccc(cc2)C(=O)Nc3ccc(N)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B04	compound treatment	1.12	-0.0621	-0.84	1.459	0.0352	0.48	-0.2534	-0.2624	1917288	CBDivE_007384	CCOC(=O)/C=C/c1ccc(\N=C\c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B05	compound treatment	1.183	8.78E-4	0.01	1.47	0.0462	0.63	0.4537	0.7203	1917289	CBDivE_007385	OCCS(=O)(=O)c1cc([N+](=O)[O-])c(O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B06	compound treatment	1.202	0.0199	0.27	1.395	-0.0288	-0.39	-0.0883	-0.1855	1917290	CBDivE_007386	CCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B07	compound treatment	1.135	-0.0471	-0.64	1.447	0.0232	0.32	-0.226	-0.3184	1917291	CBDivE_007387	O=S1(=O)Nc2cc3nc4ccccc4nc3c5cccc1c25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B08	compound treatment	1.25	0.0679	0.92	1.387	-0.0368	-0.5	0.2925	0.28	1537317	CBDivE_007388	OC(=O)c1ccccc1C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B09	compound treatment	1.252	0.0699	0.94	1.443	0.0192	0.26	0.8515	0.8704	1917292	CBDivE_007389	c1ccc(cc1)c2ncnc3n(nnc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B10	compound treatment	1.314	0.132	1.78	1.453	0.0292	0.4	1.5394	0.8444	1917293	CBDivE_007390	Cc1cccc(OP(=O)(O)Oc2cccc(C)c2C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B11	compound treatment	1.214	0.0319	0.43	1.368	-0.0558	-0.76	-0.2342	-0.2678	1917294	CBDivE_007391	OC(=O)c1cc([N+](=O)[O-])c(N2CCOCC2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B12	compound treatment	1.133	-0.0491	-0.66	1.424	1.79E-4	0.0	-0.4669	-0.7045	1701780	CBDivE_007392	N(c1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B13	compound treatment	1.166	-0.0161	-0.22	1.376	-0.0478	-0.65	-0.6149	-0.8945	1917295	CBDivE_007393	Cc1ccc(OCC(=O)N/N=C/c2ccc(O)cc2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B14	compound treatment	1.202	0.0199	0.27	1.455	0.0312	0.43	0.4903	0.9753	1917296	CBDivE_007394	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNC4CCCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B15	compound treatment	1.133	-0.0491	-0.66	1.4	-0.0238	-0.32	-0.6983	-0.9462	1917297	CBDivE_007395	CN1CCN(CC(=O)N/N=C\c2cccc(c2)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B16	compound treatment	1.354	0.172	2.32	1.412	-0.0118	-0.16	1.5256	0.6564	1917298	CBDivE_007396	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/c3cccc(N)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B17	compound treatment	1.184	0.00188	0.03	1.469	0.0452	0.62	0.4535	0.7356	1917299	CBDivE_007397	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2c(C)cc(O)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B18	compound treatment	1.225	0.0429	0.58	1.459	0.0352	0.48	0.7482	0.9957	1536183	CBDivE_007398	Nc1nc(c(CC(=O)O)s1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B19	compound treatment	1.129	-0.0531	-0.72	1.392	-0.0318	-0.43	-0.8136	-0.9711	1316411	CBDivE_007399	NS(=O)(=O)c1cc(O)c2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	B20	compound treatment	1.191	0.00888	0.12	1.428	0.00418	0.06	0.125	0.9423	1917300	CBDivE_007400	N=C1SC2CS(=O)(=O)CC2N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C01	compound treatment	0.068	-1.11	-15.03	1.447	0.0232	0.32	-10.4045	-0.6921	1917301	CBDivE_007401	Clc1ccc(c2ccc(/C=N/Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C02	compound treatment	0.066	-1.12	-15.06	1.424	1.79E-4	0.0	-10.6453	-0.707	1917302	CBDivE_007402	O=C(COc1ccccc1)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C03	compound treatment	1.608	0.426	5.75	1.462	0.0382	0.52	4.4307	0.768	1917303	CBDivE_007403	Cc1cc(C)c2c(N)c(sc2n1)C(=O)ONc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C04	compound treatment	0.068	-1.11	-15.03	1.396	-0.0278	-0.38	-10.8962	-0.7247	1917304	CBDivE_007404	O=C(N/N=C/c1ccc[nH]1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C05	compound treatment	1.24	0.0579	0.78	1.515	0.0912	1.24	1.4313	0.9749	1777206	CBDivE_007405	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C06	compound treatment	1.234	0.0519	0.7	1.483	0.0592	0.81	1.0655	0.9975	1701757	CBDivE_007406	CN(C)C(=O)c1ccccc1c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C07	compound treatment	1.534	0.352	4.75	1.464	0.0402	0.55	3.7441	0.7835	1917305	CBDivE_007407	CC(Oc1ccc2ccccc2c1)C(=O)N/N=C/c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C08	compound treatment	0.067	-1.12	-15.04	1.423	-8.21E-4	-0.01	-10.6454	-0.7076	1416516	CBDivE_007408	Oc1ccc(Br)cc1c2nc3ccc4ccccc4c3c5CCCc52
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C09	compound treatment	1.537	0.355	4.79	1.488	0.0642	0.88	4.0041	0.8227	1917306	CBDivE_007409	COC(=O)c1ccc(cc1C(=O)OC)c2ncc(o2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C10	compound treatment	0.055	-1.13	-15.21	1.475	0.0512	0.7	-10.2585	-0.6739	1917307	CBDivE_007410	CCOC(=O)c1cc(COC(=O)CC)oc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C11	compound treatment	1.484	0.302	4.07	1.44	0.0162	0.22	3.0357	0.7443	1917308	CBDivE_007411	FC(F)(F)C(F)(F)C(F)(F)C(=O)N(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C12	compound treatment	0.059	-1.12	-15.15	1.411	-0.0128	-0.17	-10.8375	-0.7152	1917309	CBDivE_007412	COC(=O)c1ccc(cc1C(=O)OC)c2ncc(o2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C13	compound treatment	1.555	0.373	5.03	1.455	0.0312	0.43	3.8576	0.7641	1343935	CBDivE_007413	O=C(CC(Nc1ccc2ccccc2c1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C14	compound treatment	0.057	-1.13	-15.18	1.438	0.0142	0.19	-10.5962	-0.698	1211460	CBDivE_007414	CCOC(=O)C1=C(C)NC2=C(C1c3ccc(Br)o3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C15	compound treatment	1.244	0.0619	0.83	1.49	0.0662	0.9	1.2284	0.9992	1917310	CBDivE_007415	CCC1(CC)C(=O)NC(=NNC(=S)N)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C16	compound treatment	1.187	0.00488	0.07	1.456	0.0322	0.44	0.3568	0.8042	1161772	CBDivE_007416	Cc1ccc(cc1)C(=O)Nc2ccc(NC(=O)c3ccccc3N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C17	compound treatment	1.188	0.00588	0.08	1.457	0.0332	0.45	0.376	0.8186	1917311	CBDivE_007417	C(N(Cc1ccccc1)/N=C/c2ccco2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C18	compound treatment	1.264	0.0819	1.1	1.474	0.0502	0.68	1.2649	0.9735	1776476	CBDivE_007418	[O-][N+](=O)c1cc(co1)c2csc(NC=O)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C19	compound treatment	1.571	0.389	5.25	1.481	0.0572	0.78	4.261	0.8034	1781817	CBDivE_007419	[O-][N+](=O)Cc1n[nH]c(=O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	C20	compound treatment	0.06	-1.12	-15.14	1.423	-8.21E-4	-0.01	-10.7122	-0.7076	1917312	CBDivE_007420	COc1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D01	compound treatment	0.078	-1.1	-14.9	1.385	-0.0388	-0.53	-10.9069	-0.7318	1917313	CBDivE_007421	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2ccccc2OCc3cccc(Br)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D02	compound treatment	0.065	-1.12	-15.07	1.384	-0.0398	-0.54	-11.0406	-0.7321	1917314	CBDivE_007422	Cc1ccc(N)cc1S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D03	compound treatment	1.15	-0.0321	-0.43	1.4	-0.0238	-0.32	-0.5361	-0.9899	1062982	CBDivE_007423	OC(=O)c1cccc2-c3ccc(Cl)cc3C(=O)c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D04	compound treatment	1.173	-0.00912	-0.12	1.412	-0.0118	-0.16	-0.201	-0.9911	1917315	CBDivE_007424	FC(F)C(F)(F)COC(=O)/C=C/C(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D05	compound treatment	1.156	-0.0261	-0.35	1.427	0.00318	0.04	-0.2185	-0.6155	1917316	CBDivE_007425	Oc1nc(O)nc(/C=C/c2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D06	compound treatment	1.178	-0.00412	-0.06	1.428	0.00418	0.06	0.001	0.0122	1917317	CBDivE_007426	COc1ccccc1NC(=O)c2c(/N=C/c3ccccc3[N+](=O)[O-])cnn2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D07	compound treatment	1.232	0.0499	0.67	1.453	0.0292	0.4	0.7572	0.9686	1510868	CBDivE_007427	OCCNS(=O)(=O)c1ccc2cc(O)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D08	compound treatment	1.214	0.0319	0.43	1.385	-0.0388	-0.53	-0.0702	-0.103	1633871	CBDivE_007428	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(F)c(F)c3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D09	compound treatment	1.134	-0.0481	-0.65	1.383	-0.0408	-0.56	-0.8527	-0.9971	1917318	CBDivE_007429	NC(=O)COc1ccc(OCC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D10	compound treatment	1.22	0.0379	0.51	1.403	-0.0208	-0.28	0.1606	0.2747	1917319	CBDivE_007430	CS(=O)(=O)N1CCN(CC1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D11	compound treatment	1.135	-0.0471	-0.64	1.446	0.0222	0.3	-0.2357	-0.3347	1917320	CBDivE_007431	Cc1ccc(C)c(Nc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D12	compound treatment	1.183	8.78E-4	0.01	1.443	0.0192	0.26	0.1933	0.7384	1917321	CBDivE_007432	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)/C=C/c3cccc(c3)[N+](=O)[O-])cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D13	compound treatment	1.224	0.0419	0.56	1.412	-0.0118	-0.16	0.2855	0.486	1917322	CBDivE_007433	Cc1ccc(OCC(=O)N/N=C/c2ccc(o2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D14	compound treatment	1.257	0.0749	1.01	1.388	-0.0358	-0.49	0.3689	0.3288	1548096	CBDivE_007434	CCc1cccc(NCn2nnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D15	compound treatment	1.172	-0.0101	-0.14	1.436	0.0122	0.17	0.0209	0.0971	1917323	CBDivE_007435	CCN(CC)CC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D16	compound treatment	1.176	-0.00612	-0.08	1.349	-0.0748	-1.02	-0.7799	-0.7619	1070737	CBDivE_007436	OC(=O)CCC(=O)Nc1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D17	compound treatment	1.206	0.0239	0.32	1.434	0.0102	0.14	0.3259	0.9292	1917324	CBDivE_007437	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2cc(Br)c(O)c(Br)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D18	compound treatment	1.14	-0.0421	-0.57	1.41	-0.0138	-0.19	-0.5351	-0.8938	1599205	CBDivE_007438	CCN1C(=O)c2cccc3c(NC(=O)c4ccccc4C)ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D19	compound treatment	1.155	-0.0271	-0.37	1.48	0.0562	0.77	0.283	0.3333	1917325	CBDivE_007439	Cc1ccc-2c(c1)C(=O)c3c2cccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	D20	compound treatment	1.218	0.0359	0.48	1.422	-0.00182	-0.02	0.3247	0.6699	1917326	CBDivE_007440	CC(C)(C)NC(=O)C[n+]1ccc(/C=N/O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E01	compound treatment	0.059	-1.12	-15.15	1.433	0.00918	0.13	-10.6253	-0.7012	1917327	CBDivE_007441	[O-][N+](=O)c1ccc(c2ccc(/C=N/Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E02	compound treatment	0.053	-1.13	-15.23	1.421	-0.00282	-0.04	-10.7983	-0.7089	1917328	CBDivE_007442	O=C1N(/N=C/c2ccc[nH]2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E03	compound treatment	1.441	0.259	3.49	1.477	0.0532	0.73	2.9823	0.8361	1917329	CBDivE_007443	Brc1ccc(cc1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E04	compound treatment	0.063	-1.12	-15.1	1.472	0.0482	0.66	-10.2111	-0.6757	1917330	CBDivE_007444	[O-][N+](=O)c1ccc(N/N=C/c2ccc[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E05	compound treatment	1.52	0.338	4.56	1.487	0.0632	0.86	3.8323	0.8261	1380130	CBDivE_007445	OC(COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)CN5CCOCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E06	compound treatment	0.055	-1.13	-15.21	1.428	0.00418	0.06	-10.7117	-0.7045	1917331	CBDivE_007446	[O-][N+](=O)c1ccc(N/N=C/c2ccc[nH]2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E07	compound treatment	1.789	0.607	8.19	1.518	0.0942	1.28	6.6973	0.8081	1917332	CBDivE_007447	COc1cccc(/C=N/NC(=O)C(C)Oc2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E08	compound treatment	0.059	-1.12	-15.15	1.449	0.0252	0.34	-10.471	-0.6909	1917333	CBDivE_007448	CC(C)(C)C(=O)OCCCN1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E09	compound treatment	1.54	0.358	4.83	1.426	0.00218	0.03	3.4349	0.7114	1917334	CBDivE_007449	[O-][N+](=O)c1ccccc1C(=O)NNC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E10	compound treatment	0.05	-1.13	-15.27	1.448	0.0242	0.33	-10.5665	-0.6917	1526252	CBDivE_007450	Oc1ccc(cc1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E11	compound treatment	1.177	-0.00512	-0.07	1.47	0.0462	0.63	0.3964	0.6258	1917335	CBDivE_007451	OC1C(CCOC1OCc2ccccc2)/N=C/c3cc(ccc3O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E12	compound treatment	1.292	0.11	1.48	1.417	-0.00682	-0.09	0.9824	0.6614	1917336	CBDivE_007452	CCc1n(nc2ccccc12)c3ccccc3C(=O)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E13	compound treatment	1.671	0.489	6.6	1.434	0.0102	0.14	4.7617	0.7218	1917337	CBDivE_007453	COC(=O)CC1C(O[N+](=C1C(=O)OC)[O-])C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E14	compound treatment	0.045	-1.14	-15.34	1.395	-0.0288	-0.39	-11.1253	-0.725	1694556	CBDivE_007454	Cc1ccc(cc1)c2cc3C(=O)c4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E15	compound treatment	1.175	-0.00712	-0.1	1.536	0.112	1.53	1.0137	0.6614	1917338	CBDivE_007455	C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E16	compound treatment	1.135	-0.0471	-0.64	1.402	-0.0218	-0.3	-0.6599	-0.9402	1917339	CBDivE_007456	CC(=O)Nc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E17	compound treatment	1.164	-0.0181	-0.24	1.433	0.00918	0.13	-0.0844	-0.3072	1742082	CBDivE_007457	O=C1c2ccccc2-c3nnc(cc13)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E18	compound treatment	1.189	0.00688	0.09	1.436	0.0122	0.17	0.183	0.9622	1917340	CBDivE_007458	NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(O)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E19	compound treatment	1.176	-0.00612	-0.08	1.505	0.0812	1.11	0.7244	0.6525	1917341	CBDivE_007459	[O-][N+](=O)c1ccc(cc1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	E20	compound treatment	1.169	-0.0131	-0.18	1.441	0.0172	0.23	0.0405	0.1378	1917342	CBDivE_007460	COC(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F01	compound treatment	0.056	-1.13	-15.19	1.366	-0.0578	-0.79	-11.3	-0.7428	1917343	CBDivE_007461	Brc1ccccc1/C=N/NC(=O)C(Oc2ccccc2)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F02	compound treatment	0.05	-1.13	-15.27	1.39	-0.0338	-0.46	-11.1258	-0.7281	1917344	CBDivE_007462	Cc1ccc(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F03	compound treatment	1.152	-0.0301	-0.41	1.444	0.0202	0.28	-0.0928	-0.189	1917345	CBDivE_007463	CCN(c1ccccc1)S(=O)(=O)c2cc(ccc2N)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F04	compound treatment	1.095	-0.0871	-1.18	1.368	-0.0558	-0.76	-1.3693	-0.9779	1917346	CBDivE_007464	OCC(CO)Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F05	compound treatment	1.175	-0.00712	-0.1	1.463	0.0392	0.53	0.3098	0.5708	1041543	CBDivE_007465	CCOC(=O)c1c(O)cc2ccccc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F06	compound treatment	1.205	0.0229	0.31	1.393	-0.0308	-0.42	-0.0789	-0.1514	1917347	CBDivE_007466	Cn1nc(NCc2ccccc2)c(n1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F07	compound treatment	1.154	-0.0281	-0.38	1.355	-0.0688	-0.94	-0.9319	-0.9206	1247989	CBDivE_007467	NS(=O)(=O)c1ccc(O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F08	compound treatment	1.22	0.0379	0.51	1.457	0.0332	0.45	0.6813	0.9982	1134618	CBDivE_007468	COc1ccc(C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nc(C)cc(C)n3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F09	compound treatment	1.172	-0.0101	-0.14	1.424	1.79E-4	0.0	-0.0948	-0.6944	1305894	CBDivE_007469	CC(=C)CNC(=S)N1CCN(CC1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F10	compound treatment	1.242	0.0599	0.81	1.464	0.0402	0.55	0.9586	0.9821	1917348	CBDivE_007470	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F11	compound treatment	1.155	-0.0271	-0.37	1.479	0.0552	0.75	0.2733	0.3267	1917349	CBDivE_007471	Cc1cccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F12	compound treatment	1.216	0.0339	0.46	1.4	-0.0238	-0.32	0.0935	0.1667	1284690	CBDivE_007472	COc1ccc(COCC(O)CN2CCN(C)CC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F13	compound treatment	1.096	-0.0861	-1.16	1.442	0.0182	0.25	-0.6463	-0.544	1917350	CBDivE_007473	Cc1ccc(OCC(=O)N/N=C/c2ccc3OCOc3c2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F14	compound treatment	1.16	-0.0221	-0.3	1.416	-0.00782	-0.11	-0.2864	-0.9038	1917351	CBDivE_007474	COc1cc(/C=N/NC(=O)C2CC2c3ccccc3)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F15	compound treatment	1.133	-0.0491	-0.66	1.444	0.0202	0.28	-0.274	-0.3819	1917352	CBDivE_007475	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=O)c4ccccc4)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F16	compound treatment	1.168	-0.0141	-0.19	1.425	0.00118	0.02	-0.1233	-0.6452	1203343	CBDivE_007476	OC(=O)CCC(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F17	compound treatment	1.142	-0.0401	-0.54	1.477	0.0532	0.73	0.13	0.1437	1917353	CBDivE_007477	Cc1ccc(OCC(=O)N/N=C/c2c(C)c(Br)c(O)c(Br)c2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F18	compound treatment	1.32	0.138	1.86	1.45	0.0262	0.36	1.5677	0.8277	1917354	CBDivE_007478	CN1CCN(CC1)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F19	compound treatment	1.171	-0.0111	-0.15	1.476	0.0522	0.71	0.397	0.546	1448964	CBDivE_007479	Nc1cc2-c3ccccc3C(=O)c4cccc(n1)c42
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	F20	compound treatment	1.23	0.0479	0.65	1.378	-0.0458	-0.62	0.0149	0.0166	1148289	CBDivE_007480	OCCN(CCO)c1nc(ncc1F)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G01	compound treatment	0.054	-1.13	-15.22	1.424	1.79E-4	0.0	-10.7598	-0.707	1917355	CBDivE_007481	Oc1c(Br)cc(Cl)cc1/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G02	compound treatment	0.065	-1.12	-15.07	1.401	-0.0228	-0.31	-10.8766	-0.7216	1917356	CBDivE_007482	O=C(N/N=C/c1ccc[nH]1)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G03	compound treatment	0.315	-0.867	-11.7	1.449	0.0252	0.34	-8.029	-0.6861	1430350	CBDivE_007483	CC(=O)Nc1ccc(NC(=O)C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G04	compound treatment	1.3	0.118	1.59	1.45	0.0262	0.36	1.3769	0.8448	1917357	CBDivE_007484	Cc1ccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G05	compound treatment	1.154	-0.0281	-0.38	1.438	0.0142	0.19	-0.1315	-0.3089	1917358	CBDivE_007485	CN1CCN(CC(O)COCCC2(CC3CC4CC(C3)C2)C4)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G06	compound treatment	1.184	0.00188	0.03	1.391	-0.0328	-0.45	-0.2986	-0.666	1917359	CBDivE_007486	CC(=O)Nc1ccc(/N=C/c2ccc[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G07	compound treatment	1.173	-0.00912	-0.12	1.443	0.0192	0.26	0.0979	0.3388	1917360	CBDivE_007487	CC(Oc1cccc2ccccc12)C(=O)N/N=C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G08	compound treatment	1.187	0.00488	0.07	1.429	0.00518	0.07	0.0965	0.9994	1917361	CBDivE_007488	CC1C/2CC(C(\C2=N\O)S(=O)(=O)NC(C)(C)C)C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G09	compound treatment	1.168	-0.0141	-0.19	1.428	0.00418	0.06	-0.0944	-0.4748	1557044	CBDivE_007489	Oc1cccc(c1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G10	compound treatment	1.232	0.0499	0.67	1.537	0.113	1.54	1.5671	0.9308	1736719	CBDivE_007490	Cc1cc(=O)[nH]c2sc(C(=O)c3ccc(Cl)c(Cl)c3)c(N)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G11	compound treatment	1.534	0.352	4.75	1.478	0.0542	0.74	3.8791	0.8074	1393985	CBDivE_007491	OC1C2SCC1(CCC2O)NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G12	compound treatment	0.059	-1.12	-15.15	1.441	0.0172	0.23	-10.5482	-0.6961	1917362	CBDivE_007492	CCC(=O)c1ccc(Br)cc1N=[N+]([O-])c2cc(Br)ccc2C(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G13	compound treatment	1.482	0.3	4.05	1.489	0.0652	0.89	3.4891	0.8424	1176108	CBDivE_007493	Brc1cc(Br)c2cccnc2c1NS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G14	compound treatment	0.051	-1.13	-15.26	1.41	-0.0138	-0.19	-10.9234	-0.7158	1917363	CBDivE_007494	COc1cccc(C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G15	compound treatment	1.539	0.357	4.81	1.499	0.0752	1.03	4.1293	0.8389	1917364	CBDivE_007495	C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/CCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G16	compound treatment	0.052	-1.13	-15.25	1.473	0.0492	0.67	-10.3064	-0.6754	1917365	CBDivE_007496	Oc1ccnc(c1C(=O)c2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G17	compound treatment	1.173	-0.00912	-0.12	1.478	0.0542	0.74	0.4354	0.5813	1917366	CBDivE_007497	O=C(OCCCN1CCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G18	compound treatment	1.256	0.0739	1.0	1.417	-0.00682	-0.09	0.639	0.6383	1917367	CBDivE_007498	NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G19	compound treatment	1.209	0.0269	0.36	1.457	0.0332	0.45	0.5763	0.994	1917368	CBDivE_007499	COc1ccc(cc1OC)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	G20	compound treatment	1.233	0.0509	0.69	1.376	-0.0478	-0.65	0.0242	0.0256	1917369	CBDivE_007500	Fc1ccc(cc1)C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H01	compound treatment	0.08	-1.1	-14.87	1.329	-0.0948	-1.29	-11.4278	-0.7657	1917370	CBDivE_007501	OC(C(=O)N/N=C/c1cccc(Br)c1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H02	compound treatment	0.068	-1.11	-15.03	1.427	0.00318	0.04	-10.5973	-0.7051	1917371	CBDivE_007502	Cc1ccc(OCC(=O)N/N=C/C=C/c2ccco2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H03	compound treatment	1.133	-0.0491	-0.66	1.356	-0.0678	-0.92	-1.1225	-0.9866	1917372	CBDivE_007503	Clc1cc2c(=O)c3ccccc3[nH]c2c4C(=O)c5ccccc5C(=O)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H04	compound treatment	1.156	-0.0261	-0.35	1.374	-0.0498	-0.68	-0.7296	-0.9533	1917373	CBDivE_007504	CCCCC(=O)Nc1cccc(c1)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H05	compound treatment	1.192	0.00988	0.13	1.4	-0.0238	-0.32	-0.1355	-0.3858	1917374	CBDivE_007505	CC1C=CC(C)[C@@H]([C@H]1C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H06	compound treatment	1.214	0.0319	0.43	1.38	-0.0438	-0.6	-0.1184	-0.1609	1917375	CBDivE_007506	Cn1ncc(Nc2ccccc2)c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H07	compound treatment	1.173	-0.00912	-0.12	1.406	-0.0178	-0.24	-0.2589	-0.9503	1143690	CBDivE_007507	NS(=O)(=O)c1cc(O)c2c(cccc2c1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H08	compound treatment	1.198	0.0159	0.21	1.381	-0.0428	-0.58	-0.2614	-0.4203	1917376	CBDivE_007508	COc1cc(/C=N/CCc2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H09	compound treatment	1.174	-0.00812	-0.11	1.37	-0.0538	-0.73	-0.5964	-0.8038	1917377	CBDivE_007509	OC(=O)CNc1c(cc(cc1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H10	compound treatment	1.144	-0.0381	-0.51	1.476	0.0522	0.71	0.1395	0.1589	1917378	CBDivE_007510	COc1ccc(/C=C\2/SC(=S)N(CC(=O)O)C2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H11	compound treatment	1.157	-0.0251	-0.34	1.375	-0.0488	-0.67	-0.7104	-0.9509	1917379	CBDivE_007511	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H12	compound treatment	1.139	-0.0431	-0.58	1.394	-0.0298	-0.41	-0.6989	-0.9847	1435296	CBDivE_007512	COc1ccc(COCC(O)CN2CCCCC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H13	compound treatment	1.215	0.0329	0.44	1.48	0.0562	0.77	0.8553	0.9662	1917380	CBDivE_007513	Cc1ccc(OCC(=O)N/N=C/c2c[nH]c3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H14	compound treatment	1.218	0.0359	0.48	1.412	-0.0118	-0.16	0.2283	0.4474	1917381	CBDivE_007514	O=C(Nc1cc2-c3[nH]c4ccccc4c3CCc2oc1=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H15	compound treatment	1.171	-0.0111	-0.15	1.423	-8.21E-4	-0.01	-0.114	-0.7578	1917382	CBDivE_007515	CNCC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H16	compound treatment	1.183	8.78E-4	0.01	1.452	0.0282	0.38	0.2801	0.7286	1917383	CBDivE_007516	CC(=C)CC1CC=CC(CC(=C)C)N1CC(O)C(F)(F)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H17	compound treatment	1.105	-0.0771	-1.04	1.433	0.00918	0.13	-0.6472	-0.6176	1917384	CBDivE_007517	Cc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H18	compound treatment	1.154	-0.0281	-0.38	1.359	-0.0648	-0.88	-0.8933	-0.9287	1917385	CBDivE_007518	Nc1nc(c(s1)C(=O)Nc2ccccc2Cl)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H19	compound treatment	1.193	0.0109	0.15	1.459	0.0352	0.48	0.443	0.883	1660956	CBDivE_007519	OCCS(=O)(=O)c1ccc2oc(=O)[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	H20	compound treatment	1.117	-0.0651	-0.88	1.389	-0.0348	-0.47	-0.957	-0.9583	1917386	CBDivE_007520	Cn1c2scc[n+]2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I01	compound treatment	0.07	-1.11	-15.0	1.408	-0.0158	-0.22	-10.7614	-0.7172	1917387	CBDivE_007521	Cc1ccc(cc1c2ccc(/C=N/Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I02	compound treatment	0.059	-1.12	-15.15	1.39	-0.0338	-0.46	-11.0399	-0.7283	1917388	CBDivE_007522	Oc1ccc(cc1/N=C/c2ccc[nH]2)S(=O)(=O)c3ccc(O)c(/N=C/c4ccc[nH]4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I03	compound treatment	0.39	-0.792	-10.69	1.477	0.0532	0.73	-7.0435	-0.6576	1395568	CBDivE_007523	CC(C)c1ccc(C)cc1OCC(O)CN2CCC(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I04	compound treatment	0.045	-1.14	-15.34	1.41	-0.0138	-0.19	-10.9806	-0.7157	1917389	CBDivE_007524	C(c1ccc(/N=C/c2ccc[nH]2)cc1)c3ccc(/N=C/c4ccc[nH]4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I05	compound treatment	1.175	-0.00712	-0.1	1.424	1.79E-4	0.0	-0.0662	-0.689	1917390	CBDivE_007525	O=C(NNC(=O)C1CC21CCC2)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I06	compound treatment	1.165	-0.0171	-0.23	1.413	-0.0108	-0.15	-0.2677	-0.9766	1682299	CBDivE_007526	C(N1CCN(Cc2ccccc2)C1c3ccc[nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I07	compound treatment	1.228	0.0459	0.62	1.491	0.0672	0.92	1.0854	0.9818	1318008	CBDivE_007527	Clc1ccc(cc1)S(=O)(=O)c2nc(oc2NCc3ccccc3)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I08	compound treatment	1.138	-0.0441	-0.6	1.486	0.0622	0.85	0.1787	0.1725	1618454	CBDivE_007528	Oc1ccc(cc1)c2cc3C(=O)c4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I09	compound treatment	1.191	0.00888	0.12	1.456	0.0322	0.44	0.395	0.8683	1917391	CBDivE_007529	Clc1ccc(NC(=O)NNC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I10	compound treatment	0.048	-1.13	-15.3	1.424	1.79E-4	0.0	-10.817	-0.707	1917392	CBDivE_007530	COc1cccc(c1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I11	compound treatment	1.174	-0.00812	-0.11	1.445	0.0212	0.29	0.1267	0.4103	1917393	CBDivE_007531	OC(=O)CCCC[C@@H]1SCC2(O)NC(=O)N[C@@H]12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I12	compound treatment	1.205	0.0229	0.31	1.498	0.0742	1.01	0.9335	0.8827	1917394	CBDivE_007532	O=C(COc1ccccc1)NNC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I13	compound treatment	1.231	0.0489	0.66	1.449	0.0252	0.34	0.709	0.9537	1917395	CBDivE_007533	COC(=O)C/C(=C(/Cl)\c1ccc(C)cc1)/C=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I14	compound treatment	1.182	-1.22E-4	0.0	1.418	-0.00582	-0.08	-0.0573	-0.7216	1255590	CBDivE_007534	OC(=O)c1ccccc1N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I15	compound treatment	1.216	0.0339	0.46	1.468	0.0442	0.6	0.7492	0.9907	1917396	CBDivE_007535	O=C(CCc1ccccc1)NNC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I16	compound treatment	1.239	0.0569	0.77	1.395	-0.0288	-0.39	0.2647	0.307	1735902	CBDivE_007536	COC(=O)c1ccc(CSc2ccc(Oc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I17	compound treatment	1.513	0.331	4.46	1.45	0.0262	0.36	3.4088	0.7612	1178542	CBDivE_007537	CC(CC(C)(C)N1CCCCC1)OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I18	compound treatment	0.514	-0.668	-9.01	1.493	0.0692	0.94	-5.7064	-0.6297	1917397	CBDivE_007538	Oc1ccc(cc1[N+](=O)[O-])C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I19	compound treatment	1.166	-0.0161	-0.22	1.422	-0.00182	-0.02	-0.1714	-0.7828	1917398	CBDivE_007539	[O-][N+](=O)c1cccc(c1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	I20	compound treatment	1.226	0.0439	0.59	1.441	0.0172	0.23	0.5842	0.9177	1917399	CBDivE_007540	COc1ccc(/C=N\NC(=O)C(O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J01	compound treatment	0.055	-1.13	-15.21	1.382	-0.0418	-0.57	-11.1552	-0.7331	1522204	CBDivE_007541	Nc1ccc(cc1)C(=O)Nc2ccc(NC(=O)c3ccc(N)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J02	compound treatment	0.078	-1.1	-14.9	1.447	0.0232	0.32	-10.3091	-0.6919	1917400	CBDivE_007542	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J03	compound treatment	1.202	0.0199	0.27	1.356	-0.0678	-0.92	-0.4643	-0.4822	1776736	CBDivE_007543	OC(CN1CCN(C/C=C/c2ccccc2)CC1)Cn3c4ccc(Cl)cc4c5cc(Cl)ccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J04	compound treatment	1.182	-1.22E-4	0.0	1.426	0.00218	0.03	0.0198	0.667	1917401	CBDivE_007544	COC(=O)C1C(C)NC(=O)NC1c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J05	compound treatment	1.16	-0.0221	-0.3	1.43	0.00618	0.08	-0.1514	-0.4884	1291683	CBDivE_007545	CCCCc1ccc(C(=O)O)c(C(=O)O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J06	compound treatment	1.092	-0.0901	-1.22	1.362	-0.0618	-0.84	-1.4558	-0.984	1917402	CBDivE_007546	CC1=Nc2ccc(C)cc2-c3[nH]c4ccccc4c3N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J07	compound treatment	1.117	-0.0651	-0.88	1.36	-0.0638	-0.87	-1.2366	-1.0	1777130	CBDivE_007547	CN1C(/C=C/c2ccccc2)N(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J08	compound treatment	1.135	-0.0471	-0.64	1.41	-0.0138	-0.19	-0.5828	-0.8789	1442370	CBDivE_007548	NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J09	compound treatment	1.795	0.613	8.27	1.422	-0.00182	-0.02	5.8289	0.705	1917403	CBDivE_007549	COc1ccc(/C=N/c2cnn(C)c2C(=O)N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J10	compound treatment	1.298	0.116	1.56	1.415	-0.00882	-0.12	1.0203	0.6508	1917404	CBDivE_007550	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J11	compound treatment	1.152	-0.0301	-0.41	1.38	-0.0438	-0.6	-0.7099	-0.9823	1039588	CBDivE_007551	CN1CCCC(CN2c3ccccc3Sc4ccccc24)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J12	compound treatment	1.166	-0.0161	-0.22	1.423	-8.21E-4	-0.01	-0.1617	-0.7425	1917405	CBDivE_007552	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=O)c4ccc(NC(=O)C)cc4)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J13	compound treatment	1.126	-0.0561	-0.76	1.383	-0.0408	-0.56	-0.929	-0.9886	1917406	CBDivE_007553	COc1cccc(/C=N\NC(=O)CN2CCN(C)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J14	compound treatment	1.257	0.0749	1.01	1.323	-0.101	-1.37	-0.2579	-0.1512	1917407	CBDivE_007554	COc1cc(/C=N/NC(=S)N)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J15	compound treatment	1.144	-0.0381	-0.51	1.387	-0.0368	-0.5	-0.7187	-0.9999	1917408	CBDivE_007555	CCNCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J16	compound treatment	1.145	-0.0371	-0.5	1.422	-0.00182	-0.02	-0.3717	-0.7413	1188908	CBDivE_007556	Clc1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J17	compound treatment	1.1	-0.0821	-1.11	1.449	0.0252	0.34	-0.5406	-0.4661	1917409	CBDivE_007557	Cc1ccc(OCC(=O)N/N=C\2/C(=O)Nc3ccc(cc23)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J18	compound treatment	1.199	0.0169	0.23	1.399	-0.0248	-0.34	-0.0783	-0.192	1275017	CBDivE_007558	O=C(Nc1ccccc1)c2sc(nc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J19	compound treatment	1.101	-0.0811	-1.09	1.463	0.0392	0.53	-0.3961	-0.3252	1917410	CBDivE_007559	Cc1ccc(OCC(=O)N/N=C/c2ccc(cc2)C(=O)O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	J20	compound treatment	1.309	0.127	1.71	1.419	-0.00482	-0.07	1.1638	0.6794	1584869	CBDivE_007560	COc1ccc(COCC(O)CN2CCOCC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K01	compound treatment	0.062	-1.12	-15.11	1.45	0.0262	0.36	-10.4328	-0.6902	1917411	CBDivE_007561	COc1cc(cc(/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4)c1O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K02	compound treatment	0.074	-1.11	-14.95	1.408	-0.0158	-0.22	-10.7233	-0.7172	1917412	CBDivE_007562	Oc1ccc(/C=N/c2ccc(cc2)c3ccccc3)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K03	compound treatment	0.365	-0.817	-11.02	1.459	0.0352	0.48	-7.4556	-0.6757	1917413	CBDivE_007563	CCN1C(=O)c2cccc3c(NC(=O)c4cccc(c4)[N+](=O)[O-])ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K04	compound treatment	0.044	-1.14	-15.35	1.402	-0.0218	-0.3	-11.0673	-0.7207	1917414	CBDivE_007564	C(=N/c1ccc(cc1)c2ccc(\N=C\c3ccc[nH]3)cc2)\c4ccc[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K05	compound treatment	1.518	0.336	4.53	1.47	0.0462	0.63	3.6493	0.7977	1443899	CBDivE_007565	CC1(C)CC(=O)C2=C(C1)c3c(NC2c4ccc(O)c(O)c4)ccc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K06	compound treatment	0.061	-1.12	-15.12	1.445	0.0212	0.29	-10.4905	-0.6935	1917415	CBDivE_007566	Cc1cccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K07	compound treatment	1.144	-0.0381	-0.51	1.422	-0.00182	-0.02	-0.3812	-0.7404	1917416	CBDivE_007567	Cc1ccc2nc(sc2c1)c3ccc(NC(=O)C4(CC5CC6C4)CC(C5)(C6)C(=O)Nc7ccc(cc7)c8nc9ccc(C)cc9s8)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K08	compound treatment	1.112	-0.0701	-0.95	1.428	0.00418	0.06	-0.6286	-0.6633	1670456	CBDivE_007568	Oc1ccc(cc1)c2nc3ccc4ccccc4c3c5CCCCc25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K09	compound treatment	1.48	0.298	4.02	1.454	0.0302	0.41	3.1326	0.7755	1917417	CBDivE_007569	Oc1ccccc1C(=O)CC(O)(c2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K10	compound treatment	0.053	-1.13	-15.23	1.453	0.0292	0.4	-10.4897	-0.6884	1303174	CBDivE_007570	O=C1c2ccccc2-c3nnc(cc13)c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K11	compound treatment	1.179	-0.00312	-0.04	1.417	-0.00682	-0.09	-0.0956	-0.9358	1917418	CBDivE_007571	O/N=C\1/CSCC1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K12	compound treatment	1.173	-0.00912	-0.12	1.394	-0.0298	-0.41	-0.3746	-0.8816	1066989	CBDivE_007572	Cc1ccc(cc1)S(=O)(=O)NNC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K13	compound treatment	1.55	0.368	4.96	1.458	0.0342	0.47	3.8389	0.7701	1917419	CBDivE_007573	CC(Cl)(CSSCC(C)(Cl)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K14	compound treatment	0.059	-1.12	-15.15	1.447	0.0232	0.32	-10.4903	-0.6922	1917420	CBDivE_007574	Clc1ccccc1C(=O)Oc2ccc(cc2)C3(CCCCC3)c4ccc(OC(=O)c5ccccc5Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K15	compound treatment	1.537	0.355	4.79	1.487	0.0632	0.86	3.9945	0.8212	1917421	CBDivE_007575	COc1ccc(cc1)N2C(=O)CC(NCCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K16	compound treatment	0.058	-1.12	-15.17	1.473	0.0492	0.67	-10.2492	-0.6752	1216444	CBDivE_007576	COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K17	compound treatment	1.193	0.0109	0.15	1.427	0.00318	0.04	0.1344	0.8784	1917422	CBDivE_007577	Oc1c(Br)cc(Br)cc1C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K18	compound treatment	1.208	0.0259	0.35	1.418	-0.00582	-0.08	0.1907	0.5327	1025798	CBDivE_007578	OC(=O)CSc1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K19	compound treatment	1.203	0.0209	0.28	1.508	0.0842	1.15	1.0109	0.8552	1616278	CBDivE_007579	COc1ccc(cc1)c2cc3C(=O)c4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	K20	compound treatment	1.143	-0.0391	-0.53	1.49	0.0662	0.9	0.2649	0.2534	1917423	CBDivE_007580	CC(Oc1ccc2ccccc2c1)C(=O)N/N=C/c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L01	compound treatment	0.051	-1.13	-15.26	1.42	-0.00382	-0.05	-10.827	-0.7095	1025832	CBDivE_007581	CN(C)S(=O)(=O)c1ccc(C)c(N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L02	compound treatment	0.064	-1.12	-15.08	1.391	-0.0328	-0.45	-10.9826	-0.7278	1917424	CBDivE_007582	Cc1ccc(OCC(=O)N/N=C/c2cc(I)c(O)c(I)c2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L03	compound treatment	1.136	-0.0461	-0.62	1.38	-0.0438	-0.6	-0.8625	-0.9998	1917425	CBDivE_007583	ClC1(CC2CC3C1)CC(C2)(C3)C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L04	compound treatment	1.123	-0.0591	-0.8	1.391	-0.0328	-0.45	-0.8805	-0.9627	1324359	CBDivE_007584	COC(=O)c1ccccc1NC(=O)c2c(Br)c(Br)c(Br)c(Br)c2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L05	compound treatment	1.112	-0.0701	-0.95	1.428	0.00418	0.06	-0.6286	-0.6633	1917426	CBDivE_007585	COc1ccc(cc1)[C@H]2CC(=C(C)C[C@@H]2C(=O)O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L06	compound treatment	1.176	-0.00612	-0.08	1.36	-0.0638	-0.87	-0.6738	-0.7707	1779410	CBDivE_007586	COc1ccccc1NC(=O)c2c(cnn2C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L07	compound treatment	1.151	-0.0311	-0.42	1.396	-0.0278	-0.38	-0.5651	-0.9987	1541773	CBDivE_007587	COc1ccc2nc(sc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L08	compound treatment	1.173	-0.00912	-0.12	1.409	-0.0148	-0.2	-0.2299	-0.9717	1321749	CBDivE_007588	O=C(CSCC(=O)c1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L09	compound treatment	1.119	-0.0631	-0.85	1.409	-0.0148	-0.2	-0.7451	-0.8513	1917427	CBDivE_007589	[O-][N+](=O)c1cccc(c1)c2nc3ccc(Cl)cn3[n+]2[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L10	compound treatment	1.191	0.00888	0.12	1.377	-0.0468	-0.64	-0.3668	-0.5646	1421410	CBDivE_007590	OCC(O)Cn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L11	compound treatment	1.152	-0.0301	-0.41	1.39	-0.0338	-0.46	-0.6135	-0.998	1917428	CBDivE_007591	CCCCOc1ccc(NC(=O)/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L12	compound treatment	1.175	-0.00712	-0.1	1.374	-0.0498	-0.68	-0.5483	-0.7992	1917429	CBDivE_007592	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L13	compound treatment	1.167	-0.0151	-0.2	1.397	-0.0268	-0.37	-0.4029	-0.962	1917430	CBDivE_007593	CN1CCN(CC(=O)N/N=C\c2c[nH]c3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L14	compound treatment	1.235	0.0529	0.71	1.384	-0.0398	-0.54	0.1204	0.1344	1917431	CBDivE_007594	OCCN(CCO)c1nc(O)ncc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L15	compound treatment	1.174	-0.00812	-0.11	1.361	-0.0628	-0.86	-0.6832	-0.7911	1917432	CBDivE_007595	CN(C)CC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L16	compound treatment	1.234	0.0519	0.7	1.377	-0.0468	-0.64	0.0434	0.0458	1917433	CBDivE_007596	CC1Nc2ccccc2-c3c(NC(=O)CN(C)C)c4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L17	compound treatment	1.155	-0.0271	-0.37	1.432	0.00818	0.11	-0.1799	-0.4702	1917434	CBDivE_007597	Cc1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L18	compound treatment	1.279	0.0969	1.31	1.404	-0.0198	-0.27	0.733	0.5492	1917435	CBDivE_007598	CN1CCN(CC1)C(=O)CCCN2C(=O)/C(=C\c3ccc(Cl)cc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L19	compound treatment	1.16	-0.0221	-0.3	1.45	0.0262	0.36	0.0414	0.089	1025244	CBDivE_007599	Oc1ccc2C(CC(=O)Oc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	L20	compound treatment	1.169	-0.0131	-0.18	1.436	0.0122	0.17	-0.0077	-0.0319	1054354	CBDivE_007600	Cc1cc(O)nc(n1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M01	compound treatment	0.074	-1.11	-14.95	1.364	-0.0598	-0.82	-11.1476	-0.7446	1917436	CBDivE_007601	Cc1ccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M02	compound treatment	0.049	-1.13	-15.29	1.392	-0.0318	-0.43	-11.1161	-0.7269	1917437	CBDivE_007602	OC(=O)/C=C\C(=O)Nc1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M03	compound treatment	0.343	-0.839	-11.32	1.403	-0.0208	-0.28	-8.2054	-0.7246	1917438	CBDivE_007603	C/C(=C\c1cc(C(=O)O)c(C)o1)/CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M04	compound treatment	1.207	0.0249	0.34	1.399	-0.0248	-0.34	-0.002	-0.0042	1917439	CBDivE_007604	Cc1cc(ccc1/N=C/c2ccc[nH]2)c3ccc(/N=C/c4ccc[nH]4)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M05	compound treatment	1.18	-0.00212	-0.03	1.395	-0.0288	-0.39	-0.2981	-0.7566	1917440	CBDivE_007605	COc1cc(cc(OC)c1OC)C(=O)N/N=C(\C)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M06	compound treatment	1.202	0.0199	0.27	1.429	0.00518	0.07	0.2396	0.8639	1125849	CBDivE_007606	Brc1ccc(cc1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M07	compound treatment	1.202	0.0199	0.27	1.428	0.00418	0.06	0.2299	0.8386	1428843	CBDivE_007607	OCCNC(=O)NCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M08	compound treatment	1.196	0.0139	0.19	1.386	-0.0378	-0.52	-0.2323	-0.4234	1917441	CBDivE_007608	[O-][N+](=O)c1cccc(c1)c2nc3ccc4ccccc4c3c5CCCc52
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M09	compound treatment	1.166	-0.0161	-0.22	1.464	0.0402	0.55	0.2336	0.3963	1917442	CBDivE_007609	Oc1cccc(/C=N/N=C/c2cccc(O)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M10	compound treatment	1.192	0.00988	0.13	1.444	0.0202	0.28	0.2888	0.9446	1917443	CBDivE_007610	CCOC(=O)C1=C(C)NC2=C(C1c3ccc(C)o3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M11	compound treatment	1.215	0.0329	0.44	1.42	-0.00382	-0.05	0.2768	0.6198	1305878	CBDivE_007611	Clc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M12	compound treatment	1.207	0.0249	0.34	1.415	-0.00882	-0.12	0.1523	0.4271	1917444	CBDivE_007612	Oc1c(cccc1[N+](=O)[O-])C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M13	compound treatment	1.175	-0.00712	-0.1	1.465	0.0412	0.56	0.3291	0.5777	1413402	CBDivE_007613	Brc1ccc(cc1)C(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M14	compound treatment	1.16	-0.0221	-0.3	1.411	-0.0128	-0.17	-0.3347	-0.9675	1917445	CBDivE_007614	Fc1ccccc1C(=O)Oc2ccc(cc2)C3(c4ccccc4-c5ccccc53)c6ccc(OC(=O)c7ccccc7F)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M15	compound treatment	1.177	-0.00512	-0.07	1.419	-0.00482	-0.07	-0.0953	-0.9997	1917446	CBDivE_007615	O=C(COC(=O)c1cccc(NC(=O)c2ccco2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M16	compound treatment	1.205	0.0229	0.31	1.42	-0.00382	-0.05	0.1814	0.5795	1067154	CBDivE_007616	Nc1nc(N)nc(n1)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M17	compound treatment	1.182	-1.22E-4	0.0	1.47	0.0462	0.63	0.4441	0.7053	1917447	CBDivE_007617	CC(CC(C)(C)N1CCCCC1)OC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M18	compound treatment	1.233	0.0509	0.69	1.432	0.00818	0.11	0.5642	0.8114	1917448	CBDivE_007618	CC1(CC(=O)O)C(CCC1=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M19	compound treatment	1.193	0.0109	0.15	1.52	0.0962	1.31	1.0312	0.7814	1917449	CBDivE_007619	Fc1ccc(cc1)C2N=NC(=CC2c3ccccc3)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	M20	compound treatment	1.284	0.102	1.37	1.449	0.0252	0.34	1.2146	0.8574	1096522	CBDivE_007620	CCC(N)Cc1cc(OC)c(C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N01	compound treatment	0.054	-1.13	-15.22	1.379	-0.0448	-0.61	-11.1937	-0.7349	1356732	CBDivE_007621	Nc1ccc(cc1)S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N02	compound treatment	0.071	-1.11	-14.99	1.386	-0.0378	-0.52	-10.964	-0.731	1917450	CBDivE_007622	Cc1ccc(OCC(=O)N/N=C/c2cc(I)ccc2O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N03	compound treatment	1.127	-0.0551	-0.74	1.371	-0.0528	-0.72	-1.0351	-0.9999	1416201	CBDivE_007623	Cc1ccc(NC(=O)Nc2ccc(C)c(N)c2)cc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N04	compound treatment	1.192	0.00988	0.13	1.301	-0.123	-1.67	-1.0901	-0.6488	1917451	CBDivE_007624	COC(=O)C1C(C)NC(=S)NC1c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N05	compound treatment	1.101	-0.0811	-1.09	1.376	-0.0478	-0.65	-1.235	-0.9694	1917452	CBDivE_007625	CC1=C(C)C[C@@H]([C@H](C1)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N06	compound treatment	1.123	-0.0591	-0.8	1.371	-0.0528	-0.72	-1.0733	-0.9987	1517342	CBDivE_007626	CC(=O)Nc1ccc(NC(=O)c2nn(C)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N07	compound treatment	1.16	-0.0221	-0.3	1.407	-0.0168	-0.23	-0.3732	-0.9916	1391373	CBDivE_007627	Cc1nc(nc2[nH]c(=O)n(c3ccccc3)c(=O)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N08	compound treatment	1.103	-0.0791	-1.07	1.334	-0.0898	-1.22	-1.6209	-0.9976	1316103	CBDivE_007628	CC1(C)CC(CCO1)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N09	compound treatment	1.101	-0.0811	-1.09	1.364	-0.0598	-0.82	-1.3507	-0.9895	1917453	CBDivE_007629	Cc1ccccc1N=Nc2ccc(NC(=O)c3ccnn3C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N10	compound treatment	1.111	-0.0711	-0.96	1.381	-0.0428	-0.58	-1.0914	-0.9716	1917454	CBDivE_007630	c1ccc(cc1)c2ccnc3nc4ccccc4n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N11	compound treatment	1.128	-0.0541	-0.73	1.372	-0.0518	-0.71	-1.016	-0.9999	1917455	CBDivE_007631	O/N=C(\Cc1ccccn1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N12	compound treatment	1.253	0.0709	0.96	1.362	-0.0618	-0.84	0.08	0.0628	1728771	CBDivE_007632	CC(C)OC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N13	compound treatment	1.115	-0.0671	-0.91	1.374	-0.0498	-0.68	-1.1207	-0.99	1917456	CBDivE_007633	COc1ccc(/C=N\NC(=O)CN2CCN(C)CC2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N14	compound treatment	1.068	-0.114	-1.54	1.378	-0.0458	-0.62	-1.5305	-0.9211	1917457	CBDivE_007634	Cc1cc(C)n2nc(CCCc3nc4nc(C)cc(C)n4n3)nc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N15	compound treatment	1.127	-0.0551	-0.74	1.376	-0.0478	-0.65	-0.9869	-0.9979	1917458	CBDivE_007635	Cc1cccc(OCC(=O)N/N=C/c2ccc(O)cc2)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N16	compound treatment	1.221	0.0389	0.52	1.421	-0.00282	-0.04	0.3437	0.6535	1917459	CBDivE_007636	O=C1NC(=S)NC(=O)C1=NNc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N17	compound treatment	1.165	-0.0171	-0.23	1.397	-0.0268	-0.37	-0.422	-0.9754	1917460	CBDivE_007637	Cc1ccc(OCC(=O)N/N=C/c2cc(I)cc(I)c2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N18	compound treatment	1.204	0.0219	0.3	1.362	-0.0618	-0.84	-0.3874	-0.4337	1917461	CBDivE_007638	Cc1c(NC(=O)CCN2C(=O)/C(=C\c3ccc(Cl)cc3)/SC2=S)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N19	compound treatment	1.185	0.00288	0.04	1.452	0.0282	0.38	0.2992	0.7746	1917462	CBDivE_007639	Nc1cc(N)nc(SCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	N20	compound treatment	1.059	-0.123	-1.66	1.369	-0.0548	-0.75	-1.7031	-0.935	1651459	CBDivE_007640	COc1ccc(c(OC)c1)c2cc(C(=O)O)c3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O01	compound treatment	0.085	-1.1	-14.8	1.513	0.0892	1.22	-9.6059	-0.6468	1917463	CBDivE_007641	COc1cc(Br)cc(/C=N/Nc2nc(nc(n2)N3CCOCC3)N4CCOCC4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O02	compound treatment	0.073	-1.11	-14.96	1.449	0.0252	0.34	-10.3375	-0.6907	1917464	CBDivE_007642	Cc1cccc(c1)C(=O)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O03	compound treatment	1.185	0.00288	0.04	1.494	0.0702	0.96	0.7041	0.7352	1520452	CBDivE_007643	COc1ccc(cc1)C(=O)Nc2cc3ccccc3cc2NC(=O)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O04	compound treatment	1.153	-0.0291	-0.39	1.407	-0.0168	-0.23	-0.44	-0.9672	1917465	CBDivE_007644	Oc1ccccc1C(=O)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O05	compound treatment	1.585	0.403	5.44	1.407	-0.0168	-0.23	3.681	0.6767	1917466	CBDivE_007645	Brc1cccc(/C=N/NC(=O)COc2ccc3ccccc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O06	compound treatment	0.111	-1.07	-14.45	1.419	-0.00482	-0.07	-10.2643	-0.7103	1583292	CBDivE_007646	O=C1CCCC2=C1C(Nc3ccc4ncccc4c23)c5cccnc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O07	compound treatment	1.28	0.0979	1.32	1.39	-0.0338	-0.46	0.6076	0.4344	1021274	CBDivE_007647	O=C(OCCCN1CCCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O08	compound treatment	0.051	-1.13	-15.26	1.449	0.0252	0.34	-10.5474	-0.691	1380597	CBDivE_007648	COc1ccc(cc1)c2nc3ccc4ccccc4c3c5CCCc52
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O09	compound treatment	1.196	0.0139	0.19	1.434	0.0102	0.14	0.2305	0.9891	1917467	CBDivE_007649	Oc1ccccc1C(=O)CC(O)(c2ccccc2)C(F)(F)C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O10	compound treatment	1.215	0.0329	0.44	1.4	-0.0238	-0.32	0.0839	0.1527	1063842	CBDivE_007650	CC(=O)NNS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O11	compound treatment	1.204	0.0219	0.3	1.49	0.0662	0.9	0.8468	0.8919	1917468	CBDivE_007651	O=C(N/N=C/c1c[nH]c2ccccc12)C3CC3C(=O)N/N=C/c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O12	compound treatment	1.19	0.00788	0.11	1.413	-0.0108	-0.15	-0.0292	-0.1605	1917469	CBDivE_007652	O=C1C2C(N3C4C(C(N3C2C(=O)N1Cc5ccccc5)c6ccccc6)C(=O)N(Cc7ccccc7)C4=O)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O13	compound treatment	1.141	-0.0411	-0.55	1.435	0.0112	0.15	-0.2845	-0.4945	1917470	CBDivE_007653	COc1ccccc1NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O14	compound treatment	1.184	0.00188	0.03	1.41	-0.0138	-0.19	-0.1154	-0.6066	1917471	CBDivE_007654	Cc1ccc(OC(=O)C(c2ccccc2)(c3ccccc3)c4ccccc4)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O15	compound treatment	1.295	0.113	1.52	1.443	0.0192	0.26	1.2617	0.8166	1917472	CBDivE_007655	Clc1cccc(c1)N2C(=O)C=C(N3CCN(CC3)S(=O)(=O)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O16	compound treatment	1.256	0.0739	1.0	1.475	0.0512	0.7	1.1982	0.9848	1481652	CBDivE_007656	COc1cc(OC)cc(c1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O17	compound treatment	1.162	-0.0201	-0.27	1.524	0.1	1.37	0.774	0.5557	1917473	CBDivE_007657	Cc1ccc(o1)c2cc3C(=O)c4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O18	compound treatment	1.258	0.0759	1.02	1.438	0.0142	0.19	0.8605	0.8261	1013983	CBDivE_007658	CC1=NN(C(=O)C1)c2cccc(c2)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O19	compound treatment	1.556	0.374	5.04	1.444	0.0202	0.28	3.7611	0.7446	1461620	CBDivE_007659	COc1cc(ccc1O)C2Nc3ccc4ccccc4c3C5=C2C(=O)CC(C)(C)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	O20	compound treatment	0.062	-1.12	-15.11	1.457	0.0332	0.45	-10.3653	-0.6856	1271924	CBDivE_007660	COc1ccccc1OCC(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P01	compound treatment	0.087	-1.1	-14.77	1.43	0.00618	0.08	-10.3871	-0.7031	1033078	CBDivE_007661	COc1cc(NC(=O)CC(=O)C)c(OC)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P02	compound treatment	0.078	-1.1	-14.9	1.39	-0.0338	-0.46	-10.8587	-0.7287	1130805	CBDivE_007662	O=C(N1C(C=Cc2ccccc12)c3cc4ccccc4[nH]3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P03	compound treatment	1.138	-0.0441	-0.6	1.315	-0.109	-1.48	-1.4702	-0.9195	1335580	CBDivE_007663	COc1ccc(cc1N)C(=O)Nc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P04	compound treatment	1.122	-0.0601	-0.81	1.362	-0.0618	-0.84	-1.1696	-0.9998	1917474	CBDivE_007664	Cn1ncc(/N=C/c2ccc(Cl)cc2)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P05	compound treatment	1.141	-0.0411	-0.55	1.375	-0.0488	-0.67	-0.863	-0.9959	1917475	CBDivE_007665	O=C1N(CCN2C(=O)C(=O)c3ccccc23)c4ccccc4C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P06	compound treatment	1.115	-0.0671	-0.91	1.343	-0.0808	-1.1	-1.4196	-0.9952	1917476	CBDivE_007666	Cc1ccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P07	compound treatment	1.709	0.527	7.11	1.384	-0.0398	-0.54	4.6421	0.6512	1917477	CBDivE_007667	CC(=O)N1[C@@H](CS[C@@H]1c2ccc(F)cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P08	compound treatment	1.245	0.0629	0.85	1.375	-0.0488	-0.67	0.1291	0.1197	1917478	CBDivE_007668	CCNCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OCC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P09	compound treatment	1.161	-0.0211	-0.28	1.287	-0.137	-1.87	-1.5208	-0.8058	1434725	CBDivE_007669	O=C1C2(Cc3ccccc3)CN4CN(C2)CC1(Cc5ccccc5)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P10	compound treatment	1.229	0.0469	0.63	0.823	-0.601	-8.19	-5.3462	-0.6506	1917479	CBDivE_007670	Cn1c(=O)n(C)c2nc([nH]c2c1=O)[n+]3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P11	compound treatment	1.076	-0.106	-1.43	1.363	-0.0608	-0.83	-1.5988	-0.9663	1917480	CBDivE_007671	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2ccc(O)c(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P12	compound treatment	0.805	-0.377	-5.09	1.292	-0.132	-1.8	-4.8686	-0.9023	1917481	CBDivE_007672	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P13	compound treatment	1.146	-0.0361	-0.49	1.397	-0.0268	-0.37	-0.6032	-0.99	1917482	CBDivE_007673	CN1CCN(CC(=O)N/N=C\c2cc(ccc2O)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P14	compound treatment	1.163	-0.0191	-0.26	1.403	-0.0208	-0.28	-0.3832	-0.9989	1720374	CBDivE_007674	COc1cccc(NC(=O)CCCC(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P15	compound treatment	1.145	-0.0371	-0.5	1.371	-0.0528	-0.72	-0.8634	-0.9842	1917483	CBDivE_007675	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C\2/C(=O)Nc3ccc(cc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P16	compound treatment	1.193	0.0109	0.15	1.385	-0.0388	-0.53	-0.2706	-0.4925	1917484	CBDivE_007676	COc1ccc(NC(=O)CSc2nc3sc4CCCCc4c3c(=O)n2CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P17	compound treatment	1.187	0.00488	0.07	1.36	-0.0638	-0.87	-0.5689	-0.6518	1917485	CBDivE_007677	COc1cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P18	compound treatment	1.1	-0.0821	-1.11	1.379	-0.0448	-0.61	-1.2156	-0.9607	1917486	CBDivE_007678	COC(=O)C(C1CS(=O)(=O)C=C1)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P19	compound treatment	1.075	-0.107	-1.45	1.366	-0.0578	-0.79	-1.5794	-0.9594	1146936	CBDivE_007679	Cc1cc2ncn(S(=O)n3cnc4cc(C)c(C)cc34)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.24	P20	compound treatment	1.151	-0.0311	-0.42	1.36	-0.0638	-0.87	-0.9123	-0.9441	1917487	CBDivE_007680	CC(/N=C/c1c(O)ccc2ccccc12)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A01	compound treatment	1.2	0.0225	0.3	1.447	0.0188	0.26	0.396	0.9964	1917488	CBDivE_007681	COC(=O)c1ccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A02	compound treatment	1.218	0.0405	0.55	1.446	0.0178	0.24	0.558	0.9332	1047189	CBDivE_007682	Clc1ccc(cc1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A03	compound treatment	1.218	0.0405	0.55	1.482	0.0538	0.73	0.9052	0.9895	1917489	CBDivE_007683	Fc1ccc(/C=C\2/SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A04	compound treatment	1.106	-0.0715	-0.96	1.418	-0.0102	-0.14	-0.7803	-0.8009	1917490	CBDivE_007684	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A05	compound treatment	1.247	0.0695	0.94	1.46	0.0318	0.43	0.9697	0.9385	1156246	CBDivE_007685	Brc1cc2OCOc2cc1C(N3CCOCC3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A06	compound treatment	1.172	-0.00548	-0.07	1.378	-0.0502	-0.68	-0.5364	-0.779	1917491	CBDivE_007686	CC(C)OC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNC(C)(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A07	compound treatment	1.207	0.0295	0.4	1.535	0.107	1.46	1.3113	0.8686	1104228	CBDivE_007687	COC(=O)C(Cc1ccccc1)NS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A08	compound treatment	1.246	0.0685	0.92	1.516	0.0878	1.2	1.5001	0.9918	1917492	CBDivE_007688	CCN(CC)CCn1c(NC(=O)c2ccc(Br)cc2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A09	compound treatment	1.189	0.0115	0.16	1.399	-0.0292	-0.4	-0.1718	-0.4018	1917493	CBDivE_007689	Oc1ccccc1C(=O)NNC(=O)CN2C(=O)S/C(=C\c3ccccc3)/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A10	compound treatment	1.252	0.0745	1.01	1.381	-0.0472	-0.64	0.2556	0.2141	1917494	CBDivE_007690	CCOC(=O)/C(=N\Nc1ccccc1Cl)/Sc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A11	compound treatment	1.226	0.0485	0.65	1.51	0.0818	1.12	1.2515	0.9677	1266680	CBDivE_007691	OC(=O)c1cc(c2c(O)c(F)c(F)c(F)c2F)n(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A12	compound treatment	1.191	0.0135	0.18	1.447	0.0188	0.26	0.3101	0.9861	1002707	CBDivE_007692	Oc1cc(cc2cc(NC(=O)Nc3ccc4c(O)cc(cc4c3)S(=O)(=O)O)ccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A13	compound treatment	1.255	0.0775	1.05	1.469	0.0408	0.56	1.1328	0.9563	1490981	CBDivE_007693	Clc1ccc(NC(=O)Nc2cc(Br)cc3cccnc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A14	compound treatment	1.18	0.00252	0.03	1.469	0.0408	0.56	0.4173	0.7489	1917495	CBDivE_007694	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/C3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A15	compound treatment	1.187	0.00952	0.13	1.465	0.0368	0.5	0.4455	0.8603	1917496	CBDivE_007695	OC1(NCCN=C1C(F)(F)C(F)(F)C(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A16	compound treatment	1.179	0.00152	0.02	1.439	0.0108	0.15	0.1185	0.7978	1650992	CBDivE_007696	CCOC1=CC2=C(CC(C)(C)CC2=O)OC1N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A17	compound treatment	1.254	0.0765	1.03	1.501	0.0728	0.99	1.4318	0.9998	1608089	CBDivE_007697	CC(C)(C)C(=O)Nc1sc2CCCCc2c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A18	compound treatment	1.206	0.0285	0.38	1.365	-0.0632	-0.86	-0.3375	-0.3575	1917497	CBDivE_007698	BrC(Br)(Br)C(NC1CCCCC1)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A19	compound treatment	1.193	0.0155	0.21	1.498	0.0698	0.95	0.821	0.8425	1917498	CBDivE_007699	OC(=O)/C=C/C(=O)Nc1cccc(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	A20	compound treatment	1.147	-0.0305	-0.41	1.427	-0.00121	-0.02	-0.3025	-0.7349	1917499	CBDivE_007700	C1C/C(=N\N=C/2\CCCc3ccccc3N2)/Nc4ccccc4C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B01	compound treatment	1.18	0.00252	0.03	1.374	-0.0542	-0.74	-0.4987	-0.6739	1568074	CBDivE_007701	Cc1ccc(C)c2c(N)c3CCCCCc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B02	compound treatment	1.2	0.0225	0.3	1.465	0.0368	0.5	0.5695	0.9711	1288193	CBDivE_007702	Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B03	compound treatment	1.184	0.00652	0.09	1.385	-0.0432	-0.59	-0.3545	-0.595	1917500	CBDivE_007703	Cc1ccccc1c2nc3sc4CCCCc4c3c(=O)n2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B04	compound treatment	1.201	0.0235	0.32	1.439	0.0108	0.15	0.3284	0.939	1917501	CBDivE_007704	Brc1ccc(OS(=O)(=O)CCSc2nc3sc4CCCCc4c3c(=O)n2CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B05	compound treatment	1.177	-4.83E-4	-0.01	1.424	-0.00421	-0.06	-0.0452	-0.7823	1917502	CBDivE_007705	FC(F)(F)c1cccc(NC(=O)CCCC(=O)Nc2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B06	compound treatment	1.124	-0.0535	-0.72	1.402	-0.0262	-0.36	-0.7629	-0.9475	1917503	CBDivE_007706	COc1ccccc1OP(=O)(O)Oc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B07	compound treatment	1.214	0.0365	0.49	1.462	0.0338	0.46	0.6742	0.9994	1917504	CBDivE_007707	OC(=O)c1ccc(cc1)n2nc(O)ccc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B08	compound treatment	1.251	0.0735	0.99	1.387	-0.0412	-0.56	0.3039	0.2666	1456714	CBDivE_007708	OC(=O)C1C(C2C=CC1C3CC32)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B09	compound treatment	1.167	-0.0105	-0.14	1.422	-0.00621	-0.08	-0.1599	-0.9699	1917505	CBDivE_007709	CCOC(=O)/C(=N/Nc1ccc(cc1)C(=O)C)/c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B10	compound treatment	1.242	0.0645	0.87	1.464	0.0358	0.49	0.9606	0.9626	1917506	CBDivE_007710	COc1ccc(O)c(/C=N/NC(=S)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B11	compound treatment	1.171	-0.00648	-0.09	1.374	-0.0542	-0.74	-0.5846	-0.7853	1333795	CBDivE_007711	O=C(Nc1ccccc1)C2CC=CCC2C(=O)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B12	compound treatment	1.159	-0.0185	-0.25	1.398	-0.0302	-0.41	-0.4676	-0.9711	1917507	CBDivE_007712	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4cccc(c4)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B13	compound treatment	1.186	0.00852	0.11	1.32	-0.108	-1.48	-0.9622	-0.6501	1184058	CBDivE_007713	Fc1ccc(cc1)C2Nc3ccc4ncccc4c3C5=C2C(=O)CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B14	compound treatment	1.147	-0.0305	-0.41	1.427	-0.00121	-0.02	-0.3025	-0.7349	1147290	CBDivE_007714	CCN1C2NC(=O)N(CC)C2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B15	compound treatment	1.176	-0.00148	-0.02	1.381	-0.0472	-0.64	-0.4694	-0.7287	1776030	CBDivE_007715	[O-][N+](=O)c1ccc(CSc2nc3ccccc3o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B16	compound treatment	1.124	-0.0535	-0.72	1.411	-0.0172	-0.23	-0.6761	-0.8911	1333776	CBDivE_007716	COc1cc(OC)cc(c1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nc(C)cc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B17	compound treatment	1.18	0.00252	0.03	1.419	-0.00921	-0.13	-0.0648	-0.498	1917508	CBDivE_007717	COC(=O)c1ccccc1NC(NC(=O)c2ccccc2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B18	compound treatment	1.134	-0.0435	-0.59	1.45	0.0218	0.3	-0.2047	-0.3113	1917509	CBDivE_007718	Clc1cccc(c1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B19	compound treatment	1.145	-0.0325	-0.44	1.358	-0.0702	-0.96	-0.9869	-0.9372	1917510	CBDivE_007719	BrC(Br)(Br)C(NC(=O)c1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	B20	compound treatment	1.119	-0.0585	-0.79	1.425	-0.00321	-0.04	-0.5888	-0.7452	1917511	CBDivE_007720	COc1nc(NC2(CC3CC4CC(C3)C2)C4)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C01	compound treatment	1.188	0.0105	0.14	1.429	7.9E-4	0.01	0.1079	0.7586	1917512	CBDivE_007721	[O-][N+](=O)c1ccc(cc1)c2nc(sc2C(=O)Nc3cccc(c3)C(F)(F)F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C02	compound treatment	1.166	-0.0115	-0.15	1.439	0.0108	0.15	-0.0055	-0.0257	1873850	CBDivE_007722	OC(=O)CCC(=O)Nc1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C03	compound treatment	1.31	0.133	1.79	1.466	0.0378	0.52	1.6285	0.8753	1378226	CBDivE_007723	COc1cc2nc(nc(N)c2cc1OC)N3CCNCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C04	compound treatment	1.186	0.00852	0.11	1.378	-0.0502	-0.68	-0.4029	-0.5803	1774494	CBDivE_007724	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C05	compound treatment	1.193	0.0155	0.21	1.52	0.0918	1.25	1.0331	0.8141	1917513	CBDivE_007725	Cc1c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)/SC2=S)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C06	compound treatment	1.192	0.0145	0.2	1.459	0.0308	0.42	0.4354	0.9397	1917514	CBDivE_007726	Cc1c(N2C(=O)c3ccc(cc3C2=O)C(=O)c4ccc5C(=O)N(C(=O)c5c4)c6c(C)n(C)n(c7ccccc7)c6=O)c(=O)n(c8ccccc8)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C07	compound treatment	1.231	0.0535	0.72	1.495	0.0668	0.91	1.1545	0.9934	1122622	CBDivE_007727	Cc1ccc(cc1)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C08	compound treatment	1.18	0.00252	0.03	1.432	0.00379	0.05	0.0606	0.9793	1917515	CBDivE_007728	CC/1=NNC(=O)\C1=N\Nc2ccc(cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C09	compound treatment	1.204	0.0265	0.36	1.458	0.0298	0.41	0.5402	0.998	1917516	CBDivE_007729	NS(=O)(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C10	compound treatment	1.207	0.0295	0.4	1.465	0.0368	0.5	0.6363	0.9935	1917517	CBDivE_007730	Oc1ccc(/C=N/CCCN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C11	compound treatment	1.234	0.0565	0.76	1.429	7.9E-4	0.01	0.5468	0.717	1735521	CBDivE_007731	CNCCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C12	compound treatment	1.19	0.0125	0.17	1.386	-0.0422	-0.58	-0.2876	-0.4795	1782369	CBDivE_007732	COC(=O)C1=C(C)NC(=C(C1c2ccc(cc2)[N+](=O)[O-])C(=O)OC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C13	compound treatment	1.183	0.00552	0.07	1.447	0.0188	0.26	0.2338	0.8763	1677040	CBDivE_007733	CCOC(=O)Nc1ccc2C=Cc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C14	compound treatment	1.234	0.0565	0.76	1.452	0.0238	0.32	0.7685	0.9275	1917518	CBDivE_007734	COc1ccc2[nH]cc(CCNC(=O)CCCl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C15	compound treatment	1.271	0.0935	1.26	1.479	0.0508	0.69	1.3818	0.9601	1917519	CBDivE_007735	Cc1nc(c(s1)C(=O)Nc2ccccc2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C16	compound treatment	1.169	-0.00848	-0.11	1.436	0.00779	0.11	-0.0058	-0.0372	1917520	CBDivE_007736	OS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C17	compound treatment	1.21	0.0325	0.44	1.464	0.0358	0.49	0.6553	0.9986	1917521	CBDivE_007737	Oc1c(F)c(F)c(F)c(F)c1C(=O)/C=C/2\Nc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C18	compound treatment	1.173	-0.00448	-0.06	1.463	0.0348	0.47	0.2927	0.612	1917522	CBDivE_007738	COc1ccc(C(=O)/C=C/c2cccc(c2)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C19	compound treatment	1.186	0.00852	0.11	1.498	0.0698	0.95	0.7542	0.7868	3106414	CBDivE_007739	OC(=O)C(O)(O)C(F)(F)F.C(CC1CCNCC1)CC2CCNCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	C20	compound treatment	1.166	-0.0115	-0.15	1.44	0.0118	0.16	0.0041	0.0186	1917524	CBDivE_007740	CN1CCN(CC(=O)N/N=C\c2ccccc2Cl)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D01	compound treatment	1.162	-0.0155	-0.21	1.388	-0.0402	-0.55	-0.5354	-0.9125	1430581	CBDivE_007741	C1CCC(CC1)c2ccc3n4CCNC5CCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D02	compound treatment	1.176	-0.00148	-0.02	1.377	-0.0512	-0.7	-0.5079	-0.7271	1917525	CBDivE_007742	Cn1c(=N/N=C/c2ccccc2F)sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D03	compound treatment	1.091	-0.0865	-1.17	1.427	-0.00121	-0.02	-0.8367	-0.717	1917526	CBDivE_007743	NS(=O)(=O)c1ccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D04	compound treatment	1.162	-0.0155	-0.21	1.367	-0.0612	-0.83	-0.7379	-0.8576	1917527	CBDivE_007744	C(CCSc1nc2ccccc2s1)CSc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D05	compound treatment	1.127	-0.0505	-0.68	1.4	-0.0282	-0.38	-0.7536	-0.9634	1917528	CBDivE_007745	COc1cc(/C=N/c2cccc(CO)c2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D06	compound treatment	1.204	0.0265	0.36	1.46	0.0318	0.43	0.5595	0.9954	1917529	CBDivE_007746	Cc1cc(C)cc(OS(=O)(=O)CCN2C(=O)NC3(CCCCC3)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D07	compound treatment	1.19	0.0125	0.17	1.441	0.0128	0.17	0.2427	0.9999	1917530	CBDivE_007747	CCOc1ccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D08	compound treatment	1.153	-0.0245	-0.33	1.372	-0.0562	-0.77	-0.7755	-0.9292	1917531	CBDivE_007748	Cc1ccc(cc1C)N(CC(O)C(O)C(O)CO)N=Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D09	compound treatment	1.163	-0.0145	-0.2	1.385	-0.0432	-0.59	-0.5548	-0.8937	1917532	CBDivE_007749	Brc1cccc(/C=N/NC(=O)CC(=O)N\N=C\c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D10	compound treatment	1.115	-0.0625	-0.84	1.439	0.0108	0.15	-0.492	-0.575	1917533	CBDivE_007750	CC(=O)c1c(C)n(c2cccc(Cl)c2)c3ccc(O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D11	compound treatment	1.148	-0.0295	-0.4	1.476	0.0478	0.65	0.1796	0.2352	1917534	CBDivE_007751	[O-][N+](=O)c1ccccc1NC(=O)C2CC=CCC2C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D12	compound treatment	1.197	0.0195	0.26	1.439	0.0108	0.15	0.2902	0.9622	1631712	CBDivE_007752	Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)c3c(C)cc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D13	compound treatment	1.231	0.0535	0.72	1.4	-0.0282	-0.38	0.2385	0.2915	1917535	CBDivE_007753	Cc1c(no[n+]1[O-])C(=O)NCn2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D14	compound treatment	1.164	-0.0135	-0.18	1.393	-0.0352	-0.48	-0.4681	-0.9117	1486568	CBDivE_007754	CCN1C2C(NC1=O)NC(=O)N2CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D15	compound treatment	1.131	-0.0465	-0.63	1.453	0.0248	0.34	-0.2044	-0.2869	1917536	CBDivE_007755	CCN(CC)CCOC(=O)C1=COCCO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D16	compound treatment	1.178	5.17E-4	0.01	1.326	-0.102	-1.39	-0.9806	-0.7036	1146483	CBDivE_007756	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D17	compound treatment	1.138	-0.0395	-0.53	1.404	-0.0242	-0.33	-0.6101	-0.9735	1917537	CBDivE_007757	COc1ccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D18	compound treatment	1.124	-0.0535	-0.72	1.413	-0.0152	-0.21	-0.6569	-0.8749	1917538	CBDivE_007758	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D19	compound treatment	1.193	0.0155	0.21	1.466	0.0378	0.52	0.5124	0.9212	1917539	CBDivE_007759	c1cc(sc1c2nc3ccccc3o2)c4nc5ccccc5o4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	D20	compound treatment	1.143	-0.0345	-0.47	1.469	0.0408	0.56	0.0644	0.0888	1917540	CBDivE_007760	CNS(=O)(=O)c1cc(O)c2c(cc(cc2c1)S(=O)(=O)NC)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E01	compound treatment	1.248	0.0705	0.95	1.424	-0.00421	-0.06	0.6321	0.6632	1917541	CBDivE_007761	Nc1nc(c(s1)C(=O)Nc2ccccc2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E02	compound treatment	1.196	0.0185	0.25	1.403	-0.0252	-0.34	-0.0664	-0.1564	1917542	CBDivE_007762	CCN(CC)CCn1c(NC(=O)C2(CC3CC4CC(C3)C2)C4)nc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E03	compound treatment	1.198	0.0205	0.28	1.457	0.0288	0.39	0.4733	0.9854	1917543	CBDivE_007763	CCN(CC)CCCSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E04	compound treatment	1.193	0.0155	0.21	1.458	0.0298	0.41	0.4353	0.9525	1002876	CBDivE_007764	CC(C)(c1ccc(O)c(c1)[N+](=O)[O-])c2ccc(O)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E05	compound treatment	1.238	0.0605	0.82	1.443	0.0148	0.2	0.7199	0.8561	1433413	CBDivE_007765	COc1cccc2c(=O)c3n(C)ncc3[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E06	compound treatment	1.167	-0.0105	-0.14	1.439	0.0108	0.15	0.004	0.0198	1917544	CBDivE_007766	FC(F)(c1cc(n[nH]1)c2ccccc2)C(F)(F)c3cc(n[nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E07	compound treatment	1.22	0.0425	0.57	1.533	0.105	1.43	1.416	0.9196	1025093	CBDivE_007767	OC(=O)CC1Sc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E08	compound treatment	1.2	0.0225	0.3	1.455	0.0268	0.37	0.4731	0.9958	1917545	CBDivE_007768	CC/1=NNC(=O)\C1=N/Nc2ccc(NC(=O)c3ccc(N\N=C/4\C(=NNC4=O)C)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E09	compound treatment	1.316	0.139	1.87	1.467	0.0388	0.53	1.6954	0.873	1917546	CBDivE_007769	Clc1ccc(/C=C/2\SC(=O)N(CC(=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E10	compound treatment	1.202	0.0245	0.33	1.451	0.0228	0.31	0.4536	0.9995	1917547	CBDivE_007770	[O-][N+](=O)c1ccc(/C=N/CCCN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E11	compound treatment	1.249	0.0715	0.96	1.483	0.0548	0.75	1.2105	0.992	1917548	CBDivE_007771	CN(C)CC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E12	compound treatment	1.161	-0.0165	-0.22	1.427	-0.00121	-0.02	-0.1689	-0.7575	1731315	CBDivE_007772	CC1=C(C(NC(=O)N1)c2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E13	compound treatment	1.21	0.0325	0.44	1.469	0.0408	0.56	0.7035	0.9931	1500137	CBDivE_007773	Cc1cn2C3OC(CC(=O)Oc4ccccc4)C(O)C3Oc2nc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E14	compound treatment	1.143	-0.0345	-0.47	1.437	0.00879	0.12	-0.2442	-0.5083	1917549	CBDivE_007774	Cc1nn(c(C)c1Sc2ccccc2)S(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E15	compound treatment	1.267	0.0895	1.21	1.412	-0.0162	-0.22	0.6976	0.5682	1632922	CBDivE_007775	C1CCc2c(C1)sc3ncnc(Oc4cccc5cccnc45)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E16	compound treatment	1.17	-0.00748	-0.1	1.404	-0.0242	-0.33	-0.3048	-0.883	1917550	CBDivE_007776	Clc1ccc(SCCS(=O)(=O)Oc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E17	compound treatment	1.24	0.0625	0.84	1.46	0.0318	0.43	0.9029	0.9521	1561983	CBDivE_007777	CCOC(=O)c1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E18	compound treatment	1.182	0.00452	0.06	1.451	0.0228	0.31	0.2628	0.83	1428750	CBDivE_007778	OC(CNc1ccc(I)cc1)Cn2c3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E19	compound treatment	1.239	0.0615	0.83	1.522	0.0938	1.28	1.4912	0.9781	1917551	CBDivE_007779	O/C(=C\C(=O)c1ccccc1)/C(F)(F)\C(=C\C(=O)c2ccccc2)\O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	E20	compound treatment	1.241	0.0635	0.86	1.455	0.0268	0.37	0.8642	0.9278	1917552	CBDivE_007780	OS(=O)(=O)c1ccc(cc1)N2N=C(CC2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F01	compound treatment	1.138	-0.0395	-0.53	1.352	-0.0762	-1.04	-1.1115	-0.9518	3013962	CBDivE_007781	Nc1c2CCCc2nc3ccccc13.OC(=O)c1ccccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F02	compound treatment	1.144	-0.0335	-0.45	1.364	-0.0642	-0.88	-0.9385	-0.9526	1917553	CBDivE_007782	C(C1=NCCN1)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F03	compound treatment	1.138	-0.0395	-0.53	1.396	-0.0322	-0.44	-0.6872	-0.9954	1917554	CBDivE_007783	BrC(Br)(Br)C(NC(=O)c1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F04	compound treatment	1.158	-0.0195	-0.26	1.382	-0.0462	-0.63	-0.6314	-0.9248	1917555	CBDivE_007784	CCc1cc(C(=O)COc2ccccc2)c(O)c(CN3CCCC3C(=O)O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F05	compound treatment	1.205	0.0275	0.37	1.423	-0.00521	-0.07	0.2123	0.5616	1917556	CBDivE_007785	Oc1ccc2ccccc2c1/C=N/c3ccc(\N=C\c4c(O)ccc5ccccc45)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F06	compound treatment	1.144	-0.0335	-0.45	1.389	-0.0392	-0.53	-0.6975	-0.9965	1371234	CBDivE_007786	CCN(CC)CC(O)Cn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F07	compound treatment	1.204	0.0265	0.36	1.351	-0.0772	-1.05	-0.4915	-0.442	1552456	CBDivE_007787	OC(=O)c1cccc(c1)n2nc(O)ccc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F08	compound treatment	1.196	0.0185	0.25	1.458	0.0298	0.41	0.4639	0.9727	1599387	CBDivE_007788	Brc1ccc2oc(=O)c(cc2c1)c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F09	compound treatment	1.112	-0.0655	-0.88	1.43	0.00179	0.02	-0.6074	-0.6873	1917557	CBDivE_007789	Brc1ccccc1/C=N/NC(=O)CC(=O)N\N=C\c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F10	compound treatment	1.168	-0.00948	-0.13	1.415	-0.0132	-0.18	-0.2178	-0.9859	1917558	CBDivE_007790	COc1ccc(CCN2C(=O)C3C(C4C=CC3C5CC54)C2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F11	compound treatment	1.123	-0.0545	-0.74	1.486	0.0578	0.79	0.0375	0.0348	1422056	CBDivE_007791	COc1ccc(cc1)C(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F12	compound treatment	1.08	-0.0975	-1.32	1.356	-0.0722	-0.98	-1.6262	-0.9898	1376697	CBDivE_007792	OC(COc1ccc2ccccc2c1)CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F13	compound treatment	1.167	-0.0105	-0.14	1.45	0.0218	0.3	0.1101	0.3346	1917559	CBDivE_007793	O=c1c2C(Cc3ccccc3-c2[nH]c(=S)n1Cc4ccccc4)C5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F14	compound treatment	1.146	-0.0315	-0.42	1.429	7.9E-4	0.01	-0.2927	-0.689	1917560	CBDivE_007794	O=C(CSc1nnc[nH]1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F15	compound treatment	1.174	-0.00348	-0.05	1.462	0.0338	0.46	0.2926	0.6317	1417294	CBDivE_007795	CC1=C(C(NC(=O)N1)c2cc3OCOc3cc2Br)C(=O)OC4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F16	compound treatment	1.159	-0.0185	-0.25	1.42	-0.00821	-0.11	-0.2555	-0.9347	1917561	CBDivE_007796	COc1cc(NS(=O)(=O)c2ccc(/N=C/c3c(O)ccc4ccccc34)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F17	compound treatment	1.129	-0.0485	-0.65	1.463	0.0348	0.47	-0.127	-0.1572	1917562	CBDivE_007797	BrC(Br)(Br)C(NC(=O)c1ccccc1)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F18	compound treatment	1.157	-0.0205	-0.28	1.449	0.0208	0.28	0.0051	0.0128	1917563	CBDivE_007798	Brc1cccc(c1)N2C(=O)CC(N3CCN(CC3)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F19	compound treatment	1.131	-0.0465	-0.63	1.451	0.0228	0.31	-0.2237	-0.3196	1917564	CBDivE_007799	CN(C)c1ccc(cc1)C2NC(=S)NC(=C2C(=O)OCc3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	F20	compound treatment	1.139	-0.0385	-0.52	1.383	-0.0452	-0.62	-0.803	-0.9963	1917565	CBDivE_007800	Nc1c(O)cc(c2cc(ccc12)S(=O)(=O)N)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G01	compound treatment	1.179	0.00152	0.02	1.434	0.00579	0.08	0.0703	0.8619	1917566	CBDivE_007801	CCOC(=O)c1ccc(NC(=O)CN2C(=O)S/C(=C/c3ccc(Cl)cc3)/C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G02	compound treatment	1.139	-0.0385	-0.52	1.448	0.0198	0.27	-0.1763	-0.3013	1917567	CBDivE_007802	CC/1=NNC(=O)\C1=N/Nc2cc(ccc2Cl)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G03	compound treatment	1.19	0.0125	0.17	1.466	0.0378	0.52	0.4838	0.8921	1591395	CBDivE_007803	Cc1nc(NCc2ccco2)c3c4CCCCc4sc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G04	compound treatment	1.213	0.0355	0.48	1.44	0.0118	0.16	0.4525	0.8953	1917568	CBDivE_007804	C=CCSc1nc2-c3ccccc3CC(C4CCCCC4)c2c(=O)n1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G05	compound treatment	1.243	0.0655	0.88	1.482	0.0538	0.73	1.1437	0.9957	1779117	CBDivE_007805	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G06	compound treatment	1.178	5.17E-4	0.01	1.418	-0.0102	-0.14	-0.0935	-0.6708	1917569	CBDivE_007806	COc1ccc(/C=N/NC(=O)COc2ccc(C)cc2C)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G07	compound treatment	1.219	0.0415	0.56	1.462	0.0338	0.46	0.7219	0.9953	1917570	CBDivE_007807	Cc1ccc(NC(=O)CC2Sc3ccccc3NC2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G08	compound treatment	1.181	0.00352	0.05	1.441	0.0128	0.17	0.1569	0.8679	1347308	CBDivE_007808	O=C(NCc1ccccc1)c2ccccc2C(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G09	compound treatment	1.214	0.0365	0.49	1.503	0.0748	1.02	1.0695	0.9443	1917571	CBDivE_007809	Brc1ccc(/C=C/2\SC(=O)N(CC(=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G10	compound treatment	1.185	0.00752	0.1	1.494	0.0658	0.9	0.7061	0.7821	1917572	CBDivE_007810	CCOc1ccc2[nH]c(SCc3c(F)c(F)c(F)c(F)c3F)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G11	compound treatment	1.219	0.0415	0.56	1.53	0.102	1.39	1.3775	0.9203	1427283	CBDivE_007811	Cc1cccc(NC(=O)CCCC(=O)O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G12	compound treatment	1.115	-0.0625	-0.84	1.439	0.0108	0.15	-0.492	-0.575	1779362	CBDivE_007812	COc1cc(C2N(Cc3ccccc3)CCN2Cc4ccccc4)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G13	compound treatment	1.238	0.0605	0.82	1.405	-0.0232	-0.32	0.3535	0.4037	1917573	CBDivE_007813	Cc1c(NC(=O)CN2C(=O)S/C(=C/c3ccc(Cl)cc3)/C2=O)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G14	compound treatment	1.168	-0.00948	-0.13	1.458	0.0298	0.41	0.1968	0.4621	1469657	CBDivE_007814	Cc1nn(c(C)c1Sc2ccccc2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G15	compound treatment	1.217	0.0395	0.53	1.541	0.113	1.54	1.4645	0.8997	1688430	CBDivE_007815	CC(C)(C)C(=O)Nc1cccc(c1)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G16	compound treatment	1.168	-0.00948	-0.13	1.471	0.0428	0.58	0.3221	0.5393	1917574	CBDivE_007816	OCC(O)C(O)C(O)C(O)/C=N\NC(=O)c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G17	compound treatment	1.222	0.0445	0.6	1.482	0.0538	0.73	0.9433	0.9951	1917575	CBDivE_007817	OC(=O)/C=N/n1nnnc1Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G18	compound treatment	1.192	0.0145	0.2	1.409	-0.0192	-0.26	-0.0467	-0.1429	1775900	CBDivE_007818	[O-][N+](=O)c1ccc(CSc2nc3ccccc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G19	compound treatment	1.237	0.0595	0.8	1.464	0.0358	0.49	0.9129	0.9715	1917576	CBDivE_007819	Cc1ccccc1NC(=O)c2cc(SCCS(=O)(=O)c3ccc(Cl)cc3)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	G20	compound treatment	1.169	-0.00848	-0.11	1.421	-0.00721	-0.1	-0.1504	-0.9971	1917577	CBDivE_007820	CC1=NN(C(=O)C1)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H01	compound treatment	1.142	-0.0355	-0.48	1.276	-0.152	-2.08	-1.8062	-0.8479	1696115	CBDivE_007821	CN1CCc2c1nc3ccccc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H02	compound treatment	1.152	-0.0255	-0.34	1.432	0.00379	0.05	-0.2065	-0.5941	1917578	CBDivE_007822	O/C(=C\C(=O)c1ccccc1)/C(F)(F)C(F)(F)C(F)(F)C(F)(F)c2cc(n[nH]2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H03	compound treatment	1.202	0.0245	0.33	1.365	-0.0632	-0.86	-0.3756	-0.4068	1917579	CBDivE_007823	CC(C)(C)NC(NC(=O)c1ccccc1)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H04	compound treatment	1.189	0.0115	0.16	1.402	-0.0262	-0.36	-0.1429	-0.3666	1917580	CBDivE_007824	CN(C)CCCN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H05	compound treatment	1.125	-0.0525	-0.71	1.388	-0.0402	-0.55	-0.8884	-0.992	1917581	CBDivE_007825	OC(=O)CCCCCNC(=O)c1cccc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H06	compound treatment	1.168	-0.00948	-0.13	1.376	-0.0522	-0.71	-0.5939	-0.821	1337165	CBDivE_007826	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H07	compound treatment	1.146	-0.0315	-0.42	1.392	-0.0362	-0.49	-0.6495	-0.9972	1917582	CBDivE_007827	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H08	compound treatment	1.163	-0.0145	-0.2	1.397	-0.0312	-0.43	-0.4391	-0.9376	1917583	CBDivE_007828	OS(=O)(=O)c1ccc2C(=O)c3ccccc3-c4n[nH]c1c42
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H09	compound treatment	1.156	-0.0215	-0.29	1.382	-0.0462	-0.63	-0.6505	-0.9379	1917584	CBDivE_007829	Cc1ccc(cc1)S(=O)(=O)c2cc(C)cc(c2C)S(=O)(=O)Nc3cccc(c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H10	compound treatment	1.184	0.00652	0.09	1.486	0.0578	0.79	0.6194	0.7812	1244471	CBDivE_007830	CCN(CC)CC(O)COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H11	compound treatment	1.258	0.0805	1.09	1.385	-0.0432	-0.59	0.3514	0.2844	1917585	CBDivE_007831	CCOC(=O)/C(=N/Nc1cc2OCCOc2cc1[N+](=O)[O-])/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H12	compound treatment	1.16	-0.0175	-0.24	1.417	-0.0112	-0.15	-0.2749	-0.978	1139804	CBDivE_007832	CC(C)(C)NCC(O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H13	compound treatment	1.247	0.0695	0.94	1.493	0.0648	0.88	1.2879	0.9996	1917586	CBDivE_007833	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H14	compound treatment	1.172	-0.00548	-0.07	1.412	-0.0162	-0.22	-0.2086	-0.8949	1917587	CBDivE_007834	CC(C)NCC(O)COCc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H15	compound treatment	1.15	-0.0275	-0.37	1.416	-0.0122	-0.17	-0.3799	-0.9347	1917588	CBDivE_007835	CCOc1ccccc1C2NC(=S)NC(=C2C(=O)OCc3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H16	compound treatment	1.098	-0.0795	-1.07	1.467	0.0388	0.53	-0.3842	-0.3213	1917589	CBDivE_007836	CCN(CC)C(=O)c1ccc(o1)C(O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H17	compound treatment	1.145	-0.0325	-0.44	1.425	-0.00321	-0.04	-0.3408	-0.7739	1917590	CBDivE_007837	Brc1cccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H18	compound treatment	1.172	-0.00548	-0.07	1.361	-0.0672	-0.92	-0.7004	-0.7617	1917591	CBDivE_007838	Brc1cccc(c1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H19	compound treatment	1.145	-0.0325	-0.44	1.454	0.0258	0.35	-0.0612	-0.1089	1917592	CBDivE_007839	CC1=C(C(NC(=O)N1)c2ccccc2)C(=O)OCC(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	H20	compound treatment	1.143	-0.0345	-0.47	1.409	-0.0192	-0.26	-0.5142	-0.9631	1917593	CBDivE_007840	CC(=O)NNC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I01	compound treatment	1.156	-0.0215	-0.29	1.438	0.00979	0.13	-0.1105	-0.3464	1917594	CBDivE_007841	CCOc1ccc(/C=N/c2cnn(C)c2C(=O)N)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I02	compound treatment	1.14	-0.0375	-0.51	1.428	-2.1E-4	0.0	-0.3596	-0.7111	1917595	CBDivE_007842	CC/1=NNC(=O)\C1=N\Nc2cccc(c2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I03	compound treatment	1.254	0.0765	1.03	1.502	0.0738	1.01	1.4414	0.9999	1123155	CBDivE_007843	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I04	compound treatment	1.152	-0.0255	-0.34	1.412	-0.0162	-0.22	-0.3994	-0.9772	1658120	CBDivE_007844	O=C(NCC(c1ccccc1)c2ccccc2)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I05	compound treatment	1.204	0.0265	0.36	1.456	0.0278	0.38	0.5209	0.9996	1917596	CBDivE_007845	[O-][n+]1c(nc2ccc(Br)cn12)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I06	compound treatment	1.164	-0.0135	-0.18	1.429	7.9E-4	0.01	-0.121	-0.6641	1450578	CBDivE_007846	C1CN(CCO1)C(N2CCOCC2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I07	compound treatment	1.222	0.0445	0.6	1.501	0.0728	0.99	1.1265	0.971	1917597	CBDivE_007847	CC(=O)NCCC(CN1CCOCC1)([N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I08	compound treatment	1.179	0.00152	0.02	1.522	0.0938	1.28	0.9188	0.7183	1424135	CBDivE_007848	CC(C)c1ccc(C)cc1OCC(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I09	compound treatment	1.202	0.0245	0.33	1.515	0.0868	1.18	1.0707	0.8713	1917598	CBDivE_007849	COc1ccc(/C=C\2/SC(=S)N(CCC(=O)Nc3ccc(cc3)S(=O)(=O)N)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I10	compound treatment	1.168	-0.00948	-0.13	1.458	0.0298	0.41	0.1968	0.4621	1917599	CBDivE_007850	CCOC(=O)/C(=N/Nc1ccccc1)/c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I11	compound treatment	1.241	0.0635	0.86	1.461	0.0328	0.45	0.9221	0.954	1726755	CBDivE_007851	Cc1cc(C)c(NC(=O)CCCC(=O)O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I12	compound treatment	1.158	-0.0195	-0.26	1.451	0.0228	0.31	0.0339	0.0833	1164169	CBDivE_007852	Cc1ccsc1C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I13	compound treatment	1.236	0.0585	0.79	1.444	0.0158	0.22	0.7105	0.8683	1917600	CBDivE_007853	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)C(C)N(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I14	compound treatment	1.203	0.0255	0.34	1.462	0.0338	0.46	0.5692	0.9897	1917601	CBDivE_007854	Cc1nn(c(C)c1Sc2ccc(cc2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I15	compound treatment	1.23	0.0525	0.71	1.466	0.0378	0.52	0.8654	0.9878	1917602	CBDivE_007855	COC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I16	compound treatment	1.173	-0.00448	-0.06	1.423	-0.00521	-0.07	-0.093	-0.9968	1917603	CBDivE_007856	CCOC(=O)/C(=N\Nc1ccccc1Cl)/Sc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I17	compound treatment	1.271	0.0935	1.26	1.471	0.0428	0.58	1.3047	0.9386	1917604	CBDivE_007857	FC(F)C(F)(F)c1cc([nH]n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I18	compound treatment	1.17	-0.00748	-0.1	1.453	0.0248	0.34	0.1677	0.4752	1054186	CBDivE_007858	O=S(=O)(Cc1nc2ccccc2[nH]1)Cc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I19	compound treatment	1.241	0.0635	0.86	1.455	0.0268	0.37	0.8642	0.9278	1917605	CBDivE_007859	Clc1ccc(cc1)S(=O)(=O)CCSc2ccc(Cl)c(c2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	I20	compound treatment	1.179	0.00152	0.02	1.419	-0.00921	-0.13	-0.0743	-0.5842	1917606	CBDivE_007860	Cc1cc(C)c(NC(=O)CN2CCN(CC2)c3ccccn3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J01	compound treatment	1.141	-0.0365	-0.49	1.363	-0.0652	-0.89	-0.9768	-0.9611	1917607	CBDivE_007861	[O-][N+](=O)c1cccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J02	compound treatment	1.164	-0.0135	-0.18	1.433	0.00479	0.07	-0.0824	-0.4265	1917608	CBDivE_007862	COc1cc(/C=C/C(=O)c2ccc(cc2)c3ccccc3)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J03	compound treatment	1.114	-0.0635	-0.86	1.37	-0.0582	-0.79	-1.1669	-0.9993	1917609	CBDivE_007863	BrC(Br)(Br)C(NC(=O)c1ccccc1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J04	compound treatment	1.159	-0.0185	-0.25	1.431	0.00279	0.04	-0.1494	-0.5924	1917610	CBDivE_007864	COc1ccc(C(=O)/C=C/c2ccc(F)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J05	compound treatment	1.151	-0.0265	-0.36	1.417	-0.0112	-0.15	-0.3607	-0.9283	1917611	CBDivE_007865	OC(=O)CCCCCNC(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J06	compound treatment	1.157	-0.0205	-0.28	1.359	-0.0692	-0.94	-0.8627	-0.8773	1917612	CBDivE_007866	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J07	compound treatment	1.174	-0.00348	-0.05	1.382	-0.0462	-0.63	-0.4788	-0.7577	1917613	CBDivE_007867	OS(=O)(=O)c1cccc2c(NC(=O)c3ccccc3)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J08	compound treatment	1.196	0.0185	0.25	1.419	-0.00921	-0.13	0.0878	0.3141	1917614	CBDivE_007868	NS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J09	compound treatment	1.147	-0.0305	-0.41	1.404	-0.0242	-0.33	-0.5242	-0.9941	1917615	CBDivE_007869	CC(=O)/C=C(\O)/C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1cc(C)n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J10	compound treatment	1.167	-0.0105	-0.14	1.435	0.00679	0.09	-0.0345	-0.2043	1305565	CBDivE_007870	OC(COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)CN5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J11	compound treatment	1.173	-0.00448	-0.06	1.404	-0.0242	-0.33	-0.2762	-0.8229	1917616	CBDivE_007871	CCOC(=O)c1sc(nc1c2ccc(cc2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J12	compound treatment	1.149	-0.0285	-0.38	1.42	-0.00821	-0.11	-0.3509	-0.8767	1537846	CBDivE_007872	CC(C)(C)NCC(O)COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J13	compound treatment	1.209	0.0315	0.43	1.449	0.0208	0.28	0.5011	0.9806	1221128	CBDivE_007873	OC(=O)CCn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J14	compound treatment	1.144	-0.0335	-0.45	1.356	-0.0722	-0.98	-1.0157	-0.9375	1917617	CBDivE_007874	CC(CC(=O)c1ccc(Br)cc1)CC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J15	compound treatment	1.138	-0.0395	-0.53	1.437	0.00879	0.12	-0.2919	-0.5346	1708125	CBDivE_007875	CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c3cccc(I)c3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J16	compound treatment	1.09	-0.0875	-1.18	1.433	0.00479	0.07	-0.7883	-0.667	1917618	CBDivE_007876	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J17	compound treatment	1.137	-0.0405	-0.55	1.427	-0.00121	-0.02	-0.3978	-0.7281	1917619	CBDivE_007877	COC(=O)c1ccc(NC(=S)NC(/N=C(\OC)/c2ccc(C)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J18	compound treatment	1.085	-0.0925	-1.25	1.399	-0.0292	-0.4	-1.1639	-0.8887	1316234	CBDivE_007878	CN(C)c1ccc(cc1)C2C=C(Nc3ncnn23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J19	compound treatment	1.138	-0.0395	-0.53	1.478	0.0498	0.68	0.1035	0.1199	1917620	CBDivE_007879	CCCCCOC(=O)C1=C(C)NC2=C(C1c3cccc(I)c3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	J20	compound treatment	1.169	-0.00848	-0.11	1.444	0.0158	0.22	0.0713	0.2925	1917621	CBDivE_007880	CCCCOC(=O)C1=C(C)NC2=C(C1c3ccc(Cl)c(Cl)c3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K01	compound treatment	1.219	0.0415	0.56	1.448	0.0198	0.27	0.5869	0.9439	1917622	CBDivE_007881	Oc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K02	compound treatment	1.176	-0.00148	-0.02	1.423	-0.00521	-0.07	-0.0644	-0.8723	1917623	CBDivE_007882	CCN(CC)CCn1c(NC(=O)C(F)(F)F)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K03	compound treatment	1.184	0.00652	0.09	1.444	0.0158	0.22	0.2144	0.9219	1917624	CBDivE_007883	Cc1cc[n+](cc1)c2nc3n(C)c(=O)n(C)c(=O)c3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K04	compound treatment	1.161	-0.0165	-0.22	1.429	7.9E-4	0.01	-0.1496	-0.6721	1917625	CBDivE_007884	COc1ccc(/C=C/C(=O)c2ccc(cc2)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K05	compound treatment	1.257	0.0795	1.07	1.436	0.00779	0.11	0.8337	0.7733	1338838	CBDivE_007885	NNC(=O)c1ccc(OCc2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K06	compound treatment	1.181	0.00352	0.05	1.423	-0.00521	-0.07	-0.0167	-0.1953	1917626	CBDivE_007886	Cc1ccc(OCC(=O)N/N=C/c2cn(C)c3ccccc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K07	compound treatment	1.169	-0.00848	-0.11	1.511	0.0828	1.13	0.7174	0.6322	1917627	CBDivE_007887	OC(=O)CCCNS(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K08	compound treatment	1.163	-0.0145	-0.2	1.471	0.0428	0.58	0.2744	0.446	1398654	CBDivE_007888	c1ccc2oc(nc2c1)c3ccc(c4nc5ccccc5o4)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K09	compound treatment	1.191	0.0135	0.18	1.45	0.0218	0.3	0.3391	0.9725	1917628	CBDivE_007889	CCOC(=O)c1ccc(NC(=O)CN2C(=O)S/C(=C/c3ccccc3)/C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K10	compound treatment	1.187	0.00952	0.13	1.472	0.0438	0.6	0.513	0.8399	1245201	CBDivE_007890	COc1ccc(cc1)C2C3CCc4ccc(OC)cc4C3=NN2C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K11	compound treatment	1.223	0.0455	0.61	1.444	0.0158	0.22	0.5865	0.9013	1133388	CBDivE_007891	COc1ccccc1NC(=O)CCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K12	compound treatment	1.168	-0.00948	-0.13	1.415	-0.0132	-0.18	-0.2178	-0.9859	1917629	CBDivE_007892	CCN(CC)c1ccc(/C=N/NC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K13	compound treatment	1.19	0.0125	0.17	1.531	0.103	1.4	1.1105	0.7866	1917630	CBDivE_007893	OC1(OCCN=C1C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K14	compound treatment	1.142	-0.0355	-0.48	1.44	0.0118	0.16	-0.2248	-0.4452	1917631	CBDivE_007894	[O-][N+](=O)c1ccccc1S(=O)(=O)NCC(F)(F)C(F)(F)C(F)(F)C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K15	compound treatment	1.232	0.0545	0.74	1.483	0.0548	0.75	1.0484	1.0	1557395	CBDivE_007895	COC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K16	compound treatment	1.191	0.0135	0.18	1.479	0.0508	0.69	0.6187	0.8638	1917632	CBDivE_007896	Cc1ccc(cc1)C(=O)NC(Oc2ccc3ccccc3c2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K17	compound treatment	1.251	0.0735	0.99	1.436	0.00779	0.11	0.7764	0.7784	1917633	CBDivE_007897	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)COc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K18	compound treatment	1.178	5.17E-4	0.01	1.37	-0.0582	-0.79	-0.5564	-0.7009	1917634	CBDivE_007898	C(SCc1nc2ccccc2s1)SCc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K19	compound treatment	1.232	0.0545	0.74	1.508	0.0798	1.09	1.2894	0.9818	1213562	CBDivE_007899	Cc1ccc(cc1)S(=O)(=O)CCSc2cccc(c2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	K20	compound treatment	1.196	0.0185	0.25	1.495	0.0668	0.91	0.8207	0.869	1530525	CBDivE_007900	COc1cccc2cc(c3nc4cc5ccccc5cc4[nH]3)c(=O)oc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L01	compound treatment	1.162	-0.0155	-0.21	1.379	-0.0492	-0.67	-0.6222	-0.8853	1529189	CBDivE_007901	Clc1ccc(Nc2ncnc3sc4CCCCc4c23)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L02	compound treatment	1.126	-0.0515	-0.69	1.351	-0.0772	-1.05	-1.2356	-0.9796	1917635	CBDivE_007902	COc1ccc(CCN/C(=C/2\C(=O)OC(C2=O)c3ccccc3)/C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L03	compound treatment	1.193	0.0155	0.21	1.391	-0.0372	-0.51	-0.2108	-0.384	1622140	CBDivE_007903	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L04	compound treatment	1.14	-0.0375	-0.51	1.397	-0.0312	-0.43	-0.6585	-0.9963	1917636	CBDivE_007904	C(CSc1nc2ccccc2s1)CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L05	compound treatment	1.094	-0.0835	-1.13	1.427	-0.00121	-0.02	-0.808	-0.7174	1917637	CBDivE_007905	CC(OC(=O)C1CC=CCC1C(=O)Nc2ccc(cc2)C(=O)C)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L06	compound treatment	1.17	-0.00748	-0.1	1.36	-0.0682	-0.93	-0.7291	-0.7793	1495340	CBDivE_007906	Cc1cccc(NC(=O)C2CC2(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L07	compound treatment	1.139	-0.0385	-0.52	1.389	-0.0392	-0.53	-0.7452	-0.9999	1734426	CBDivE_007907	CC(C)c1ccc(C)cc1OCC(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L08	compound treatment	1.134	-0.0435	-0.59	1.419	-0.00921	-0.13	-0.5036	-0.8395	1917638	CBDivE_007908	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3ccc(OC)cc23)C1c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L09	compound treatment	1.171	-0.00648	-0.09	1.409	-0.0192	-0.26	-0.2471	-0.8946	1917639	CBDivE_007909	O/C(=C/C(=O)c1ccccc1)/C(F)(F)C(F)(F)c2cc(n[nH]2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L10	compound treatment	1.151	-0.0265	-0.36	1.358	-0.0702	-0.96	-0.9296	-0.9097	1917640	CBDivE_007910	CCOC(=O)CSc1nnc(Nc2ccc(Cl)cc2)n1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L11	compound treatment	1.143	-0.0345	-0.47	1.414	-0.0142	-0.19	-0.466	-0.9246	1917641	CBDivE_007911	C(CSc1nc2ccccc2s1)CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L12	compound treatment	1.161	-0.0165	-0.22	1.385	-0.0432	-0.59	-0.5739	-0.9112	1917642	CBDivE_007912	Brc1cccc(c1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L13	compound treatment	1.2	0.0225	0.3	1.415	-0.0132	-0.18	0.0874	0.2475	1917643	CBDivE_007913	Cc1n[nH]c(Nc2ccc(Cl)cc2Cl)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L14	compound treatment	1.161	-0.0165	-0.22	1.399	-0.0292	-0.4	-0.4389	-0.9621	1180560	CBDivE_007914	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L15	compound treatment	1.18	0.00252	0.03	1.347	-0.0812	-1.11	-0.759	-0.6851	1917644	CBDivE_007915	CC1=C(C(=O)OCc2ccccc2)C3(O)C(=O)c4ccccc4C3(O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L16	compound treatment	1.142	-0.0355	-0.48	1.383	-0.0452	-0.62	-0.7744	-0.9922	1917645	CBDivE_007916	Brc1cccc(c1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L17	compound treatment	1.181	0.00352	0.05	1.449	0.0208	0.28	0.234	0.8141	1917646	CBDivE_007917	[O-][N+](=O)c1cccc(NC(=O)C(C(=O)Nc2cccc(c2)[N+](=O)[O-])C3(CC4CC5CC(C4)C3)C5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L18	compound treatment	1.143	-0.0345	-0.47	1.386	-0.0422	-0.58	-0.7359	-0.9944	1917647	CBDivE_007918	CCCC(/C(=N\O)/c1ccccc1)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L19	compound treatment	1.156	-0.0215	-0.29	1.449	0.0208	0.28	-0.0045	-0.011	1917648	CBDivE_007919	N(/N=C/c1ccccc1)c2ncnc3n(ncc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	L20	compound treatment	1.114	-0.0635	-0.86	1.418	-0.0102	-0.14	-0.704	-0.8114	1917649	CBDivE_007920	O=C1C(C(=O)c2cccc3cccc1c23)c4ccc5ccccc5n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M01	compound treatment	1.205	0.0275	0.37	1.417	-0.0112	-0.15	0.1544	0.3846	1446579	CBDivE_007921	COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2CN4CCN(C)CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M02	compound treatment	1.144	-0.0335	-0.45	1.423	-0.00521	-0.07	-0.3696	-0.8084	1917650	CBDivE_007922	CC/1=NNC(=O)\C1=N\Nc2ccc(Cc3ccc(N/N=C\4/C(=NNC4=O)C)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M03	compound treatment	1.242	0.0645	0.87	1.463	0.0348	0.47	0.9509	0.9593	1917651	CBDivE_007923	Cn1c(=O)n(C)c2nc([nH]c2c1=O)[n+]3ccc(cc3)C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M04	compound treatment	1.136	-0.0415	-0.56	1.432	0.00379	0.05	-0.3592	-0.6391	1361834	CBDivE_007924	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M05	compound treatment	1.312	0.135	1.81	1.385	-0.0432	-0.59	0.8666	0.4542	1053980	CBDivE_007925	Cc1ccc(cc1)S(=O)(=O)NCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M06	compound treatment	1.148	-0.0295	-0.4	1.432	0.00379	0.05	-0.2447	-0.6101	1917652	CBDivE_007926	Cc1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M07	compound treatment	1.259	0.0815	1.1	1.457	0.0288	0.39	1.0552	0.9037	1917653	CBDivE_007927	CCOC(=O)c1sc(N)nc1c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M08	compound treatment	1.181	0.00352	0.05	1.379	-0.0492	-0.67	-0.441	-0.6555	1393623	CBDivE_007928	COc1ccc(cc1)C2NC(=S)NC3=C2CCc4ccc(OC)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M09	compound treatment	1.204	0.0265	0.36	1.481	0.0528	0.72	0.762	0.9479	1917654	CBDivE_007929	ClCC(=O)Nc1ccc2CCc3ccccc3N(C(=O)c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M10	compound treatment	1.186	0.00852	0.11	1.454	0.0258	0.35	0.3299	0.8917	1589869	CBDivE_007930	O=C(CCN(Cc1ccccc1)Cc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M11	compound treatment	1.255	0.0775	1.05	1.458	0.0298	0.41	1.0267	0.9152	1456617	CBDivE_007931	OC(=O)CCCC(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M12	compound treatment	1.166	-0.0115	-0.15	1.4	-0.0282	-0.38	-0.3816	-0.9201	1511470	CBDivE_007932	OC(=O)CCCC(=O)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M13	compound treatment	1.179	0.00152	0.02	1.496	0.0678	0.92	0.6681	0.7226	1917655	CBDivE_007933	OC1(OCCN=C1C(F)(F)C(F)(F)C(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M14	compound treatment	1.193	0.0155	0.21	1.427	-0.00121	-0.02	0.1364	0.6494	1917656	CBDivE_007934	C/C(=N/Nc1ccccc1)/Cc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M15	compound treatment	1.229	0.0515	0.7	1.427	-0.00121	-0.02	0.4798	0.6901	1917657	CBDivE_007935	CCOC(=O)/C(=N\Nc1ccc(SC(F)(F)F)cc1)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M16	compound treatment	1.165	-0.0125	-0.17	1.431	0.00279	0.04	-0.0922	-0.5339	1917658	CBDivE_007936	Cc1ccc(cc1)C(=O)NC(Oc2cccc(c2)[N+](=O)[O-])C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M17	compound treatment	1.246	0.0685	0.92	1.467	0.0388	0.53	1.0276	0.9649	1917659	CBDivE_007937	C=Cc1ccccc1CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M18	compound treatment	1.175	-0.00248	-0.03	1.459	0.0308	0.42	0.2732	0.6486	1917660	CBDivE_007938	Clc1cc(/N=C/c2cccc3ccccc23)ccc1/N=C/c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M19	compound treatment	1.231	0.0535	0.72	1.532	0.104	1.42	1.5113	0.9512	1917661	CBDivE_007939	Brc1ccc(NC(=O)CCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	M20	compound treatment	1.221	0.0435	0.59	1.435	0.00679	0.09	0.4806	0.8086	1917662	CBDivE_007940	Brc1ccc2oc(=O)c(cc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N01	compound treatment	1.139	-0.0385	-0.52	1.392	-0.0362	-0.49	-0.7163	-0.9997	1917663	CBDivE_007941	O=CNNc1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N02	compound treatment	1.135	-0.0425	-0.57	1.39	-0.0382	-0.52	-0.7737	-0.9989	1917664	CBDivE_007942	CC(=O)N1C(=O)/C(=N/NC(=O)Nc2ccccc2)/c3cc(C)c(Br)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N03	compound treatment	1.186	0.00852	0.11	1.318	-0.11	-1.5	-0.9814	-0.6511	1917665	CBDivE_007943	Brc1ccc(cc1)N(Cc2ccc(I)cc2)C(=O)COc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N04	compound treatment	1.134	-0.0435	-0.59	1.345	-0.0832	-1.13	-1.2171	-0.9529	1375164	CBDivE_007944	CC(C)C1CC(CCO1)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N05	compound treatment	1.191	0.0135	0.18	1.39	-0.0382	-0.52	-0.2395	-0.4338	1369355	CBDivE_007945	Cc1cc(=O)oc2cc(OC(=O)COc3ccc4c(=O)c(c(C)oc4c3)c5ccc6OCCOc6c5)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N06	compound treatment	1.166	-0.0115	-0.15	1.352	-0.0762	-1.04	-0.8444	-0.8036	1917666	CBDivE_007946	CC(NCc1c(O)ccc(C(=O)COc2ccccc2)c1O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N07	compound treatment	1.102	-0.0755	-1.02	1.424	-0.00421	-0.06	-0.7606	-0.7458	1659770	CBDivE_007947	CC(C)c1ccc(C)cc1OCC(=O)Nc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N08	compound treatment	1.092	-0.0855	-1.15	1.38	-0.0482	-0.66	-1.2803	-0.9645	1215529	CBDivE_007948	Clc1nc(NCC=C)nc(n1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N09	compound treatment	1.1	-0.0775	-1.05	1.422	-0.00621	-0.08	-0.799	-0.7619	1917667	CBDivE_007949	Cc1csc(=N)n1c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N10	compound treatment	1.15	-0.0275	-0.37	1.413	-0.0152	-0.21	-0.4088	-0.9623	1917668	CBDivE_007950	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N11	compound treatment	1.131	-0.0465	-0.63	1.392	-0.0362	-0.49	-0.7926	-0.993	1917669	CBDivE_007951	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N12	compound treatment	1.138	-0.0395	-0.53	1.359	-0.0692	-0.94	-1.044	-0.9633	1917670	CBDivE_007952	Brc1ccc(/C=N/Nc2nc(cs2)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N13	compound treatment	1.159	-0.0185	-0.25	1.39	-0.0382	-0.52	-0.5447	-0.9431	1917671	CBDivE_007953	OC(Cn1ccnc1Cl)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N14	compound treatment	1.133	-0.0445	-0.6	1.384	-0.0442	-0.6	-0.8506	-1.0	1021487	CBDivE_007954	C1CN(CCN1c2ccccn2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N15	compound treatment	1.126	-0.0515	-0.69	1.387	-0.0412	-0.56	-0.8885	-0.9945	1917672	CBDivE_007955	CC1=C(C(NC(=O)N1)c2cccc(I)c2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N16	compound treatment	1.18	0.00252	0.03	1.401	-0.0272	-0.37	-0.2384	-0.6397	1917673	CBDivE_007956	Clc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4cccc(Cl)c4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N17	compound treatment	1.103	-0.0745	-1.0	1.395	-0.0332	-0.45	-1.0307	-0.9352	1917674	CBDivE_007957	CCCCOC(=O)CCNc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N18	compound treatment	1.181	0.00352	0.05	1.374	-0.0542	-0.74	-0.4892	-0.6604	1917675	CBDivE_007958	NS(=O)(=O)c1cc(O)c2c(cccc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N19	compound treatment	1.137	-0.0405	-0.55	1.45	0.0218	0.3	-0.1761	-0.2832	1917676	CBDivE_007959	O=C1N(CN2CCC=CC2)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	N20	compound treatment	1.126	-0.0515	-0.69	1.388	-0.0402	-0.55	-0.8788	-0.9932	1917677	CBDivE_007960	COC(=S)N/C(=N/CS(=O)(=O)c1ccc(C)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O01	compound treatment	1.216	0.0385	0.52	1.45	0.0218	0.3	0.5775	0.9648	1203621	CBDivE_007961	O=C(CS(=O)CC(=O)c1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O02	compound treatment	1.139	-0.0385	-0.52	1.438	0.00979	0.13	-0.2727	-0.5087	1775238	CBDivE_007962	CC(=O)Nc1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O03	compound treatment	1.185	0.00752	0.1	1.516	0.0878	1.2	0.9182	0.7643	1917678	CBDivE_007963	CCOC(=O)c1sc(N/N=C/2\C(=O)C=Cc3ccccc23)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O04	compound treatment	1.213	0.0355	0.48	1.421	-0.00721	-0.1	0.2693	0.5505	1541871	CBDivE_007964	NC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O05	compound treatment	1.221	0.0435	0.59	1.437	0.00879	0.12	0.4999	0.8343	1917679	CBDivE_007965	Brc1ccc(OS(=O)(=O)CCN2C(=O)NC3(CCCCC3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O06	compound treatment	1.153	-0.0245	-0.33	1.413	-0.0152	-0.21	-0.3802	-0.9749	1917680	CBDivE_007966	Oc1c(/C=N/c2ccc3-c4ccc(\N=C\c5cccc([N+](=O)[O-])c5O)cc4S(=O)(=O)c3c2)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O07	compound treatment	1.211	0.0335	0.45	1.559	0.131	1.78	1.5809	0.8592	1261455	CBDivE_007967	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O08	compound treatment	1.217	0.0395	0.53	1.472	0.0438	0.6	0.7992	0.9984	1917681	CBDivE_007968	CCOC(=O)c1c(NC(=O)c2cccc(c2)[N+](=O)[O-])sc(Br)c1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O09	compound treatment	1.248	0.0705	0.95	1.431	0.00279	0.04	0.6996	0.7348	1917682	CBDivE_007969	O=C(CCN1CCOCC1)Nc2ccc3CCc4ccccc4N(C(=O)CN5CCOCC5)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O10	compound treatment	1.145	-0.0325	-0.44	1.382	-0.0462	-0.63	-0.7554	-0.9842	1917683	CBDivE_007970	Nc1ccc(/C=C/c2ccc(N)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O11	compound treatment	1.269	0.0915	1.23	1.423	-0.00521	-0.07	0.8228	0.6653	1362316	CBDivE_007971	CN(C)CCC(=O)N1c2ccccc2Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O12	compound treatment	1.203	0.0255	0.34	1.444	0.0158	0.22	0.3957	0.9745	1011990	CBDivE_007972	OC(=O)c1ccccc1N=Nc2c(O)c(cc3cc(ccc23)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O13	compound treatment	1.171	-0.00648	-0.09	1.48	0.0518	0.71	0.4375	0.6148	1917684	CBDivE_007973	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN4CCN(C)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O14	compound treatment	1.136	-0.0415	-0.56	1.424	-0.00421	-0.06	-0.4363	-0.7756	1917685	CBDivE_007974	Cc1cc(=O)oc2cc(OCC(=O)Oc3ccc4c(=O)c(Oc5ccccc5)c(C)oc4c3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O15	compound treatment	1.169	-0.00848	-0.11	1.435	0.00679	0.09	-0.0154	-0.1049	1917686	CBDivE_007975	CC1(C)CC(=NNc2c(Cl)cc(Cl)cc2Cl)CC(C)(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O16	compound treatment	1.192	0.0145	0.2	1.459	0.0308	0.42	0.4354	0.9397	1917687	CBDivE_007976	BrC(Br)(Br)C(NC(=O)c1ccccc1)Oc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O17	compound treatment	1.239	0.0615	0.83	1.551	0.123	1.67	1.7708	0.9476	1917688	CBDivE_007977	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)COc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O18	compound treatment	1.152	-0.0255	-0.34	1.45	0.0218	0.3	-0.033	-0.0726	1917689	CBDivE_007978	Oc1cccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O19	compound treatment	1.247	0.0695	0.94	1.498	0.0698	0.95	1.3361	1.0	1917690	CBDivE_007979	Cc1nnc(NC(=O)c2ccc(NC(=O)C(F)(F)F)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	O20	compound treatment	1.127	-0.0505	-0.68	1.441	0.0128	0.17	-0.3582	-0.5096	1917691	CBDivE_007980	Cc1cc(NC(=O)CN2CCCCCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P01	compound treatment	1.187	0.00952	0.13	1.405	-0.0232	-0.32	-0.133	-0.3894	1917692	CBDivE_007981	Cc1sc2ncn3cnnc3c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P02	compound treatment	1.153	-0.0245	-0.33	1.393	-0.0352	-0.48	-0.5731	-0.9833	1917693	CBDivE_007982	CC(=O)N1C(=O)/C(=N/c2ccc(C)cc2O)/c3cc(C)c(Br)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P03	compound treatment	1.212	0.0345	0.47	1.342	-0.0862	-1.18	-0.502	-0.397	1917694	CBDivE_007983	C(=N/c1cccc2ccccc12)\c3ccc[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P04	compound treatment	1.111	-0.0665	-0.9	1.381	-0.0472	-0.64	-1.0894	-0.9868	1236632	CBDivE_007984	CCOC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P05	compound treatment	1.151	-0.0265	-0.36	1.357	-0.0712	-0.97	-0.9393	-0.9078	1380097	CBDivE_007985	NS(=O)(=O)c1ccc2ccc(O)cc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P06	compound treatment	1.12	-0.0575	-0.78	1.36	-0.0682	-0.93	-1.2061	-0.9959	1917695	CBDivE_007986	O=C(NN1C(=O)C2C(C3C=CC2C4CC43)C1=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P07	compound treatment	1.131	-0.0465	-0.63	1.39	-0.0382	-0.52	-0.8119	-0.9958	1917696	CBDivE_007987	CCOC(=O)/C(=N\Nc1cccc(c1)C(F)(F)F)/c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P08	compound treatment	1.133	-0.0445	-0.6	1.35	-0.0782	-1.07	-1.1785	-0.963	1917697	CBDivE_007988	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(Cc3ccc(NC(=O)c4cccc(c4)[N+](=O)[O-])cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P09	compound treatment	1.085	-0.0925	-1.25	1.304	-0.124	-1.69	-2.0799	-0.9887	1917698	CBDivE_007989	COc1ccc(cc1)c2csc(=Nc3cccc(Br)c3)n2c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P10	compound treatment	0.68	-0.497	-6.71	0.875	-0.553	-7.54	-10.0799	-0.9983	1917699	CBDivE_007990	CC(C)(C)c1cc(Br)cc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P11	compound treatment	1.145	-0.0325	-0.44	1.353	-0.0752	-1.03	-1.0351	-0.9281	1401898	CBDivE_007991	CN(C)CC(O)Cn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P12	compound treatment	1.121	-0.0565	-0.76	1.323	-0.105	-1.43	-1.5533	-0.9562	1478246	CBDivE_007992	CN1C2C3N(CN(CN3C(=O)N2C)C(C)(C)C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P13	compound treatment	1.134	-0.0435	-0.59	1.405	-0.0232	-0.32	-0.6386	-0.9581	1917700	CBDivE_007993	Cn1c(=O)n(C)c2ncc(Cl)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P14	compound treatment	1.14	-0.0375	-0.51	1.406	-0.0222	-0.3	-0.5717	-0.97	1917701	CBDivE_007994	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P15	compound treatment	1.193	0.0155	0.21	1.399	-0.0292	-0.4	-0.1336	-0.297	1917702	CBDivE_007995	Cc1ccc(NC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P16	compound treatment	1.14	-0.0375	-0.51	1.38	-0.0482	-0.66	-0.8224	-0.9916	1917703	CBDivE_007996	Clc1cccc(c1)N2CCN(CC2)C3CC(=O)N(C3=O)c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P17	compound treatment	1.138	-0.0395	-0.53	1.344	-0.0842	-1.15	-1.1886	-0.939	1917704	CBDivE_007997	CC(C)c1ccc(C)cc1OCC(=O)Nc2cc(ccc2C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P18	compound treatment	1.06	-0.117	-1.58	1.434	0.00579	0.08	-1.0649	-0.671	1917705	CBDivE_007998	CNS(=O)(=O)c1cc(O)c2c(cccc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P19	compound treatment	1.183	0.00552	0.07	1.428	-2.1E-4	0.0	0.0506	0.6794	1507428	CBDivE_007999	Cc1cc(C)c(c(C)c1)S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.25	P20	compound treatment	1.132	-0.0455	-0.61	1.39	-0.0382	-0.52	-0.8023	-0.9967	1074133	CBDivE_008000	CC(C)(C)c1ccc2oc(nc2c1)c3ccc(s3)c4nc5cc(ccc5o4)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A01	compound treatment	1.184	0.0038	0.05	1.44	0.0121	0.17	0.153	0.885	1122158	CBDivE_008001	CC(N)C1CCCCNC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A02	compound treatment	1.23	0.0498	0.67	1.433	0.00511	0.07	0.5244	0.7763	1917706	CBDivE_008002	O=C(N/N=C/c1c[nH]c2ccccc12)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A03	compound treatment	1.221	0.0408	0.55	1.463	0.0351	0.48	0.7278	0.9976	1044846	CBDivE_008003	CCOC(=O)c1c(C)[nH]c(c1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A04	compound treatment	1.233	0.0528	0.71	1.412	-0.0159	-0.22	0.3505	0.4707	1917707	CBDivE_008004	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2cc(N=Nc3ccccc3)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A05	compound treatment	1.284	0.104	1.4	1.479	0.0511	0.7	1.483	0.9481	1269039	CBDivE_008005	OP1(=O)COc2ccccc2OC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A06	compound treatment	1.19	0.0098	0.13	1.397	-0.0309	-0.42	-0.2043	-0.4628	1917708	CBDivE_008006	Sc1nc2ccccc2n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A07	compound treatment	1.275	0.0948	1.28	1.522	0.0941	1.28	1.8118	1.0	1334319	CBDivE_008007	CC(C)(C)N=c1scc(c2ccccc2)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A08	compound treatment	1.263	0.0828	1.12	1.515	0.0871	1.19	1.6298	0.9995	1917709	CBDivE_008008	[O-][N+](=O)c1ccc(/C=C/2\S\C(=N\N=C\3/C(=O)Nc4ccc(Br)cc34)\NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A09	compound treatment	1.244	0.0638	0.86	1.387	-0.0409	-0.56	0.2144	0.209	1450171	CBDivE_008009	OC(=O)c1cccc(c1)n2cnnn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A10	compound treatment	1.249	0.0688	0.93	1.405	-0.0229	-0.31	0.4356	0.4448	1611380	CBDivE_008010	OC(=O)c1ccccc1C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A11	compound treatment	1.238	0.0578	0.78	1.509	0.0811	1.11	1.3335	0.9854	1917710	CBDivE_008011	NS(=O)(=O)c1ccc(C/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A12	compound treatment	1.202	0.0218	0.29	1.469	0.0411	0.56	0.6044	0.9547	1917711	CBDivE_008012	COC(=O)C(O)(c1ccc(O)cc1O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A13	compound treatment	1.185	0.0048	0.06	1.487	0.0591	0.81	0.6158	0.7615	1917712	CBDivE_008013	CC(=O)C/C(=N/NC(=O)c1ccc(cc1)c2ccccc2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A14	compound treatment	1.183	0.0028	0.04	1.459	0.0311	0.42	0.3267	0.7671	1917713	CBDivE_008014	Clc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A15	compound treatment	1.196	0.0158	0.21	1.475	0.0471	0.64	0.605	0.8938	1917714	CBDivE_008015	COc1ccc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A16	compound treatment	1.183	0.0028	0.04	1.47	0.0421	0.57	0.4328	0.752	1917715	CBDivE_008016	Clc1ccc(cc1)C(=O)Oc2c(Br)cc(Br)cc2CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A17	compound treatment	1.309	0.129	1.74	1.523	0.0951	1.3	2.1458	0.9896	1917716	CBDivE_008017	COc1ccccc1OC(NC(=O)c2ccc(C)cc2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A18	compound treatment	1.216	0.0358	0.48	1.401	-0.0269	-0.37	0.0822	0.1356	1917717	CBDivE_008018	OC(=O)C1(c2ccccc2C3c4ccccc41)c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A19	compound treatment	1.171	-0.0092	-0.12	1.493	0.0651	0.89	0.5401	0.6024	1112164	CBDivE_008019	[O-][N+](=O)c1ccc(cc1)C(=O)NN=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	A20	compound treatment	1.146	-0.0342	-0.46	1.439	0.0111	0.15	-0.2191	-0.4512	1917718	CBDivE_008020	Oc1ccc(/C=N\NC(=O)c2ccn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B01	compound treatment	1.196	0.0158	0.21	1.359	-0.0689	-0.94	-0.5135	-0.5331	1917719	CBDivE_008021	CN1/C(=C\C=N\NC(=O)c2ccccc2C)/C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B02	compound treatment	1.203	0.0228	0.31	1.453	0.0251	0.34	0.4596	0.9986	1917720	CBDivE_008022	C/C(=N\NC(=O)c1ccccc1)/c2ccc(NS(=O)(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B03	compound treatment	1.204	0.0238	0.32	1.398	-0.0299	-0.41	-0.0612	-0.1179	1380009	CBDivE_008023	OC(=O)c1nccnc1C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B04	compound treatment	1.204	0.0238	0.32	1.451	0.0231	0.32	0.4499	1.0	1917721	CBDivE_008024	CN(C)CCCNS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B05	compound treatment	1.19	0.0098	0.13	1.454	0.0261	0.36	0.3453	0.9091	1917722	CBDivE_008025	C/C(=N/NC(=O)c1ccc(O)cc1)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B06	compound treatment	1.14	-0.0402	-0.54	1.387	-0.0409	-0.56	-0.7777	-0.9999	1917723	CBDivE_008026	COc1cc(/C=N/c2ccc(cc2)N3CCOCC3)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B07	compound treatment	1.222	0.0418	0.56	1.439	0.0111	0.15	0.5059	0.8663	1696691	CBDivE_008027	Nc1ccc(C(=O)Nc2cccc(c2)C(=O)O)c(c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B08	compound treatment	1.255	0.0748	1.01	1.393	-0.0349	-0.48	0.3771	0.338	1917724	CBDivE_008028	Oc1cc(/C=N/c2ccc(cc2)N3CCOCC3)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B09	compound treatment	1.164	-0.0162	-0.22	1.438	0.0101	0.14	-0.057	-0.2207	1917725	CBDivE_008029	N(/N=C/c1ccc2ccccc2c1)c3nnn[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B10	compound treatment	1.252	0.0718	0.97	1.454	0.0261	0.36	0.9367	0.9076	1296974	CBDivE_008030	CCN(CC)S(=O)(=O)c1ccc(cc1)c2csc(Nc3ccc(Br)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B11	compound treatment	1.166	-0.0142	-0.19	1.371	-0.0569	-0.78	-0.684	-0.856	1112685	CBDivE_008031	CCC(C)NC(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B12	compound treatment	1.163	-0.0172	-0.23	1.41	-0.0179	-0.24	-0.3366	-0.9997	1917726	CBDivE_008032	c1csc(c1)c2nnc(o2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B13	compound treatment	1.199	0.0188	0.25	1.342	-0.0859	-1.17	-0.6488	-0.5414	1388273	CBDivE_008033	O=C(N1CCN(CC1)C(=O)c2cccs2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B14	compound treatment	1.152	-0.0282	-0.38	1.458	0.0301	0.41	0.0213	0.0381	1917727	CBDivE_008034	Clc1ccc(Nc2nc(cs2)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B15	compound treatment	1.188	0.0078	0.11	1.418	-0.00989	-0.13	-0.0209	-0.1224	1917728	CBDivE_008035	Cc1ccc(O)c(/C=N/NC(=O)c2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B16	compound treatment	1.154	-0.0262	-0.35	1.422	-0.00589	-0.08	-0.3067	-0.8462	1917729	CBDivE_008036	C/C(=N/NC(=O)c1ccncc1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B17	compound treatment	1.184	0.0038	0.05	1.443	0.0151	0.21	0.182	0.857	1917730	CBDivE_008037	CCOC(=O)NC(NCCc1c[nH]c2ccccc12)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B18	compound treatment	1.134	-0.0462	-0.62	1.484	0.0561	0.77	0.1003	0.1017	1917731	CBDivE_008038	COc1ccc2ccccc2c1/C=N\NC(=O)COc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B19	compound treatment	1.149	-0.0312	-0.42	1.379	-0.0489	-0.67	-0.769	-0.9754	1917732	CBDivE_008039	COc1cc(/C=N/c2ccc(cc2)N3CCOCC3)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	B20	compound treatment	1.14	-0.0402	-0.54	1.441	0.0131	0.18	-0.257	-0.4502	1917733	CBDivE_008040	COc1ccc2C3=NN(C(C3CCc2c1)c4ccc(cc4)[N+](=O)[O-])C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C01	compound treatment	1.179	-0.0012	-0.02	1.457	0.0291	0.4	0.2693	0.6778	1340452	CBDivE_008041	CC(C)(c1ccc(s1)C(=O)O)c2ccc(s2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C02	compound treatment	1.189	0.0088	0.12	1.426	-0.00189	-0.03	0.0657	0.541	1917734	CBDivE_008042	O=C/1Nc2ccccc2\C1=N\NS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C03	compound treatment	1.302	0.122	1.64	1.448	0.0201	0.27	1.3558	0.8139	1917735	CBDivE_008043	O=C1c2ccccc2-c3cc4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C04	compound treatment	1.184	0.0038	0.05	1.367	-0.0609	-0.83	-0.5509	-0.6622	1917736	CBDivE_008044	FC(F)C(F)(F)c1nc2ccccc2[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C05	compound treatment	1.177	-0.0032	-0.04	1.455	0.0271	0.37	0.2309	0.6204	1917737	CBDivE_008045	CN1CCN(CC(=O)N/N=C\c2ccccc2O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C06	compound treatment	1.21	0.0298	0.4	1.485	0.0571	0.78	0.835	0.9527	1367642	CBDivE_008046	CC(=O)N1C(O)CCN1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C07	compound treatment	1.249	0.0688	0.93	1.455	0.0271	0.37	0.9177	0.9186	1503602	CBDivE_008047	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C08	compound treatment	1.175	-0.0052	-0.07	1.449	0.0211	0.29	0.154	0.5197	1917738	CBDivE_008048	COc1ccc(/C=C/C(=O)NCCc2ccccn2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C09	compound treatment	1.198	0.0178	0.24	1.468	0.0401	0.55	0.5566	0.9317	1917739	CBDivE_008049	NC(=N)SCC1CN=C(S1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C10	compound treatment	1.197	0.0168	0.23	1.498	0.0701	0.96	0.8363	0.8512	1917740	CBDivE_008050	Cc1ccc(cc1)C(=O)Nc2ccc(N=Nc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C11	compound treatment	1.239	0.0588	0.79	1.443	0.0151	0.21	0.7066	0.8622	1917741	CBDivE_008051	NS(=O)(=O)c1ccc(C/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C12	compound treatment	1.196	0.0158	0.21	1.4	-0.0279	-0.38	-0.1182	-0.2711	1917742	CBDivE_008052	COC(=O)C(O)(c1ccc(cc1)N(C)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C13	compound treatment	1.24	0.0598	0.81	1.469	0.0411	0.56	0.9669	0.9842	1917743	CBDivE_008053	BrCCC(=O)NC(=O)Oc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C14	compound treatment	1.238	0.0578	0.78	1.473	0.0451	0.62	0.9864	0.9931	1917744	CBDivE_008054	Oc1c(CC=C)cccc1/C=N/NC(=O)c2ccn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C15	compound treatment	1.271	0.0908	1.22	1.492	0.0641	0.87	1.4844	0.9863	1917745	CBDivE_008055	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C16	compound treatment	1.161	-0.0192	-0.26	1.482	0.0541	0.74	0.3386	0.433	1917746	CBDivE_008056	Cc1nc2sc3CCCCc3c2c(=O)n1/N=C/c4ccccc4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C17	compound treatment	1.242	0.0618	0.83	1.486	0.0581	0.79	1.1499	0.9997	1917747	CBDivE_008057	COc1ccc(OC(NC(=O)c2ccc(C)cc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C18	compound treatment	1.151	-0.0292	-0.39	1.469	0.0411	0.56	0.1179	0.172	1917748	CBDivE_008058	CNc1nc(CC(=O)C2CC2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C19	compound treatment	1.197	0.0168	0.23	1.519	0.0911	1.24	1.0388	0.8225	1917749	CBDivE_008059	COc1ccc(/C=N/C2C(O)OC(CO)C(O)C2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	C20	compound treatment	1.152	-0.0282	-0.38	1.401	-0.0269	-0.37	-0.5283	-0.9998	1917750	CBDivE_008060	COc1ccccc1/C=N/NC(=O)c2[nH]ncc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D01	compound treatment	1.157	-0.0232	-0.31	1.371	-0.0569	-0.78	-0.7698	-0.9203	1917751	CBDivE_008061	COC(=O)CCC(=O)c1ccc(Br)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D02	compound treatment	1.157	-0.0232	-0.31	1.374	-0.0539	-0.73	-0.7409	-0.9276	1197164	CBDivE_008062	CC(C)Cc1ccc(cc1)C(C)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D03	compound treatment	1.053	-0.127	-1.72	1.373	-0.0549	-0.75	-1.7427	-0.9308	1917752	CBDivE_008063	CC1(C)CC(=O)C(=Cc2c(O)ccc3ccccc23)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D04	compound treatment	1.177	-0.0032	-0.04	1.404	-0.0239	-0.33	-0.2609	-0.7938	1775959	CBDivE_008064	[O-][N+](=O)c1ccc(Sc2ccc(NC(=O)C(c3ccccc3)c4ccccc4)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D05	compound treatment	1.13	-0.0502	-0.68	1.417	-0.0109	-0.15	-0.5839	-0.8422	1917753	CBDivE_008065	COc1ccc2C(=O)N(C)C(=O)c3cccc1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D06	compound treatment	1.218	0.0378	0.51	1.411	-0.0169	-0.23	0.1977	0.3534	1917754	CBDivE_008066	CS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D07	compound treatment	1.172	-0.0082	-0.11	1.453	0.0251	0.34	0.1639	0.4556	1917755	CBDivE_008067	FC(F)(F)C(F)(F)C(=O)Nc1cccc2c(ccnc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D08	compound treatment	1.151	-0.0292	-0.39	1.379	-0.0489	-0.67	-0.7499	-0.9685	1917756	CBDivE_008068	Oc1ccc([N+](=O)[O-])c(/C=N/c2ccc(cc2)N3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D09	compound treatment	1.143	-0.0372	-0.5	1.393	-0.0349	-0.48	-0.6913	-0.9996	1917757	CBDivE_008069	CN(C(=O)Oc1ccccc1)c2ccc(cc2)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D10	compound treatment	1.131	-0.0492	-0.66	1.426	-0.00189	-0.03	-0.4875	-0.734	1917758	CBDivE_008070	Cc1ccccc1OC(=O)NC(=O)CCBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D11	compound treatment	1.141	-0.0392	-0.53	1.464	0.0361	0.49	-0.0257	-0.0356	1162294	CBDivE_008071	CCc1c(C)nc2sc(C(=O)N)c(N)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D12	compound treatment	1.204	0.0238	0.32	1.444	0.0161	0.22	0.3824	0.9829	1917759	CBDivE_008072	Fc1ccc2c(Cl)c(sc2c1)C(=O)N/N=C/C3CC4CCC3C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D13	compound treatment	1.232	0.0518	0.7	1.444	0.0161	0.22	0.6495	0.8866	1917760	CBDivE_008073	CCCCCCCC(=O)Nc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D14	compound treatment	1.168	-0.0122	-0.16	1.371	-0.0569	-0.78	-0.6649	-0.8384	1277637	CBDivE_008074	Cc1ccc(Nc2nc(cs2)c3ccc(Cl)c(Cl)c3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D15	compound treatment	1.127	-0.0532	-0.72	1.46	0.0321	0.44	-0.1979	-0.2353	1917761	CBDivE_008075	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2cc3ccc(O)cc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D16	compound treatment	1.189	0.0088	0.12	1.35	-0.0779	-1.06	-0.6671	-0.6242	1917762	CBDivE_008076	C/C(=N\NC(=O)c1cccc(Br)c1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D17	compound treatment	1.158	-0.0222	-0.3	1.396	-0.0319	-0.43	-0.5192	-0.9834	1917763	CBDivE_008077	Cc1ccccc1NCC(=O)N/N=C/c2cc3ccccc3nc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D18	compound treatment	1.124	-0.0562	-0.76	1.424	-0.00389	-0.05	-0.5736	-0.7547	1917764	CBDivE_008078	COc1ccc2ccccc2c1/C=N\NC(=O)COc3ccc(C)cc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D19	compound treatment	1.196	0.0158	0.21	1.481	0.0531	0.72	0.6629	0.878	1917765	CBDivE_008079	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c2c[nH]nc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	D20	compound treatment	1.15	-0.0302	-0.41	1.484	0.0561	0.77	0.253	0.2918	1515525	CBDivE_008080	COc1ccc2CCC3C(N(N=C3c2c1)C(=O)C)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E01	compound treatment	1.226	0.0458	0.62	1.42	-0.00789	-0.11	0.3608	0.5753	1242157	CBDivE_008081	CC(C)(C)c1cc(C(=O)CCCC(=O)O)c(s1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E02	compound treatment	1.168	-0.0122	-0.16	1.423	-0.00489	-0.07	-0.1635	-0.9209	1917766	CBDivE_008082	COc1cccc(/C=N/n2cnnc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E03	compound treatment	1.212	0.0318	0.43	1.46	0.0321	0.44	0.613	0.9999	1917767	CBDivE_008083	CC(=O)OC1(C(=O)N(c2ccccc21)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E04	compound treatment	1.186	0.0058	0.08	1.483	0.0551	0.75	0.5867	0.7766	1202313	CBDivE_008084	COc1ccc(NC(=O)COc2cccc(c2)C3(C)NC(=O)NC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E05	compound treatment	1.228	0.0478	0.64	1.447	0.0191	0.26	0.6403	0.9205	1917768	CBDivE_008085	COc1cccc(/C=N\NC(=O)CN2CCN(C)CC2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E06	compound treatment	1.153	-0.0272	-0.37	1.414	-0.0139	-0.19	-0.3934	-0.9527	1917769	CBDivE_008086	Oc1ccc(/N=C/2\C(=O)Nc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E07	compound treatment	1.203	0.0228	0.31	1.53	0.102	1.39	1.2021	0.843	1917770	CBDivE_008087	CC1=C(C)N(NC(=O)O1)c2c(Cl)cc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E08	compound treatment	1.197	0.0168	0.23	1.471	0.0431	0.59	0.576	0.9142	1917771	CBDivE_008088	Clc1ccc(/C=N/c2ncn[nH]2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E09	compound treatment	1.319	0.139	1.87	1.496	0.0681	0.93	1.9808	0.9477	1917772	CBDivE_008089	Cc1ccccc1N2C(=O)CC(SC(=N)N/N=C/c3ccc(Cl)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E10	compound treatment	1.216	0.0358	0.48	1.452	0.0241	0.33	0.574	0.9824	1917773	CBDivE_008090	CC[n+]1ccc(/C=C/N(C)c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E11	compound treatment	1.247	0.0668	0.9	1.462	0.0341	0.47	0.9662	0.9527	1595094	CBDivE_008091	CCCCc1ccc(nc1)c2ccc(Br)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E12	compound treatment	1.167	-0.0132	-0.18	1.424	-0.00389	-0.05	-0.1634	-0.8796	1012009	CBDivE_008092	CN(C)CCC(=O)c1ccc(O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E13	compound treatment	1.186	0.0058	0.08	1.438	0.0101	0.14	0.1528	0.964	1917774	CBDivE_008093	O=C(NN1C(=O)c2ccccc2C1=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E14	compound treatment	1.156	-0.0242	-0.33	1.403	-0.0249	-0.34	-0.4708	-0.9998	1917775	CBDivE_008094	Clc1ccc(C(=O)CC(NC(=O)Nc2ccccc2)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E15	compound treatment	1.266	0.0858	1.16	1.426	-0.00189	-0.03	0.8003	0.6912	1917776	CBDivE_008095	COc1ccc(/C(=N\NC(=O)c2ccc(cc2)c3ccccc3)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E16	compound treatment	1.17	-0.0102	-0.14	1.401	-0.0269	-0.37	-0.3566	-0.9104	1917777	CBDivE_008096	Clc1ccc(C(=O)CC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E17	compound treatment	1.234	0.0538	0.73	1.468	0.0401	0.55	0.9	0.9903	1917778	CBDivE_008097	OCCCC(=O)NCCCCNC(=O)CCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E18	compound treatment	1.168	-0.0122	-0.16	1.451	0.0231	0.32	0.1065	0.2995	1917779	CBDivE_008098	CN(C)CCOC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E19	compound treatment	1.28	0.0998	1.35	1.542	0.114	1.56	2.0523	0.9974	1917780	CBDivE_008099	CCOC(=O)CNC(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	E20	compound treatment	1.208	0.0278	0.38	1.453	0.0251	0.34	0.5073	0.999	1917781	CBDivE_008100	Cc1cc([nH]n1)C(=O)N/N=C\c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F01	compound treatment	1.139	-0.0412	-0.56	1.364	-0.0639	-0.87	-1.0091	-0.9764	1917782	CBDivE_008101	OC(=O)CCCCc1cc2NC(=O)CCCc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F02	compound treatment	1.116	-0.0642	-0.87	1.36	-0.0679	-0.93	-1.267	-0.9994	1917783	CBDivE_008102	Cc1ccc(cc1N)S(=O)(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F03	compound treatment	1.127	-0.0532	-0.72	1.417	-0.0109	-0.15	-0.6125	-0.8357	1917784	CBDivE_008103	CC1(C)OC(=O)C(Cc2ccc(C#Cc3ccccc3)o2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F04	compound treatment	1.162	-0.0182	-0.25	1.343	-0.0849	-1.16	-0.9921	-0.8384	1917785	CBDivE_008104	O=C(Nc1ccc(/C=C/C(=O)c2ccccc2)cc1)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F05	compound treatment	1.188	0.0078	0.11	1.454	0.0261	0.36	0.3262	0.8786	1083802	CBDivE_008105	Cc1ccc2nc(sc2c1S(=O)(=O)O)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F06	compound treatment	1.148	-0.0322	-0.43	1.364	-0.0639	-0.87	-0.9232	-0.9483	1692285	CBDivE_008106	CN1C(N(C)c2ccccc12)c3cccc(CC=C)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F07	compound treatment	1.188	0.0078	0.11	1.362	-0.0659	-0.9	-0.5609	-0.62	1917786	CBDivE_008107	[O-][N+](=O)c1ccc(cc1)c2nc3cc4nc5ccccc5nc4cc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F08	compound treatment	1.18	-1.97E-4	0.0	1.442	0.0141	0.19	0.1342	0.6972	1618000	CBDivE_008108	CN(C)c1ccnc2sc3c(SCc4ccc(Cl)cc4)ncnc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F09	compound treatment	1.114	-0.0662	-0.89	1.441	0.0131	0.18	-0.5051	-0.5546	1917787	CBDivE_008109	N(/N=C\c1cccc2ccccc12)c3nnn[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F10	compound treatment	1.168	-0.0122	-0.16	1.456	0.0281	0.38	0.1547	0.3708	1917788	CBDivE_008110	Cc1ccc(NC(=O)NC(=O)CCBr)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F11	compound treatment	1.16	-0.0202	-0.27	1.486	0.0581	0.79	0.3676	0.4387	1917789	CBDivE_008111	OC(=O)c1cc(nc2ccc(Cc3ccc4nc(cc(C(=O)O)c4c3)c5ccccc5)cc12)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F12	compound treatment	1.085	-0.0952	-1.28	1.41	-0.0179	-0.24	-1.0806	-0.8266	1224133	CBDivE_008112	COc1ccc2c(Cl)c(sc2c1Cl)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F13	compound treatment	1.16	-0.0202	-0.27	1.466	0.0381	0.52	0.1748	0.2979	1358158	CBDivE_008113	Brc1ccc(o1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F14	compound treatment	1.157	-0.0232	-0.31	1.439	0.0111	0.15	-0.1142	-0.3283	1688015	CBDivE_008114	Cc1ccc(Nc2nc(cs2)c3ccc(Cl)cc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F15	compound treatment	1.172	-0.0082	-0.11	1.461	0.0331	0.45	0.2411	0.5186	1917790	CBDivE_008115	Oc1cc2ccccc2cc1/C=N/NC(=O)c3sc4cc(F)ccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F16	compound treatment	1.169	-0.0112	-0.15	1.442	0.0141	0.19	0.0292	0.1195	1775455	CBDivE_008116	CC1OC(Nc2ccc(Br)cc2)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F17	compound treatment	1.116	-0.0642	-0.87	1.46	0.0321	0.44	-0.3028	-0.312	1605478	CBDivE_008117	Cc1cccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)Nc5cccc(C)c5C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F18	compound treatment	1.167	-0.0132	-0.18	1.442	0.0141	0.19	0.0102	0.0387	1917791	CBDivE_008118	OC(=O)COc1ccc(Br)cc1/C=C/2\SC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F19	compound treatment	1.126	-0.0542	-0.73	1.461	0.0331	0.45	-0.1977	-0.2301	1917792	CBDivE_008119	Cc1ccccc1NCC(=O)N/N=C/c2cc(N=Nc3ccccc3)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	F20	compound treatment	1.154	-0.0262	-0.35	1.391	-0.0369	-0.5	-0.6056	-0.9851	1600524	CBDivE_008120	OC(=O)C1C(C2CCCCC2=C3CCCCC13)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G01	compound treatment	1.159	-0.0212	-0.29	1.426	-0.00189	-0.03	-0.2204	-0.7677	1917793	CBDivE_008121	Clc1ccc(cc1Cl)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G02	compound treatment	1.151	-0.0292	-0.39	1.391	-0.0369	-0.5	-0.6342	-0.9927	1917794	CBDivE_008122	Cc1ccc(NC(=O)Nc2ccc3ccccc3c2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G03	compound treatment	1.115	-0.0652	-0.88	1.447	0.0191	0.26	-0.4377	-0.4771	1917795	CBDivE_008123	CCCC(=O)c1ccc(s1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G04	compound treatment	1.209	0.0288	0.39	1.431	0.00311	0.04	0.3047	0.7796	1917796	CBDivE_008124	[O-][N+](=O)c1cccc(/C=N/c2nccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G05	compound treatment	1.19	0.0098	0.13	1.427	-8.9E-4	-0.01	0.0849	0.6395	1917797	CBDivE_008125	COc1ccc(OC)c(/C=N\NC(=O)CN2CCN(C)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G06	compound treatment	1.182	0.0018	0.02	1.405	-0.0229	-0.31	-0.2035	-0.6501	1917798	CBDivE_008126	CCC(NC(=O)Nc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G07	compound treatment	1.27	0.0898	1.21	1.444	0.0161	0.22	1.012	0.8219	1917799	CBDivE_008127	Fc1ccccc1/C=N/NC(=N)SC2CC(=O)N(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G08	compound treatment	1.172	-0.0082	-0.11	1.426	-0.00189	-0.03	-0.0964	-0.8492	1914564	CBDivE_008128	CN(C)c1ccc(/C=C/c2cccc[n+]2CCCS(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G09	compound treatment	1.207	0.0268	0.36	1.459	0.0311	0.42	0.5557	0.9968	1917800	CBDivE_008129	[O-][N+](=O)c1ccc(NCCCC(=O)OCC#C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G10	compound treatment	1.197	0.0168	0.23	1.481	0.0531	0.72	0.6724	0.886	1917801	CBDivE_008130	Cc1ccc(cc1)S(=O)(=O)Oc2cc3c(C)cc(=O)oc3cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G11	compound treatment	1.261	0.0808	1.09	1.453	0.0251	0.34	1.0129	0.8865	1404475	CBDivE_008131	CCCCc1ccc(nc1)c2ccc(C)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G12	compound treatment	1.104	-0.0762	-1.03	1.449	0.0211	0.29	-0.5233	-0.4902	1917802	CBDivE_008132	CC(C)OC(=O)CCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G13	compound treatment	1.21	0.0298	0.4	1.394	-0.0339	-0.46	-0.0425	-0.0694	1917803	CBDivE_008133	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G14	compound treatment	1.158	-0.0222	-0.3	1.436	0.00811	0.11	-0.1336	-0.4184	1917804	CBDivE_008134	Cc1cc(C)n(CC(=O)Nc2ccc(Br)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G15	compound treatment	1.238	0.0578	0.78	1.522	0.0941	1.28	1.4588	0.9715	1917805	CBDivE_008135	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G16	compound treatment	1.179	-0.0012	-0.02	1.482	0.0541	0.74	0.5103	0.6915	1411025	CBDivE_008136	Fc1cccc(NC(=O)c2cc(F)c(F)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G17	compound treatment	1.235	0.0548	0.74	1.441	0.0131	0.18	0.6492	0.8535	1917806	CBDivE_008137	C1Cc2ccccc2N1c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G18	compound treatment	1.238	0.0578	0.78	1.435	0.00711	0.1	0.62	0.7889	1917807	CBDivE_008138	COC(=O)C1C(Cl)C(=C(Cl)C(Cl)(C(Cl)Cl)C1C(=O)Nc2ccccc2)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G19	compound treatment	1.251	0.0708	0.96	1.443	0.0151	0.21	0.8211	0.8403	1917808	CBDivE_008139	COc1cccc(/C=N/NC(=O)c2ccco2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	G20	compound treatment	1.181	8.03E-4	0.01	1.401	-0.0269	-0.37	-0.2516	-0.6859	1917809	CBDivE_008140	Cc1cc([nH]n1)C(=O)N/N=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H01	compound treatment	1.146	-0.0342	-0.46	1.31	-0.118	-1.61	-1.463	-0.8747	1917810	CBDivE_008141	Cc1sc2CCCNC(=O)c2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H02	compound treatment	1.153	-0.0272	-0.37	1.401	-0.0269	-0.37	-0.5187	-1.0	1314358	CBDivE_008142	CCN(CC)S(=O)(=O)c1ccc(cc1)c2csc(Nc3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H03	compound treatment	1.19	0.0098	0.13	1.356	-0.0719	-0.98	-0.5997	-0.6062	1917811	CBDivE_008143	Oc1c(CC=C)cccc1/C=N/NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H04	compound treatment	1.206	0.0258	0.35	1.391	-0.0369	-0.5	-0.1096	-0.1791	1917812	CBDivE_008144	Cc1ccccc1NC(=O)C(=Nc2ccccc2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H05	compound treatment	1.131	-0.0492	-0.66	1.396	-0.0319	-0.43	-0.7768	-0.979	1917813	CBDivE_008145	CC(C)(C)c1cc(c(O)c(c1)C(C)(C)C)n2nc3ccc(Cl)cc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H06	compound treatment	1.177	-0.0032	-0.04	1.389	-0.0389	-0.53	-0.4055	-0.7621	1917814	CBDivE_008146	OS(=O)(=O)c1cc(ccc1/C=C/c2ccccc2)n3nc4ccc5ccccc5c4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H07	compound treatment	1.138	-0.0422	-0.57	1.406	-0.0219	-0.3	-0.6136	-0.9546	1343318	CBDivE_008147	Nc1ccc(CN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H08	compound treatment	1.149	-0.0312	-0.42	1.386	-0.0419	-0.57	-0.7015	-0.9887	1917815	CBDivE_008148	Clc1ccc(CSc2cn3CCCc3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H09	compound treatment	1.129	-0.0512	-0.69	1.388	-0.0399	-0.54	-0.873	-0.993	1917816	CBDivE_008149	CCOc1ccc(/C=N/Nc2nnn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H10	compound treatment	1.172	-0.0082	-0.11	1.45	0.0221	0.3	0.135	0.4204	1917817	CBDivE_008150	CC(C)(C)c1ccc(OC(=O)NC(=O)CCBr)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H11	compound treatment	1.25	0.0698	0.94	1.363	-0.0649	-0.88	0.0402	0.0311	1707988	CBDivE_008151	Cc1ccc2nc(cc(C(=O)O)c2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H12	compound treatment	1.159	-0.0212	-0.29	1.405	-0.0229	-0.31	-0.4229	-0.999	1243710	CBDivE_008152	Nc1c2CCCc2nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H13	compound treatment	1.231	0.0508	0.69	1.495	0.0671	0.92	1.1317	0.9899	1553244	CBDivE_008153	CCC(C)NC(=O)c1ccccc1C(=O)NC(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H14	compound treatment	1.173	-0.0072	-0.1	1.434	0.00611	0.08	-0.0097	-0.0762	1917818	CBDivE_008154	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H15	compound treatment	1.108	-0.0722	-0.97	1.359	-0.0689	-0.94	-1.353	-0.9998	1917819	CBDivE_008155	Cc1ccc(/C=N/NC(=O)c2sc3cc(F)ccc3c2Cl)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H16	compound treatment	1.114	-0.0662	-0.89	1.451	0.0231	0.32	-0.4086	-0.4315	1917820	CBDivE_008156	CC1OC(Nc2ccc(cc2)c3ccc(NC4OC(C)C(O)C(O)C4O)cc3)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H17	compound treatment	1.107	-0.0732	-0.99	1.428	1.1E-4	0.0	-0.6972	-0.706	1917821	CBDivE_008157	OC(=O)c1cc(cc(c1)n2c(=O)c3ccc4c(=O)n(c5cc(cc(c5)C(=O)O)C(=O)O)c(=O)c6ccc(c2=O)c3c46)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H18	compound treatment	1.186	0.0058	0.08	1.372	-0.0559	-0.76	-0.4836	-0.6312	1917822	CBDivE_008158	COc1ccc(OCC(=O)N/N=C\c2c(OC)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H19	compound treatment	1.131	-0.0492	-0.66	1.441	0.0131	0.18	-0.3429	-0.4989	1917823	CBDivE_008159	Cc1nn(c(N2CCCCC2)c1/C=N/NC(=O)CNc3ccccc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	H20	compound treatment	1.149	-0.0312	-0.42	1.43	0.00211	0.03	-0.2773	-0.6572	1516212	CBDivE_008160	CC(=O)Nc1cc(n[nH]1)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I01	compound treatment	1.181	8.03E-4	0.01	1.413	-0.0149	-0.2	-0.1359	-0.6685	1065011	CBDivE_008161	OP(=O)(c1cccc(c1)[N+](=O)[O-])c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I02	compound treatment	1.132	-0.0482	-0.65	1.381	-0.0469	-0.64	-0.9119	-1.0	1532087	CBDivE_008162	OC(=O)CNc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I03	compound treatment	1.229	0.0488	0.66	1.494	0.0661	0.9	1.103	0.9881	1917824	CBDivE_008163	CC(C)Cc1ccc(s1)/C(=N\NC(=O)N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I04	compound treatment	1.147	-0.0332	-0.45	1.425	-0.00289	-0.04	-0.3446	-0.7664	1917825	CBDivE_008164	Oc1ccc(Br)cc1/C=N\c2ccccc2c3ccccc3/N=C\c4cc(Br)ccc4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I05	compound treatment	1.197	0.0168	0.23	1.448	0.0201	0.27	0.3542	0.9955	1917826	CBDivE_008165	COc1cc(/C=N\NC(=O)CN2CCN(C)CC2)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I06	compound treatment	1.162	-0.0182	-0.25	1.442	0.0141	0.19	-0.0375	-0.1204	1917827	CBDivE_008166	COc1ccc(NC(=O)/C(=C/c2ccccc2)/NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I07	compound treatment	1.213	0.0328	0.44	1.459	0.0311	0.42	0.6129	0.9998	1917828	CBDivE_008167	Fc1ccccc1/C=N/NC(=N)SC2CC(=O)N(C2=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I08	compound treatment	1.178	-0.0022	-0.03	1.484	0.0561	0.77	0.5201	0.6792	1917829	CBDivE_008168	C/C(=C/c1ccccc1)/C(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I09	compound treatment	1.202	0.0218	0.29	1.498	0.0701	0.96	0.884	0.8838	1917830	CBDivE_008169	OC1(C(=O)N(c2ccccc21)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I10	compound treatment	1.196	0.0158	0.21	1.414	-0.0139	-0.19	0.0168	0.0589	1917831	CBDivE_008170	C/C(=C\C(=O)Nc1ccc(OCc2ccccc2)cc1)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I11	compound treatment	1.253	0.0728	0.98	1.484	0.0561	0.77	1.2355	0.9924	1917832	CBDivE_008171	CCCCCCc1cc2/C(=N/O)/CCCCc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I12	compound treatment	1.174	-0.0062	-0.08	1.494	0.0661	0.9	0.5783	0.6388	1410613	CBDivE_008172	Clc1c(Cl)c(Cl)c(C(=O)OCC#C)c(C(=O)NCc2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I13	compound treatment	1.25	0.0698	0.94	1.439	0.0111	0.15	0.773	0.8104	1917833	CBDivE_008173	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I14	compound treatment	1.199	0.0188	0.25	1.436	0.00811	0.11	0.2576	0.9308	1917834	CBDivE_008174	COc1ccc(C=C2C(=O)OC(OC2=O)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I15	compound treatment	1.179	-0.0012	-0.02	1.487	0.0591	0.81	0.5585	0.6928	1917835	CBDivE_008175	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I16	compound treatment	1.179	-0.0012	-0.02	1.431	0.00311	0.04	0.0186	0.409	1917836	CBDivE_008176	C(N(/N=C/c1cccnc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I17	compound treatment	1.262	0.0818	1.1	1.497	0.0691	0.94	1.4467	0.9969	1917837	CBDivE_008177	C/C(=N\NC(=O)c1ccncc1)/c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I18	compound treatment	1.176	-0.0042	-0.06	1.475	0.0471	0.64	0.4142	0.6423	1917838	CBDivE_008178	COc1cc2ccccc2cc1C(=O)N/N=C\c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I19	compound treatment	1.263	0.0828	1.12	1.419	-0.00889	-0.12	0.7042	0.6267	1917839	CBDivE_008179	Clc1ccccc1CNC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	I20	compound treatment	1.209	0.0288	0.39	1.448	0.0201	0.27	0.4687	0.9854	1776738	CBDivE_008180	C(/C=C/c1ccccc1)N2CCN(CC2)C3c4ccccc4-c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J01	compound treatment	1.168	-0.0122	-0.16	1.39	-0.0379	-0.52	-0.4817	-0.8883		CBDivE_008181	
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J02	compound treatment	1.16	-0.0202	-0.27	1.456	0.0281	0.38	0.0784	0.1667	1917841	CBDivE_008182	COc1ccccc1NC(=S)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J03	compound treatment	1.1	-0.0802	-1.08	1.361	-0.0669	-0.91	-1.41	-0.9964	1917842	CBDivE_008183	Oc1ccc(Cl)cc1/C=N/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J04	compound treatment	1.152	-0.0282	-0.38	1.438	0.0101	0.14	-0.1715	-0.4239	1722931	CBDivE_008184	COC(=O)c1sc2nc(C)c(C)c(C)c2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J05	compound treatment	1.15	-0.0302	-0.41	1.424	-0.00389	-0.05	-0.3256	-0.7925	1917843	CBDivE_008185	CCC(C)(C)c1cc(c(O)c(c1)C(C)(C)CC)n2nc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J06	compound treatment	1.153	-0.0272	-0.37	1.364	-0.0639	-0.87	-0.8755	-0.9261	1400739	CBDivE_008186	COC(=O)c1ccc2oc(nc2c1)c3ccc(c4nc5cc(ccc5o4)C(=O)OC)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J07	compound treatment	1.174	-0.0062	-0.08	1.399	-0.0289	-0.39	-0.3377	-0.8385	1917844	CBDivE_008187	COc1ccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J08	compound treatment	1.182	0.0018	0.02	1.428	1.1E-4	0.0	0.0183	0.7492	1917845	CBDivE_008188	CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J09	compound treatment	1.153	-0.0272	-0.37	1.428	1.1E-4	0.0	-0.2584	-0.7042	1407661	CBDivE_008189	Fc1c(F)c(C(=O)N2CCCC2)c(F)c(C(=O)N3CCCC3)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J10	compound treatment	1.175	-0.0052	-0.07	1.427	-8.9E-4	-0.01	-0.0582	-0.8174	1917846	CBDivE_008190	NC(=O)Oc1ccc(cc1)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J11	compound treatment	1.162	-0.0182	-0.25	1.409	-0.0189	-0.26	-0.3557	-0.9997	1332231	CBDivE_008191	Cc1ccc2nc(cc(C(=O)O)c2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J12	compound treatment	1.138	-0.0422	-0.57	1.42	-0.00789	-0.11	-0.4786	-0.8261	1917847	CBDivE_008192	COC/1=Nc2ccccc2\C1=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J13	compound treatment	1.175	-0.0052	-0.07	1.389	-0.0389	-0.53	-0.4246	-0.7937	1917848	CBDivE_008193	CC(C)(C)NC(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J14	compound treatment	1.135	-0.0452	-0.61	1.333	-0.0949	-1.29	-1.3461	-0.9411	1917849	CBDivE_008194	COc1ccccc1Nc2nc(cs2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J15	compound treatment	1.146	-0.0342	-0.46	1.433	0.00511	0.07	-0.277	-0.5936	1639903	CBDivE_008195	Fc1ccc2c(Cl)c(sc2c1)C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J16	compound treatment	1.099	-0.0812	-1.1	1.445	0.0171	0.23	-0.6096	-0.5443	1776695	CBDivE_008196	CC1OC(Nc2cccc3ccccc23)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J17	compound treatment	1.14	-0.0402	-0.54	1.436	0.00811	0.11	-0.3053	-0.5516	1917850	CBDivE_008197	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(NC(=O)c3cccc(c3)[N+](=O)[O-])c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J18	compound treatment	1.105	-0.0752	-1.01	1.419	-0.00889	-0.12	-0.8031	-0.786	1917851	CBDivE_008198	OC(=O)/C=C/C(=O)Nc1ccc(Oc2ccc(NC(=O)\C=C\C(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J19	compound treatment	1.145	-0.0352	-0.47	1.472	0.0441	0.6	0.0896	0.1169	1917852	CBDivE_008199	Cc1ccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	J20	compound treatment	1.197	0.0168	0.23	1.441	0.0131	0.18	0.2867	0.9931	1917853	CBDivE_008200	OC(=O)c1ccc(cc1)N2CCC(=N2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K01	compound treatment	1.238	0.0578	0.78	1.466	0.0381	0.52	0.9189	0.9805	1917854	CBDivE_008201	[O-][N+](=O)c1ccc(OCSc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K02	compound treatment	1.184	0.0038	0.05	1.389	-0.0389	-0.53	-0.3387	-0.6357	1917855	CBDivE_008202	[O-][N+](=O)c1ccccc1NC(=O)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K03	compound treatment	1.197	0.0168	0.23	1.436	0.00811	0.11	0.2385	0.9456	1917856	CBDivE_008203	CCN(C(=O)C1(CC2CC3CC(C2)C1)C3)c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K04	compound treatment	1.145	-0.0352	-0.47	1.407	-0.0209	-0.28	-0.5372	-0.9701	1917857	CBDivE_008204	CC(=O)Oc1ccc(cc1)C2N(CCN2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K05	compound treatment	1.256	0.0758	1.02	1.458	0.0301	0.41	1.0134	0.9197	1493850	CBDivE_008205	Cc1ccc(cc1)S(=O)(=O)Nc2cc(n[nH]2)c3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K06	compound treatment	1.167	-0.0132	-0.18	1.427	-8.9E-4	-0.01	-0.1345	-0.7536	1917858	CBDivE_008206	CC(=O)Nc1ccc(N=NC2C(=NN(C2=O)c3ccccc3)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K07	compound treatment	1.163	-0.0172	-0.23	1.462	0.0341	0.47	0.1648	0.3171	1917859	CBDivE_008207	N=C(N/N=C/c1ccccc1)SC2CC(=O)N(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K08	compound treatment	1.148	-0.0322	-0.43	1.426	-0.00189	-0.03	-0.3254	-0.7478	1917860	CBDivE_008208	Clc1cc(Cl)c(NC(=O)CCCC(=O)OCC#C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K09	compound treatment	1.18	-1.97E-4	0.0	1.441	0.0131	0.18	0.1245	0.6965	1496014	CBDivE_008209	Cc1cc(CN2CCOCC2)c(O)c(CN3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K10	compound treatment	1.179	-0.0012	-0.02	1.457	0.0291	0.4	0.2693	0.6778	1917861	CBDivE_008210	Cn1cc(/C=N/NC(=O)N)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K11	compound treatment	1.225	0.0448	0.6	1.435	0.00711	0.1	0.4959	0.8102	1249274	CBDivE_008211	COc1ccccc1Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K12	compound treatment	1.165	-0.0152	-0.21	1.398	-0.0299	-0.41	-0.4332	-0.9494	1917862	CBDivE_008212	Cc1n[nH]c(c1Br)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K13	compound treatment	1.235	0.0548	0.74	1.451	0.0231	0.32	0.7456	0.9277	1917863	CBDivE_008213	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K14	compound treatment	1.144	-0.0362	-0.49	1.457	0.0291	0.4	-0.0646	-0.1027	1917864	CBDivE_008214	Brc1cccc(c1)C(=O)N/N=C\C=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K15	compound treatment	1.258	0.0778	1.05	1.484	0.0561	0.77	1.2832	0.9879	1917865	CBDivE_008215	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K16	compound treatment	1.196	0.0158	0.21	1.459	0.0311	0.42	0.4507	0.9493	1917866	CBDivE_008216	CC1CC(C(C)CN1C)(N(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K17	compound treatment	1.253	0.0728	0.98	1.437	0.00911	0.12	0.7823	0.7902	1581400	CBDivE_008217	OCC(O)Cn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K18	compound treatment	1.172	-0.0082	-0.11	1.405	-0.0229	-0.31	-0.2989	-0.9027	1917867	CBDivE_008218	CN(C)c1ccc(/C=N/NC(=O)c2[nH]ncc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K19	compound treatment	1.229	0.0488	0.66	1.524	0.0961	1.31	1.3923	0.9493	1917868	CBDivE_008219	CN(C)c1ccc(/C=N/c2ccc(C)cn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	K20	compound treatment	1.207	0.0268	0.36	1.484	0.0561	0.77	0.7967	0.9414	1917869	CBDivE_008220	Oc1c(CC=C)cccc1/C=N/NC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L01	compound treatment	1.178	-0.0022	-0.03	1.399	-0.0289	-0.39	-0.2995	-0.7582	1917870	CBDivE_008221	C/C(=N/NC(=O)c1ccc(O)cc1)/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L02	compound treatment	1.145	-0.0352	-0.47	1.336	-0.0919	-1.25	-1.2218	-0.9118	3106129	CBDivE_008222	Nc1c2CCCc2nc3CCCc31.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L03	compound treatment	1.188	0.0078	0.11	1.373	-0.0549	-0.75	-0.4548	-0.6017	1186303	CBDivE_008223	O=C1N(C(=O)c2nccnc12)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L04	compound treatment	1.125	-0.0552	-0.74	1.36	-0.0679	-0.93	-1.1812	-0.9942	1472463	CBDivE_008224	Cc1nc2sc(C(=O)N)c(N)c2c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L05	compound treatment	1.09	-0.0902	-1.22	1.421	-0.00689	-0.09	-0.9269	-0.7594	1917871	CBDivE_008225	CC1=C(C(NC(=O)N1)c2ccccc2Br)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L06	compound treatment	1.184	0.0038	0.05	1.366	-0.0619	-0.84	-0.5605	-0.6629	1289675	CBDivE_008226	Nc1cccc(c1)C(=O)Nc2cccc(c2)S(=O)(=O)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L07	compound treatment	1.122	-0.0582	-0.79	1.394	-0.0339	-0.46	-0.8819	-0.9681	1917872	CBDivE_008227	Nc1ccc(Sc2ccc(Sc3ccc(Sc4ccc(N)cc4)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L08	compound treatment	1.117	-0.0632	-0.85	1.412	-0.0159	-0.22	-0.7561	-0.8595	1440954	CBDivE_008228	Clc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L09	compound treatment	1.158	-0.0222	-0.3	1.406	-0.0219	-0.3	-0.4228	-1.0	1424504	CBDivE_008229	Fc1cccc(c1)C(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L10	compound treatment	1.155	-0.0252	-0.34	1.366	-0.0619	-0.84	-0.8371	-0.9201	1917873	CBDivE_008230	OC(=O)c1ccc(cc1)n2cnnn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L11	compound treatment	1.14	-0.0402	-0.54	1.378	-0.0499	-0.68	-0.8645	-0.9937	1172239	CBDivE_008231	O=C(NC1CCCCCCC1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L12	compound treatment	1.158	-0.0222	-0.3	1.406	-0.0219	-0.3	-0.4228	-1.0	1917874	CBDivE_008232	Cc1ccc(/N=C\2/CCCc3ccccc3N2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L13	compound treatment	1.192	0.0118	0.16	1.388	-0.0399	-0.54	-0.2721	-0.48	1650301	CBDivE_008233	O=C(NC1CCC(CC1)NC(=O)c2ccco2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L14	compound treatment	1.179	-0.0012	-0.02	1.391	-0.0369	-0.5	-0.3671	-0.7294	1297371	CBDivE_008234	OC(=O)c1sc2ccccc2c1Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L15	compound treatment	1.182	0.0018	0.02	1.353	-0.0749	-1.02	-0.7049	-0.6901	1559902	CBDivE_008235	Fc1ccc2c(Cl)c(sc2c1)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L16	compound treatment	1.144	-0.0362	-0.49	1.424	-0.00389	-0.05	-0.3828	-0.7793	1917875	CBDivE_008236	OCC1CC(O)C(O)C(Nc2ccc(cc2)[N+](=O)[O-])O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L17	compound treatment	1.204	0.0238	0.32	1.466	0.0381	0.52	0.5945	0.9732	1917876	CBDivE_008237	Oc1ccc(/N=C/c2ccc(\C=N\c3ccc(O)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L18	compound treatment	1.157	-0.0232	-0.31	1.402	-0.0259	-0.35	-0.4709	-0.9982	1917877	CBDivE_008238	CCCCCOc1ccc(NC(=O)/C=C/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L19	compound treatment	1.174	-0.0062	-0.08	1.486	0.0581	0.79	0.5012	0.629	1917878	CBDivE_008239	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)Cc2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	L20	compound treatment	1.122	-0.0582	-0.79	1.436	0.00811	0.11	-0.477	-0.6016	1146970	CBDivE_008240	Clc1ccc(s1)C(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M01	compound treatment	1.216	0.0358	0.48	1.424	-0.00389	-0.05	0.304	0.6257	1087928	CBDivE_008241	OP1(=O)c2ccccc2Nc3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M02	compound treatment	1.149	-0.0312	-0.42	1.409	-0.0189	-0.26	-0.4798	-0.9722	1161167	CBDivE_008242	CCCC1CC(CCO1)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M03	compound treatment	1.198	0.0178	0.24	1.461	0.0331	0.45	0.4891	0.9564	1244168	CBDivE_008243	CC(=O)Nc1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M04	compound treatment	1.159	-0.0212	-0.29	1.428	1.1E-4	0.0	-0.2012	-0.7034	1917879	CBDivE_008244	Ic1ccccc1/N=C/c2ccc(OC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M05	compound treatment	1.289	0.109	1.47	1.394	-0.0339	-0.46	0.7111	0.4621	1719734	CBDivE_008245	Clc1cncn1CC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M06	compound treatment	1.145	-0.0352	-0.47	1.439	0.0111	0.15	-0.2286	-0.4587	1917880	CBDivE_008246	O=C(OCCC1(C(=O)c2ccccc2C1=O)c3ccccc3)Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M07	compound treatment	1.223	0.0428	0.58	1.45	0.0221	0.3	0.6215	0.9541	1917881	CBDivE_008247	CC(=O)c1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M08	compound treatment	1.173	-0.0072	-0.1	1.398	-0.0299	-0.41	-0.3569	-0.8517	1917882	CBDivE_008248	CCOc1ccc(/C=N/Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M09	compound treatment	1.244	0.0638	0.86	1.457	0.0291	0.4	0.8893	0.9382	1917883	CBDivE_008249	O/N=C/1\C2(CCCCC2)C(=O)N(O)C31CCCC=C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M10	compound treatment	1.2	0.0198	0.27	1.438	0.0101	0.14	0.2864	0.9526	1917884	CBDivE_008250	Oc1ccc(cc1NC(=O)CC2=CCCCC2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M11	compound treatment	1.205	0.0248	0.33	1.434	0.00611	0.08	0.2955	0.857	1917885	CBDivE_008251	Cc1cc(O)c(C(=O)O)c(/C=C/c2cccc(O)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M12	compound treatment	1.177	-0.0032	-0.04	1.41	-0.0179	-0.24	-0.203	-0.8194	1917886	CBDivE_008252	N/C(=N\OCO/N=C(\N)/c1ccccc1)/C2=CC=CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M13	compound treatment	1.196	0.0158	0.21	1.486	0.0581	0.79	0.7111	0.8665	1917887	CBDivE_008253	COc1ccc(cc1)/C(=N/NC(=O)c2ccc(cc2)c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M14	compound treatment	1.194	0.0138	0.19	1.417	-0.0109	-0.15	0.0267	0.1119	1917888	CBDivE_008254	C1Oc2ccc(/C=N/c3ccc(N=Nc4ccccc4)cc3)cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M15	compound treatment	1.224	0.0438	0.59	1.475	0.0471	0.64	0.8721	0.9991	1081755	CBDivE_008255	C(CSc1nc2ccccc2s1)Sc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M16	compound treatment	1.174	-0.0062	-0.08	1.416	-0.0119	-0.16	-0.1738	-0.9525	1917889	CBDivE_008256	CCc1cc(/C=N/CC\N=C\c2cc(CC)sc2O)c(O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M17	compound treatment	1.25	0.0698	0.94	1.494	0.0661	0.9	1.3033	0.9998	1917890	CBDivE_008257	COc1ccc(cc1N)c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M18	compound treatment	1.168	-0.0122	-0.16	1.442	0.0141	0.19	0.0197	0.0778	1917891	CBDivE_008258	Ic1cn[nH]c1C(=O)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M19	compound treatment	1.239	0.0588	0.79	1.53	0.102	1.39	1.5455	0.9644	1917892	CBDivE_008259	O=C(N/N=C(/C=C/c1ccccc1)\c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	M20	compound treatment	1.183	0.0028	0.04	1.463	0.0351	0.48	0.3653	0.7606	1917893	CBDivE_008260	COc1ccc2nc(N=Nc3ccc(cc3)N(C)c4ccccc4)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N01	compound treatment	1.141	-0.0392	-0.53	1.385	-0.0429	-0.58	-0.7875	-0.9987	1917894	CBDivE_008261	COc1ccc(/C=N/NC(=O)c2ccc(O)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N02	compound treatment	1.139	-0.0412	-0.56	1.376	-0.0519	-0.71	-0.8933	-0.9929	1917895	CBDivE_008262	ClCCC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N03	compound treatment	1.205	0.0248	0.33	1.342	-0.0859	-1.17	-0.5916	-0.4857	1917896	CBDivE_008263	COc1ccc(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N04	compound treatment	1.143	-0.0372	-0.5	1.294	-0.134	-1.83	-1.6459	-0.8692	1917897	CBDivE_008264	Cc1cccc(NCC(=O)N/N=C/C=C/c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N05	compound treatment	1.192	0.0118	0.16	1.385	-0.0429	-0.58	-0.301	-0.4965	1917898	CBDivE_008265	CN(C)c1ccc(/C=C/c2nnnn2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N06	compound treatment	1.176	-0.0042	-0.06	1.362	-0.0659	-0.9	-0.6754	-0.7502	1917899	CBDivE_008266	Cc1ccc(OCC(=O)N/N=C/c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N07	compound treatment	1.098	-0.0822	-1.11	1.422	-0.00589	-0.08	-0.8409	-0.7563	1651883	CBDivE_008267	CCOC(=O)c1c(NC(=O)C)sc2c(NC(=O)C)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N08	compound treatment	1.106	-0.0742	-1.0	1.371	-0.0569	-0.78	-1.2564	-0.9921	1917900	CBDivE_008268	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N09	compound treatment	1.11	-0.0702	-0.95	1.38	-0.0479	-0.65	-1.1314	-0.9835	1917901	CBDivE_008269	Clc1ccc(cc1Cl)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N10	compound treatment	1.147	-0.0332	-0.45	1.412	-0.0159	-0.22	-0.4699	-0.9445	1237342	CBDivE_008270	OC(C(=O)NCc1ccccc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N11	compound treatment	1.147	-0.0332	-0.45	1.393	-0.0349	-0.48	-0.6531	-0.9995	1179200	CBDivE_008271	Brc1ccc(o1)C(=O)NC2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N12	compound treatment	1.125	-0.0552	-0.74	1.391	-0.0369	-0.5	-0.8823	-0.9818	1917902	CBDivE_008272	OC(=O)CC/N=C\1/CCCc2ccccc2N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N13	compound treatment	1.166	-0.0142	-0.19	1.379	-0.0489	-0.67	-0.6069	-0.8749	1110836	CBDivE_008273	[O-][N+](=O)c1ccccc1NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N14	compound treatment	1.141	-0.0392	-0.53	1.394	-0.0339	-0.46	-0.7007	-0.9977	1917903	CBDivE_008274	OC(=O)c1sc2cc(F)ccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N15	compound treatment	1.145	-0.0352	-0.47	1.391	-0.0369	-0.5	-0.6915	-0.9996	1917904	CBDivE_008275	COC(=O)c1sc2cc(F)ccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N16	compound treatment	1.172	-0.0082	-0.11	1.415	-0.0129	-0.18	-0.2025	-0.9751	1917905	CBDivE_008276	CC(=O)NC1(C(=O)C)C(=O)N(C(=O)C)c2ccccc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N17	compound treatment	1.122	-0.0582	-0.79	1.375	-0.0529	-0.72	-1.0652	-0.9991	1917906	CBDivE_008277	Cc1ccc(OCC(=O)N/N=C/c2ccc(C)cc2O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N18	compound treatment	1.191	0.0108	0.15	1.408	-0.0199	-0.27	-0.0887	-0.2882	1917907	CBDivE_008278	CCCCCCOC(=O)c1ccccc1NC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N19	compound treatment	1.152	-0.0282	-0.38	1.481	0.0531	0.72	0.2431	0.2972	1917908	CBDivE_008279	Oc1ccc(N=Nc2ccc(cc2)[N+](=O)[O-])cc1/C=N/NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	N20	compound treatment	1.142	-0.0382	-0.52	1.371	-0.0569	-0.78	-0.9129	-0.9803	1917909	CBDivE_008280	Oc1cc2ccccc2cc1/C=N/NC(=O)c3sc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O01	compound treatment	1.226	0.0458	0.62	1.464	0.0361	0.49	0.7851	0.9937	1536696	CBDivE_008281	CN1C(=O)N(C)C(O)(c2ccccc2)C1(O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O02	compound treatment	1.146	-0.0342	-0.46	1.432	0.00411	0.06	-0.2866	-0.6167	1917910	CBDivE_008282	FC(F)C(F)(F)C(F)(F)C(F)(F)c1nc2ccccc2[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O03	compound treatment	1.211	0.0308	0.42	1.493	0.0651	0.89	0.9216	0.9402	1721764	CBDivE_008283	CC(=O)Nc1ccc(NC2OCC(O)C(O)C2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O04	compound treatment	1.202	0.0218	0.29	1.432	0.00411	0.06	0.2476	0.827	1155641	CBDivE_008284	Cc1cc(C)c(NC(=O)c2ccc(cc2)c3ccccc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O05	compound treatment	1.241	0.0608	0.82	1.428	1.1E-4	0.0	0.5811	0.7084	1917911	CBDivE_008285	Cc1ccc(cc1)c2csc(=Nc3ccc(Cl)cc3)n2CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O06	compound treatment	1.163	-0.0172	-0.23	1.402	-0.0259	-0.35	-0.4137	-0.9793	1917912	CBDivE_008286	C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O07	compound treatment	1.193	0.0128	0.17	1.42	-0.00789	-0.11	0.046	0.2263	1917913	CBDivE_008287	Cn1c(/C=C/c2ccccc2)[n+](C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O08	compound treatment	1.208	0.0278	0.38	1.45	0.0221	0.3	0.4784	0.9941	1917914	CBDivE_008288	COC1OC(C)C(OC2OC3COC(C)(C)OC3C(O)C2OCc4ccc(OC)cc4)C5OC(C)(C)OC51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O09	compound treatment	1.232	0.0518	0.7	1.448	0.0201	0.27	0.6881	0.9165	1917915	CBDivE_008289	Brc1ccc(/C=N/NC(=O)c2cccc(n2)C(=O)N\N=C\c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O10	compound treatment	1.151	-0.0292	-0.39	1.433	0.00511	0.07	-0.2293	-0.5731	1283227	CBDivE_008290	Oc1ccccc1OCP(=O)(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O11	compound treatment	1.272	0.0918	1.24	1.453	0.0251	0.34	1.1179	0.87	1917916	CBDivE_008291	OC(=O)/C=C\C(=O)NNC(=O)c1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O12	compound treatment	1.207	0.0268	0.36	1.451	0.0231	0.32	0.4785	0.9977	1917917	CBDivE_008292	CCS(=O)(=O)/C=C/SC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O13	compound treatment	1.182	0.0018	0.02	1.416	-0.0119	-0.16	-0.0975	-0.5944	1917918	CBDivE_008293	C/C(=N\NC(=O)c1ccc(cc1)c2ccccc2)/c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O14	compound treatment	1.17	-0.0102	-0.14	1.426	-0.00189	-0.03	-0.1155	-0.8252	1917919	CBDivE_008294	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1OC(=O)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O15	compound treatment	1.25	0.0698	0.94	1.44	0.0121	0.17	0.7826	0.8186	1917920	CBDivE_008295	Cc1ccc(cc1)C(=O)NC(N2CCOCC2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O16	compound treatment	1.201	0.0208	0.28	1.443	0.0151	0.21	0.3441	0.9885	1917921	CBDivE_008296	CSc1sc(SC)c(/C=N/O)c1/C=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O17	compound treatment	1.225	0.0448	0.6	1.557	0.129	1.76	1.6723	0.8984	1917922	CBDivE_008297	O=C(NN=C1CCCCCC1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O18	compound treatment	1.186	0.0058	0.08	1.496	0.0681	0.93	0.7121	0.764	1917923	CBDivE_008298	Oc1ccc2ccccc2c1/C=N\NC(=O)c3[nH]ncc3I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O19	compound treatment	1.237	0.0568	0.77	1.475	0.0471	0.64	0.9961	0.9962	1917924	CBDivE_008299	Br/C(=C\c1ccccc1)/C=N/NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	O20	compound treatment	1.127	-0.0532	-0.72	1.465	0.0371	0.51	-0.1496	-0.1704	1917925	CBDivE_008300	COc1ccc(/C=N/NC(=O)c2[nH]ncc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P01	compound treatment	1.181	8.03E-4	0.01	1.416	-0.0119	-0.16	-0.107	-0.6584	1917926	CBDivE_008301	Oc1ccc(cc1)C(=O)N/N=C/c2cc(Br)cc(Br)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P02	compound treatment	1.159	-0.0212	-0.29	1.375	-0.0529	-0.72	-0.7122	-0.918	1917927	CBDivE_008302	OCCNS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P03	compound treatment	1.196	0.0158	0.21	1.317	-0.111	-1.51	-0.9185	-0.6015	1387617	CBDivE_008303	Oc1cccc(c1)N2C(=O)c3nccnc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P04	compound treatment	1.105	-0.0752	-1.01	1.381	-0.0469	-0.64	-1.1695	-0.9752	1497944	CBDivE_008304	OC(=O)CCC(=O)Nc1cc(cc(c1)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P05	compound treatment	1.152	-0.0282	-0.38	1.372	-0.0559	-0.76	-0.8079	-0.9485	1917928	CBDivE_008305	CN(C)c1ccc2c(C)cc(=O)[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P06	compound treatment	1.131	-0.0492	-0.66	1.379	-0.0489	-0.67	-0.9407	-1.0	1917929	CBDivE_008306	COc1ccc(OCC(=O)N/N=C/c2ccc(o2)c3ccc(I)cc3)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P07	compound treatment	1.128	-0.0522	-0.7	1.377	-0.0509	-0.69	-0.9886	-1.0	1917930	CBDivE_008307	Clc1ccc(/C=N/Nc2nnn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P08	compound treatment	1.153	-0.0272	-0.37	1.381	-0.0469	-0.64	-0.7116	-0.9652	1202470	CBDivE_008308	CCN(CC)S(=O)(=O)c1ccc(cc1)c2csc(Nc3ccccc3OC)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P09	compound treatment	1.091	-0.0892	-1.2	1.323	-0.105	-1.43	-1.8623	-0.9963	1917931	CBDivE_008309	Clc1cccc(NC(=O)Cc2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P10	compound treatment	0.686	-0.494	-6.67	0.754	-0.674	-9.19	-11.2122	-0.9876	1917932	CBDivE_008310	CCOC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P11	compound treatment	1.161	-0.0192	-0.26	1.378	-0.0499	-0.68	-0.6642	-0.9124	1288441	CBDivE_008311	COc1cccc(NC(=O)c2cccnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P12	compound treatment	1.124	-0.0562	-0.76	1.327	-0.101	-1.38	-1.5089	-0.9606	1917933	CBDivE_008312	OC(=O)CCC/N=C\1/CCCc2ccccc2N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P13	compound treatment	1.153	-0.0272	-0.37	1.416	-0.0119	-0.16	-0.3741	-0.9326	1917934	CBDivE_008313	C/C(=N/Nc1nc2ccccc2s1)/N=Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P14	compound treatment	1.137	-0.0432	-0.58	1.416	-0.0119	-0.16	-0.5267	-0.8708	1917935	CBDivE_008314	OC(=O)c1sc2cc(ccc2c1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P15	compound treatment	1.209	0.0288	0.39	1.403	-0.0249	-0.34	0.0348	0.0674	1917936	CBDivE_008315	Cc1ccc(OCC(=O)N/N=C\2/C(=O)Nc3ccc(cc23)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P16	compound treatment	1.158	-0.0222	-0.3	1.397	-0.0309	-0.42	-0.5096	-0.986	1917937	CBDivE_008316	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)Cc3ccc(Br)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P17	compound treatment	1.136	-0.0442	-0.6	1.347	-0.0809	-1.1	-1.2016	-0.9583	1917938	CBDivE_008317	Cc1c(/C=N/NC(=O)COc2ccc(Cl)cc2Br)c3ccccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P18	compound treatment	1.059	-0.121	-1.64	1.439	0.0111	0.15	-1.049	-0.6389	1917939	CBDivE_008318	COc1ccc(/C=N/C(=N/NC(=O)c2ccccc2)/c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P19	compound treatment	1.183	0.0028	0.04	1.403	-0.0249	-0.34	-0.2133	-0.6245	1917940	CBDivE_008319	CCOC(=O)C(NC(=O)C)(NS(=O)(=O)c1ccccc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.26	P20	compound treatment	1.148	-0.0322	-0.43	1.386	-0.0419	-0.57	-0.7111	-0.9909	1917941	CBDivE_008320	C/C(=N\c1ccc2COC(=O)c2c1)/C3=C(O)C=C(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A01	compound treatment	1.226	0.0295	0.4	1.439	0.00921	0.13	0.3699	0.8874	1917942	CBDivE_008321	CCOC(=O)c1c(C)c(C)sc1NC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A02	compound treatment	1.228	0.0315	0.42	1.449	0.0192	0.26	0.4854	0.9731	1917943	CBDivE_008322	Clc1nc2ccccc2cc1/C=N/NC(=O)CNc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A03	compound treatment	1.237	0.0405	0.55	1.447	0.0172	0.23	0.5519	0.9289	1917944	CBDivE_008323	CCN(CC)C/C(=N/Nc1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A04	compound treatment	1.238	0.0415	0.56	1.422	-0.00779	-0.11	0.3204	0.5628	1917945	CBDivE_008324	Clc1ccc(/C=N/NC(=O)CSCc2ccccc2Br)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A05	compound treatment	1.241	0.0445	0.6	1.522	0.0922	1.26	1.3133	0.9426	1917946	CBDivE_008325	Brc1ccccc1C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A06	compound treatment	1.188	-0.00854	-0.12	1.4	-0.0298	-0.41	-0.3687	-0.8732	1917947	CBDivE_008326	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A07	compound treatment	1.206	0.00946	0.13	1.583	0.153	2.09	1.5676	0.7489	1917948	CBDivE_008327	C/C(=N/NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2ccc(NC(=O)CN3CCCCC3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A08	compound treatment	1.256	0.0595	0.8	1.542	0.112	1.53	1.6492	0.9546	1917949	CBDivE_008328	COc1cc(/C=N/c2ccc(O)c(c2)c3nc4cc(C)ccc4o3)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A09	compound treatment	1.24	0.0435	0.59	1.465	0.0352	0.48	0.7541	0.9951	1088489	CBDivE_008329	OC(=O)C1C(C2CCC1C=C2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A10	compound treatment	1.244	0.0475	0.64	1.411	-0.0188	-0.26	0.2716	0.3938	1917950	CBDivE_008330	[O-][N+](=O)c1ccc(cc1)c2nc(c([nH]2)c3ccc(cc3)c4[nH]c(nc4c5ccccc5)c6ccc(cc6)[N+](=O)[O-])c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A11	compound treatment	1.252	0.0555	0.75	1.488	0.0582	0.79	1.0904	0.9996	1917951	CBDivE_008331	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccn[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A12	compound treatment	1.206	0.00946	0.13	1.475	0.0452	0.62	0.5262	0.8358	1917952	CBDivE_008332	Ic1c(noc1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A13	compound treatment	1.266	0.0695	0.94	1.442	0.0122	0.17	0.7804	0.8199	1917953	CBDivE_008333	C/C(=N\NC(=O)COc1ccc(C)cc1C)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A14	compound treatment	1.203	0.00646	0.09	1.469	0.0392	0.53	0.4397	0.8116	1917954	CBDivE_008334	[O-][N+](=O)c1cccc(c1)c2nc(c([nH]2)c3ccc(cc3)c4[nH]c(nc4c5ccccc5)c6cccc(c6)[N+](=O)[O-])c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A15	compound treatment	1.227	0.0305	0.41	1.496	0.0662	0.9	0.929	0.9365	1917955	CBDivE_008335	[O-][N+](=O)c1cccc(NC(=O)C2CC=CCC2C(=O)NCC=C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A16	compound treatment	1.175	-0.0215	-0.29	1.44	0.0102	0.14	-0.107	-0.332	1917956	CBDivE_008336	Oc1ccccc1/C=N/N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A17	compound treatment	1.308	0.111	1.5	1.523	0.0932	1.27	1.9621	0.9965	1917957	CBDivE_008337	Oc1c(/C=N/NC(=O)CNc2ccc3ccccc3c2)cc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A18	compound treatment	1.228	0.0315	0.42	1.392	-0.0378	-0.52	-0.0642	-0.0962	1917958	CBDivE_008338	Oc1ccccc1C(=O)N/N=C/2\CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A19	compound treatment	1.231	0.0345	0.46	1.438	0.00821	0.11	0.4079	0.8531	1917959	CBDivE_008339	Cn1ccc(n1)C(=O)N/N=C/c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	A20	compound treatment	1.157	-0.0395	-0.53	1.443	0.0132	0.18	-0.2498	-0.4436	1472828	CBDivE_008340	COc1cccc(NC(=O)c2cccc(F)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B01	compound treatment	1.216	0.0195	0.26	1.373	-0.0568	-0.77	-0.3619	-0.4426	1917960	CBDivE_008341	Cc1cc([nH]n1)C(=O)N/N=C/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B02	compound treatment	1.255	0.0585	0.79	1.441	0.0112	0.15	0.6658	0.8288	1412025	CBDivE_008342	Clc1ccccc1S(=O)(=O)NC(=O)NC2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B03	compound treatment	1.199	0.00246	0.03	1.402	-0.0278	-0.38	-0.2445	-0.6427	1917961	CBDivE_008343	O=C1NC(=O)C(=Cc2c[nH]nc2c3ccccc3)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B04	compound treatment	1.211	0.0145	0.2	1.475	0.0452	0.62	0.5739	0.8875	1917962	CBDivE_008344	OC(=O)CCc1ccc2ccccc2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B05	compound treatment	1.168	-0.0285	-0.39	1.445	0.0152	0.21	-0.1256	-0.2871	1917963	CBDivE_008345	CCN(CC)C1CC(=O)N(C1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B06	compound treatment	1.132	-0.0645	-0.87	1.413	-0.0168	-0.23	-0.7775	-0.8637	1917964	CBDivE_008346	CCOC(=O)c1ccc2n(CC)c(C)[n+](CC)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B07	compound treatment	1.228	0.0315	0.42	1.463	0.0332	0.45	0.6204	0.9995	1917965	CBDivE_008347	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B08	compound treatment	1.275	0.0785	1.06	1.403	-0.0268	-0.37	0.4902	0.4378	1723668	CBDivE_008348	CN(C)c1ccc(cc1)c2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B09	compound treatment	1.158	-0.0385	-0.52	1.456	0.0262	0.36	-0.1149	-0.1821	1419299	CBDivE_008349	CN1CCCc2c(N)c3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B10	compound treatment	1.278	0.0815	1.1	1.476	0.0462	0.63	1.2227	0.9652	1917966	CBDivE_008350	OC(=O)c1cc(Cl)ccc1NS(=O)(=O)c2ccc(Br)c3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B11	compound treatment	1.18	-0.0165	-0.22	1.362	-0.0678	-0.92	-0.8114	-0.8533	1917967	CBDivE_008351	CC1(C)CN=C(S1)N2CCN(CC2)C3=NCC(C)(C)S3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B12	compound treatment	1.19	-0.00654	-0.09	1.425	-0.00479	-0.07	-0.1085	-0.989	1917968	CBDivE_008352	CCN(CC)CCCC(C)Nc1nc(/C=C/c2ccc(Br)cc2)nc3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B13	compound treatment	1.21	0.0135	0.18	1.338	-0.0918	-1.25	-0.7566	-0.5983	1584084	CBDivE_008353	CN1CCCCc2c(N)c3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B14	compound treatment	1.167	-0.0295	-0.4	1.488	0.0582	0.79	0.2795	0.3147	1917969	CBDivE_008354	ClC(=C/C=C/1\CCCc2ccc(=O)oc12)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B15	compound treatment	1.202	0.00546	0.07	1.409	-0.0208	-0.28	-0.1483	-0.5065	1333159	CBDivE_008355	OC(CN(c1ccccc1)c2ccccc2)CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B16	compound treatment	1.174	-0.0225	-0.3	1.453	0.0232	0.32	0.0088	0.0201	1402092	CBDivE_008356	Oc1ccccc1Cn2c(nc3ccccc23)c4ccccc4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B17	compound treatment	1.192	-0.00454	-0.06	1.447	0.0172	0.23	0.1227	0.5057	1303231	CBDivE_008357	CN(C)CC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B18	compound treatment	1.168	-0.0285	-0.39	1.487	0.0572	0.78	0.2794	0.3212	1917970	CBDivE_008358	OC(=O)c1cc(NN=Nc2cccc(c2)[N+](=O)[O-])cc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B19	compound treatment	1.17	-0.0265	-0.36	1.395	-0.0348	-0.47	-0.5886	-0.9904	1917971	CBDivE_008359	CC(NC(=O)C)c1ccc(CCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	B20	compound treatment	0.989	-0.208	-2.8	1.436	0.00621	0.08	-1.9199	-0.6854	1917972	CBDivE_008360	CC(=C)C(=O)Oc1ccccc1Oc2c(F)c(F)c(Oc3ccccc3OC(=O)C(=C)C)c(F)c2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C01	compound treatment	1.2	0.00346	0.05	1.413	-0.0168	-0.23	-0.1289	-0.5516	1917973	CBDivE_008361	Cc1ccc(OCC(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C02	compound treatment	1.198	0.00146	0.02	1.427	-0.00279	-0.04	-0.0129	-0.3023	1917974	CBDivE_008362	COc1ccc2ccccc2c1/C=N\NC(=O)COc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C03	compound treatment	1.331	0.134	1.81	1.431	0.00121	0.02	1.2944	0.7135	1917975	CBDivE_008363	Brc1ccc(cc1)c2csc(N/N=C/c3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C04	compound treatment	1.176	-0.0205	-0.28	1.394	-0.0358	-0.49	-0.541	-0.964	1917976	CBDivE_008364	Brc1ccccc1CSCC(=O)N/N=C/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C05	compound treatment	1.218	0.0215	0.29	1.505	0.0752	1.03	0.93	0.8726	1917977	CBDivE_008365	Brc1ccccc1CSCC(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C06	compound treatment	1.199	0.00246	0.03	1.5	0.0702	0.96	0.7005	0.7312	1669631	CBDivE_008366	OC(=O)CCCC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C07	compound treatment	1.259	0.0625	0.84	1.483	0.0532	0.73	1.1089	0.9972	1917978	CBDivE_008367	CN(C)c1ccc(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C08	compound treatment	1.21	0.0135	0.18	1.435	0.00521	0.07	0.1787	0.9162	1917979	CBDivE_008368	COc1cc(/C=N/c2ccc(O)c(c2)c3nc4ccccc4s3)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C09	compound treatment	1.23	0.0335	0.45	1.468	0.0382	0.52	0.6877	0.9974	1669960	CBDivE_008369	OC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C10	compound treatment	1.213	0.0165	0.22	1.487	0.0572	0.78	0.7087	0.8737	1917980	CBDivE_008370	CCCCCC(=O)N/N=C/c1cccc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C11	compound treatment	1.251	0.0545	0.73	1.436	0.00621	0.08	0.5794	0.7835	1917981	CBDivE_008371	Clc1ccc(OCC(=O)NC(=O)Oc2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C12	compound treatment	1.184	-0.0125	-0.17	1.434	0.00421	0.06	-0.079	-0.4422	1917982	CBDivE_008372	Clc1ccc(cc1)c2noc(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C13	compound treatment	1.232	0.0355	0.48	1.463	0.0332	0.45	0.6585	0.9996	1917983	CBDivE_008373	COc1cc(/C=N/NC(=O)CNc2ccccc2C)cc(I)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C14	compound treatment	1.231	0.0345	0.46	1.462	0.0322	0.44	0.6393	0.9996	1917984	CBDivE_008374	CCCCCC(=O)N/N=C/c1cc(ccc1O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C15	compound treatment	1.29	0.0935	1.26	1.492	0.0622	0.85	1.4914	0.9814	1917985	CBDivE_008375	C/C(=N\NS(=O)(=O)c1ccc(C)cc1)/CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C16	compound treatment	1.193	-0.00354	-0.05	1.469	0.0392	0.53	0.3443	0.6414	1917986	CBDivE_008376	CCOC(=O)c1[nH]c(C)c(/C(=N/O)/C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C17	compound treatment	1.214	0.0175	0.24	1.488	0.0582	0.79	0.7279	0.879	1917987	CBDivE_008377	Oc1c(I)cc(I)cc1/C=N/c2ccc3[nH]c(=O)[nH]c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C18	compound treatment	1.176	-0.0205	-0.28	1.458	0.0282	0.38	0.0761	0.1605	1917988	CBDivE_008378	CCCCCC(=O)N/N=C(\C)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C19	compound treatment	1.183	-0.0135	-0.18	1.465	0.0352	0.48	0.2104	0.4095	1917989	CBDivE_008379	CC(=O)Nc1ccc(Nc2c(cc(cc2[N+](=O)[O-])C(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	C20	compound treatment	1.188	-0.00854	-0.12	1.423	-0.00679	-0.09	-0.1469	-0.9941	1220954	CBDivE_008380	OC(C(=O)Nc1ccc(Cl)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D01	compound treatment	1.167	-0.0295	-0.4	1.362	-0.0678	-0.92	-0.9354	-0.9293	1917990	CBDivE_008381	Cc1cc([nH]n1)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D02	compound treatment	1.211	0.0145	0.2	1.379	-0.0508	-0.69	-0.3518	-0.4889	1917991	CBDivE_008382	CCCCOc1nc(N)nc(CC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D03	compound treatment	1.067	-0.13	-1.75	1.41	-0.0198	-0.27	-1.4265	-0.8067	1917992	CBDivE_008383	CC(=O)C1(C2C(C3c4ccccc41)C(=O)N(C2=O)c5ccccc5Cl)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D04	compound treatment	1.175	-0.0215	-0.29	1.39	-0.0398	-0.54	-0.5891	-0.9572	1917993	CBDivE_008384	CC(C)(C)S(=O)(=O)c1c(Br)cccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D05	compound treatment	1.128	-0.0685	-0.92	1.431	0.00121	0.02	-0.6421	-0.6943	1677502	CBDivE_008385	CN(C)N1C(=O)CC(C1=O)n2c(C)nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D06	compound treatment	1.241	0.0445	0.6	1.441	0.0112	0.15	0.5322	0.8599	1917994	CBDivE_008386	CCn1c(/C=C/N(C)c2ccccc2)[n+](CC)c3cc(ccc13)S(=O)(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D07	compound treatment	1.174	-0.0225	-0.3	1.45	0.0202	0.28	-0.0201	-0.049	1917995	CBDivE_008387	CN(C)N1C(=O)CC(NNc2ccccc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D08	compound treatment	1.002	-0.195	-2.62	1.406	-0.0238	-0.32	-2.0851	-0.7885	1917996	CBDivE_008388	CCN(CC)c1ccc2c(cc(=O)oc2c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D09	compound treatment	1.177	-0.0195	-0.26	1.399	-0.0308	-0.42	-0.4833	-0.9749	1243488	CBDivE_008389	Ic1ccccc1NC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D10	compound treatment	1.146	-0.0505	-0.68	1.432	0.00221	0.03	-0.4608	-0.6751	1138134	CBDivE_008390	CN1CCN(CC1)c2nnc(c3ccc(Cl)cc3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D11	compound treatment	1.163	-0.0335	-0.45	1.473	0.0432	0.59	0.0967	0.1302	1917997	CBDivE_008391	CN(C)CC(=O)Nc1cc(nc2ccccc12)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D12	compound treatment	1.209	0.0125	0.17	1.472	0.0422	0.58	0.5259	0.877	1031871	CBDivE_008392	Oc1ccc(Cl)cc1Cc2cc(Cl)cc(Cc3cc(Cl)ccc3O)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D13	compound treatment	1.259	0.0625	0.84	1.427	-0.00279	-0.04	0.569	0.6745	1917998	CBDivE_008393	CN(C)c1ccc(cc1)c2n(C)c3ccccc3[n+]2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D14	compound treatment	1.179	-0.0175	-0.24	1.379	-0.0508	-0.69	-0.657	-0.8977	1917999	CBDivE_008394	CCN(CC)CCOC(=O)NS(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D15	compound treatment	1.155	-0.0415	-0.56	1.446	0.0162	0.22	-0.2399	-0.3983	1273980	CBDivE_008395	CN(C)CC(O)Cn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D16	compound treatment	1.189	-0.00754	-0.1	1.367	-0.0628	-0.86	-0.6773	-0.7856	1918000	CBDivE_008396	CCOC(=O)C(=CNc1ccc(Cl)cn1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D17	compound treatment	1.164	-0.0325	-0.44	1.418	-0.0118	-0.16	-0.4241	-0.9071	1918001	CBDivE_008397	CC1(C)CN=C(S1)N2CCNCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D18	compound treatment	1.158	-0.0385	-0.52	1.421	-0.00879	-0.12	-0.4524	-0.8478	1918002	CBDivE_008398	Cc1ccc(NC2OCC(O)C(O)C2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D19	compound treatment	1.223	0.0265	0.36	1.475	0.0452	0.62	0.6884	0.9662	1918003	CBDivE_008399	CCC(=O)c1ccc(CCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	D20	compound treatment	1.187	-0.00954	-0.13	1.477	0.0472	0.64	0.3642	0.5548	1918004	CBDivE_008400	O=S(=O)(CCSc1nnc[nH]1)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E01	compound treatment	1.25	0.0535	0.72	1.408	-0.0218	-0.3	0.2999	0.3845	1918005	CBDivE_008401	Cc1nc([N+](=O)[O-])c(NCCO)n1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E02	compound treatment	1.191	-0.00554	-0.07	1.441	0.0112	0.15	0.0553	0.3248	1918006	CBDivE_008402	COc1ccc2ccccc2c1/C=N\NC(=O)COc3c(Cl)cc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E03	compound treatment	1.211	0.0145	0.2	1.438	0.00821	0.11	0.2171	0.9653	1918007	CBDivE_008403	Clc1ccc(cc1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E04	compound treatment	1.187	-0.00954	-0.13	1.456	0.0262	0.36	0.1618	0.4258	1918008	CBDivE_008404	Cc1ccccc1CSCC(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E05	compound treatment	1.242	0.0455	0.61	1.46	0.0302	0.41	0.725	0.9813	1918009	CBDivE_008405	OC(=O)C1C(C2CC1C=C2)C(=O)Nc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E06	compound treatment	1.152	-0.0445	-0.6	1.458	0.0282	0.38	-0.1528	-0.2142	1918010	CBDivE_008406	C/C(=N/NC(=O)C(O)c1ccccc1C)/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E07	compound treatment	1.198	0.00146	0.02	1.526	0.0962	1.31	0.9417	0.7176	1918011	CBDivE_008407	CC(=O)Nc1ccc(cc1)/C(=N\NC(=O)c2cccc(Br)c2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E08	compound treatment	1.208	0.0115	0.15	1.463	0.0332	0.45	0.4296	0.8976	1918012	CBDivE_008408	COc1nc(C)c([N+](=O)[O-])c(n1)N(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E09	compound treatment	1.307	0.11	1.49	1.488	0.0582	0.79	1.615	0.9565	1918013	CBDivE_008409	C/C(=N/NC(=S)N)/C(C)(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E10	compound treatment	1.208	0.0115	0.15	1.444	0.0142	0.19	0.2464	0.9937	1918014	CBDivE_008410	O=C(N/N=C/c1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E11	compound treatment	1.265	0.0685	0.92	1.489	0.0592	0.81	1.224	0.9978	1918015	CBDivE_008411	Clc1ccc(OC(=O)NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E12	compound treatment	1.179	-0.0175	-0.24	1.42	-0.00979	-0.13	-0.2617	-0.9633	1380870	CBDivE_008412	OC(C(=O)Nc1ccc(Cl)c(Cl)c1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E13	compound treatment	1.189	-0.00754	-0.1	1.405	-0.0248	-0.34	-0.3109	-0.8809	1918016	CBDivE_008413	Cc1nn(c(Cl)c1/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E14	compound treatment	1.149	-0.0475	-0.64	1.419	-0.0108	-0.15	-0.5575	-0.8473	1918017	CBDivE_008414	C/C(=N\NC(=O)Cc1c[nH]c2ccccc12)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E15	compound treatment	1.268	0.0715	0.96	1.445	0.0152	0.21	0.8284	0.84	1251049	CBDivE_008415	OCC(CO)(CO)N(CC1CCCCC1)CC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E16	compound treatment	1.194	-0.00254	-0.03	1.402	-0.0278	-0.38	-0.2922	-0.7679	1918018	CBDivE_008416	CCOC(=O)N/N=C/c1ccc2cc(OC)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E17	compound treatment	1.29	0.0935	1.26	1.513	0.0832	1.13	1.6939	0.9986	1918019	CBDivE_008417	Cc1c(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c3ccccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E18	compound treatment	1.201	0.00446	0.06	1.417	-0.0128	-0.17	-0.0807	-0.4378	1918020	CBDivE_008418	CCCCCC(=O)N/N=C/1\CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E19	compound treatment	1.28	0.0835	1.13	1.486	0.0562	0.77	1.3382	0.9824	1918021	CBDivE_008419	[O-][N+](=O)c1cn[nH]c1C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	E20	compound treatment	1.247	0.0505	0.68	1.46	0.0302	0.41	0.7727	0.9711	1716436	CBDivE_008420	Brc1ccc(o1)C(=O)N2CCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F01	compound treatment	1.158	-0.0385	-0.52	1.36	-0.0698	-0.95	-1.0406	-0.9596	1918022	CBDivE_008421	CCOC(=O)c1c(NC(=O)Cn2cnc3ccccc23)sc4CCCCc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F02	compound treatment	1.15	-0.0465	-0.63	1.376	-0.0538	-0.73	-0.9626	-0.997	1918023	CBDivE_008422	CC[n+]1c(/C=C/N(C)c2ccccc2)n(c3ccccc3)c4ccc(cc14)c5nc6ccccc6s5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F03	compound treatment	1.135	-0.0615	-0.83	1.401	-0.0288	-0.39	-0.8646	-0.9415	1918024	CBDivE_008423	CCOc1ccc(cc1)N2C(=O)C3C(C2=O)C4(C(=O)C)c5ccccc5C3c6ccccc64
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F04	compound treatment	1.209	0.0125	0.17	1.378	-0.0518	-0.71	-0.3805	-0.5241	1918025	CBDivE_008424	CCc1ccc(cc1)c2cnc(o2)c3cc[n+](Cc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F05	compound treatment	1.202	0.00546	0.07	1.453	0.0232	0.32	0.2759	0.849	1120520	CBDivE_008425	CN(C)N1C(=O)CC(C1=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F06	compound treatment	1.171	-0.0255	-0.34	1.422	-0.00779	-0.11	-0.3187	-0.884	1918026	CBDivE_008426	CC(C)(C)CC(C)(C)NC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F07	compound treatment	1.197	4.6E-4	0.01	1.351	-0.0788	-1.07	-0.7553	-0.703	1918027	CBDivE_008427	CN(C)N1C(=O)CC(NNc2ccc(C)cc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F08	compound treatment	1.21	0.0135	0.18	1.467	0.0372	0.51	0.4872	0.904	440	CBDivE_008428	COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F09	compound treatment	1.134	-0.0625	-0.84	1.419	-0.0108	-0.15	-0.7006	-0.818	1918028	CBDivE_008429	CCNC(=O)O/N=C(/C(=O)C(C)(C)C)\n1cncn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F10	compound treatment	1.181	-0.0155	-0.21	1.446	0.0162	0.22	0.0081	0.0266	1918029	CBDivE_008430	Clc1cc2Nc3cc(Cl)c(Cl)cc3Nc2cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F11	compound treatment	1.173	-0.0235	-0.32	1.426	-0.00379	-0.05	-0.2611	-0.8114	1918030	CBDivE_008431	CN(C)c1cc(NC(=O)C2(CC3CC4CC3C2)C4)c5ccccc5n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F12	compound treatment	1.065	-0.132	-1.77	1.423	-0.00679	-0.09	-1.3202	-0.743	1918031	CBDivE_008432	CC1=[N+](C)CCn2c(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F13	compound treatment	1.162	-0.0345	-0.47	1.443	0.0132	0.18	-0.2021	-0.4045	1918032	CBDivE_008433	O=C1C(C(=O)c2ccccc12)c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F14	compound treatment	1.175	-0.0215	-0.29	1.436	0.00621	0.08	-0.1456	-0.4809	1918033	CBDivE_008434	O=C(Nc1nc2ccccc2s1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F15	compound treatment	1.197	4.6E-4	0.01	1.475	0.0452	0.62	0.4404	0.7142	1918034	CBDivE_008435	C(N(Cc1ccccc1)/N=C/c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F16	compound treatment	1.16	-0.0365	-0.49	1.423	-0.00679	-0.09	-0.414	-0.8254	1918035	CBDivE_008436	OC(=O)C1C(C2C=CC1C32CC3)C(=O)Nc4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F17	compound treatment	1.156	-0.0405	-0.55	1.499	0.0692	0.94	0.2807	0.2573	1918036	CBDivE_008437	Fc1cccc(c1)N2N=C(CC2c3cccs3)/C=C/c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F18	compound treatment	1.21	0.0135	0.18	1.438	0.00821	0.11	0.2076	0.973	1918037	CBDivE_008438	CCOc1ccc(NC2OC(CO)C(O)C(O)C2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F19	compound treatment	0.866	-0.331	-4.46	1.46	0.0302	0.41	-2.8618	-0.6391	1353536	CBDivE_008439	Cn1c(ccc1C2=CC(C)(C)NC(C)(C)C2)C3=CC(C)(C)NC(C)(C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	F20	compound treatment	0.272	-0.925	-12.47	1.373	-0.0568	-0.77	-9.367	-0.7496	1918038	CBDivE_008440	Cc1ccc(cc1)N2C(=O)C3C4OC(CNC(=O)OCc5ccccc5)(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G01	compound treatment	1.216	0.0195	0.26	1.379	-0.0508	-0.69	-0.3041	-0.4105	1918039	CBDivE_008441	CC(C)(C)NCC(=O)Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G02	compound treatment	1.151	-0.0455	-0.61	1.388	-0.0418	-0.57	-0.8373	-0.9993	1918040	CBDivE_008442	[O-][N+](=O)c1ccccc1NC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G03	compound treatment	1.324	0.127	1.72	1.455	0.0252	0.34	1.459	0.832	1918041	CBDivE_008443	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G04	compound treatment	1.239	0.0425	0.57	1.438	0.00821	0.11	0.4842	0.8297	1918042	CBDivE_008444	CN(C)c1ccc(/C=N/NC(=O)CSCc2ccc(cc2)[N+](=O)[O-])cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G05	compound treatment	1.209	0.0125	0.17	1.43	2.13E-4	0.0	0.1209	0.7192	1918043	CBDivE_008445	CC(C)CCNC(=O)C(=O)NCc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G06	compound treatment	1.219	0.0225	0.3	1.468	0.0382	0.52	0.5827	0.9667	1918044	CBDivE_008446	Brc1ccc(cc1)c2csc(NC(=O)CN3CCCCC3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G07	compound treatment	1.217	0.0205	0.28	1.428	-0.00179	-0.02	0.1779	0.6422	1918045	CBDivE_008447	COc1ccc(NC(=N)NC(=N)Nc2c(C)n(C)n(c3ccccc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G08	compound treatment	1.189	-0.00754	-0.1	1.445	0.0152	0.21	0.0748	0.3236	1598243	CBDivE_008448	COc1cc(NC(=O)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c3ccccc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G09	compound treatment	1.228	0.0315	0.42	1.454	0.0242	0.33	0.5336	0.9923	1918046	CBDivE_008449	NC(CCCCCC(=O)O)C1CCCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G10	compound treatment	1.211	0.0145	0.2	1.471	0.0412	0.56	0.5353	0.8999	1918047	CBDivE_008450	CCOC(=O)C(=O)C1=CNC2C=CC=CC21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G11	compound treatment	1.267	0.0705	0.95	1.468	0.0382	0.52	1.0406	0.96	1918048	CBDivE_008451	COc1ccc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G12	compound treatment	1.168	-0.0285	-0.39	1.457	0.0272	0.37	-0.0098	-0.0184	1918049	CBDivE_008452	Brc1ccc(o1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G13	compound treatment	1.237	0.0405	0.55	1.487	0.0572	0.78	0.9376	0.9847	1918050	CBDivE_008453	Cc1cccc(NCC(=O)N/N=C/c2cc(N=Nc3ccccc3)ccc2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G14	compound treatment	1.199	0.00246	0.03	1.432	0.00221	0.03	0.0448	0.9989	1918051	CBDivE_008454	Ic1ccccc1C(=O)Nn2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G15	compound treatment	1.248	0.0515	0.69	1.528	0.0982	1.34	1.4379	0.9532	1918052	CBDivE_008455	FC1(F)C(F)(F)C(F)(F)C(F)(C(=O)Nc2ncccn2)C(F)(F)C1(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G16	compound treatment	1.202	0.00546	0.07	1.475	0.0452	0.62	0.4881	0.786	1918053	CBDivE_008456	C[n+]1oc(/C=C/c2ccccc2)cc1/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G17	compound treatment	1.249	0.0525	0.71	1.49	0.0602	0.82	1.081	0.9973	1161151	CBDivE_008457	Cc1cccc(NC(=O)C(Nc2cccc(C)c2)(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G18	compound treatment	1.227	0.0305	0.41	1.388	-0.0418	-0.57	-0.1124	-0.1599	1918054	CBDivE_008458	CCOC(=O)N/N=C(\C)/C(=N/O)/C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G19	compound treatment	1.26	0.0635	0.86	1.45	0.0202	0.28	0.8003	0.8898	1456642	CBDivE_008459	OC(=O)CCC(=O)Nc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	G20	compound treatment	1.217	0.0205	0.28	1.398	-0.0318	-0.43	-0.1113	-0.2166	1309619	CBDivE_008460	O=C(Nc1nc(cs1)c2ccccc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H01	compound treatment	1.152	-0.0445	-0.6	1.312	-0.118	-1.61	-1.5606	-0.91	1918055	CBDivE_008461	COc1cc(/C=N\NC(=O)c2cccc(Br)c2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H02	compound treatment	1.176	-0.0205	-0.28	1.416	-0.0138	-0.19	-0.3289	-0.9821	1266741	CBDivE_008462	CCOC(=O)c1nc(N)sc1C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H03	compound treatment	1.211	0.0145	0.2	1.369	-0.0608	-0.83	-0.4482	-0.5263	1918056	CBDivE_008463	CC(=O)C1(C2C(C3c4ccccc41)C(=O)N(C2=O)c5ccccc5[N+](=O)[O-])c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H04	compound treatment	1.216	0.0195	0.26	1.4	-0.0298	-0.41	-0.1016	-0.21	3015908	CBDivE_008464	CCc1ccc(cc1)c2cnc(o2)c3cc[n+](CC)cc3.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H05	compound treatment	1.127	-0.0695	-0.94	1.388	-0.0418	-0.57	-1.0663	-0.9714	1523750	CBDivE_008465	COc1ccc(cc1)c2nc3ccccc3nc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H06	compound treatment	1.198	0.00146	0.02	1.411	-0.0188	-0.26	-0.1672	-0.6508	1918058	CBDivE_008466	Oc1ccccc1C(=O)NNC(=S)NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H07	compound treatment	1.16	-0.0365	-0.49	1.38	-0.0498	-0.68	-0.8286	-0.9876	1724562	CBDivE_008467	CN(C)N1C(=O)CC(Nc2ccc(Br)cc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H08	compound treatment	1.208	0.0115	0.15	1.397	-0.0328	-0.45	-0.2068	-0.4372	1918059	CBDivE_008468	CC(C)c1ccc(C)cc1Oc2ccccc2NC(=O)c3cc(I)cc(I)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H09	compound treatment	1.123	-0.0735	-0.99	1.37	-0.0598	-0.82	-1.278	-0.9952	1688195	CBDivE_008469	CN(NC1CC(=O)N(C1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H10	compound treatment	1.199	0.00246	0.03	1.435	0.00521	0.07	0.0737	0.9399	1016554	CBDivE_008470	CCOC(=O)C(Cc1ccc(N)cc1)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H11	compound treatment	1.281	0.0845	1.14	1.343	-0.0868	-1.18	-0.0311	-0.019	1918060	CBDivE_008471	[O-][N+](=O)c1ccc(cc1)c2nc(c([nH]2)c3ccc4oc5ccc(cc5c4c3)c6[nH]c(nc6c7ccccc7)c8ccc(cc8)[N+](=O)[O-])c9ccccc9
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H12	compound treatment	1.215	0.0185	0.25	1.422	-0.00779	-0.11	0.101	0.3731	1918061	CBDivE_008472	CCCC1(CCCC1)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H13	compound treatment	1.234	0.0375	0.51	1.508	0.0782	1.07	1.1115	0.9418	1776772	CBDivE_008473	OC(=O)C1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H14	compound treatment	1.195	-0.00154	-0.02	1.427	-0.00279	-0.04	-0.0416	-0.9596	1918062	CBDivE_008474	[O-][N+](=O)c1cccc(/C=N/NC(=O)CN2CCOCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H15	compound treatment	1.162	-0.0345	-0.47	1.39	-0.0398	-0.54	-0.7131	-0.9971	1731718	CBDivE_008475	C1CN(CCN1C(c2ccccc2)c3ccccc3)C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H16	compound treatment	1.141	-0.0555	-0.75	1.447	0.0172	0.23	-0.3638	-0.4634	1918063	CBDivE_008476	Oc1ccc(/C=N/NC(=O)CN2CCOCC2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H17	compound treatment	1.179	-0.0175	-0.24	1.443	0.0132	0.18	-0.0399	-0.1342	1918064	CBDivE_008477	O=Cc1ccc(CCCCCCc2ccc(C=O)s2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H18	compound treatment	1.239	0.0425	0.57	1.373	-0.0568	-0.77	-0.1425	-0.148	1918065	CBDivE_008478	CCN/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H19	compound treatment	1.203	0.00646	0.09	1.48	0.0502	0.68	0.5458	0.7907	1918066	CBDivE_008479	COc1cc2ccccc2cc1C(=O)N/N=C\c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	H20	compound treatment	1.18	-0.0165	-0.22	1.423	-0.00679	-0.09	-0.2232	-0.9241	1918067	CBDivE_008480	COc1cc2ccccc2cc1C(=O)N/N=C/c3cc(C)ccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I01	compound treatment	1.143	-0.0535	-0.72	1.4	-0.0298	-0.41	-0.7979	-0.9629	1918068	CBDivE_008481	CN(C)/C=N/c1cc(nc2ccccc12)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I02	compound treatment	1.177	-0.0195	-0.26	1.408	-0.0218	-0.3	-0.3965	-0.9982	1135031	CBDivE_008482	Cc1ccc(cc1)N2CCN(C(=O)C2CC(=O)O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I03	compound treatment	1.241	0.0445	0.6	1.518	0.0882	1.2	1.2747	0.9483	1542833	CBDivE_008483	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2cc(Cl)cc(Cl)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I04	compound treatment	1.151	-0.0455	-0.61	1.395	-0.0348	-0.47	-0.7698	-0.9918	1918069	CBDivE_008484	OC(=O)C1C(C2C=CC1C32CC3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I05	compound treatment	1.211	0.0145	0.2	1.486	0.0562	0.77	0.68	0.8597	1445278	CBDivE_008485	COc1cccc(NCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I06	compound treatment	1.155	-0.0415	-0.56	1.429	-7.87E-4	-0.01	-0.4038	-0.7205	1918070	CBDivE_008486	CC/1CCCC\C1=N/NC(=O)C(O)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I07	compound treatment	1.243	0.0465	0.63	1.463	0.0332	0.45	0.7635	0.9873	1702203	CBDivE_008487	CN1CCN(CC1)N=Nc2c(C)n(C)n(c3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I08	compound treatment	1.232	0.0355	0.48	1.485	0.0552	0.75	0.8707	0.976	1918071	CBDivE_008488	CCCCCCOC(=O)N(P(=O)(OCCCCCC)OCCCCCC)P(=O)(OC(C)C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I09	compound treatment	1.229	0.0325	0.44	1.462	0.0322	0.44	0.6203	1.0	3015385	CBDivE_008489	NC1CCCc2sccc12.Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I10	compound treatment	1.195	-0.00154	-0.02	1.415	-0.0148	-0.2	-0.1573	-0.7758	1458934	CBDivE_008490	C1CN(CCN1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I11	compound treatment	1.28	0.0835	1.13	1.454	0.0242	0.33	1.0296	0.8775	1718560	CBDivE_008491	O=C(Nc1ncc(Cc2ccccc2)s1)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I12	compound treatment	1.159	-0.0375	-0.51	1.49	0.0602	0.82	0.2225	0.2306	1918072	CBDivE_008492	FC(F)(F)c1ccc(Cl)c(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I13	compound treatment	1.26	0.0635	0.86	1.446	0.0162	0.22	0.7617	0.8615	1536960	CBDivE_008493	CCOC(=O)c1cnc2cc(Cl)c(Oc3ccc(Cl)cc3)cc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I14	compound treatment	1.222	0.0255	0.34	1.415	-0.0148	-0.2	0.1003	0.2518	1918073	CBDivE_008494	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N/N=C\c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I15	compound treatment	1.26	0.0635	0.86	1.488	0.0582	0.79	1.1667	0.9993	1553273	CBDivE_008495	O=C(Cc1ccccc1)Nc2ccc(NC(=O)Cc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I16	compound treatment	1.18	-0.0165	-0.22	1.412	-0.0178	-0.24	-0.3293	-0.9991	1472648	CBDivE_008496	CN(C)c1cc(N)c2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I17	compound treatment	1.213	0.0165	0.22	1.507	0.0772	1.05	0.9015	0.8378	1918074	CBDivE_008497	Clc1c(sc2ccccc12)C(=O)N/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I18	compound treatment	1.196	-5.4E-4	-0.01	1.481	0.0512	0.7	0.4887	0.6997	1918075	CBDivE_008498	CN/1CCC\C1=C/c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I19	compound treatment	1.245	0.0485	0.65	1.416	-0.0138	-0.19	0.3293	0.4841	1918076	CBDivE_008499	CC(=O)c1ccc(NC(=O)Cn2cnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	I20	compound treatment	1.217	0.0205	0.28	1.432	0.00221	0.03	0.2165	0.7798	1085422	CBDivE_008500	Clc1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J01	compound treatment	1.158	-0.0385	-0.52	1.4	-0.0298	-0.41	-0.6549	-0.9925	1918077	CBDivE_008501	COc1cc(/C=N\NC(=O)c2ccc(cc2)[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J02	compound treatment	1.161	-0.0355	-0.48	1.427	-0.00279	-0.04	-0.3659	-0.7608	1918078	CBDivE_008502	Cc1scc(c2ccccc2)[n+]1CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J03	compound treatment	1.118	-0.0785	-1.06	1.355	-0.0748	-1.02	-1.4703	-0.9998	1918079	CBDivE_008503	[O-][N+](=O)c1cc2OCOc2cc1NN=C3C(=O)NC(=S)NC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J04	compound treatment	1.169	-0.0275	-0.37	1.436	0.00621	0.08	-0.2028	-0.5322	3106295	CBDivE_008504	Cc1ccc(cc1)S(=O)(=O)O.C[n+]1ccc(c2ncc(o2)c3ccccc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J05	compound treatment	1.159	-0.0375	-0.51	1.408	-0.0218	-0.3	-0.5682	-0.9677	1918081	CBDivE_008505	Oc1nc2ccccc2nc1C3=CNC4C=CC=CC43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J06	compound treatment	1.176	-0.0205	-0.28	1.361	-0.0688	-0.94	-0.8592	-0.8785	1371229	CBDivE_008506	O=S(=O)(N1CCOCC1)c2ccc(cc2)c3csc(Nc4cccc5ccccc45)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J07	compound treatment	1.189	-0.00754	-0.1	1.421	-0.00879	-0.12	-0.1566	-0.9967	1918082	CBDivE_008507	CN(C)N1C(=O)CC(NCc2ccccc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J08	compound treatment	1.226	0.0295	0.4	1.427	-0.00279	-0.04	0.2542	0.6366	1299315	CBDivE_008508	Clc1ccc(NS(=O)(=O)c2cccc3nsnc23)c(c1)C(=O)Nc4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J09	compound treatment	1.179	-0.0175	-0.24	1.434	0.00421	0.06	-0.1267	-0.5203	1918083	CBDivE_008509	O=C1CC(NCc2ccccc2)C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J10	compound treatment	1.15	-0.0465	-0.63	1.449	0.0192	0.26	-0.2587	-0.3803	1182042	CBDivE_008510	Oc1ccc(Cl)cc1C(=O)Nc2cc(Cl)ccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J11	compound treatment	1.197	4.6E-4	0.01	1.402	-0.0278	-0.38	-0.2635	-0.6954	1918084	CBDivE_008511	[O-][N+](=O)c1cccc(c1)c2nc(c([nH]2)c3ccc4oc5ccc(cc5c4c3)c6[nH]c(nc6c7ccccc7)c8cccc(c8)[N+](=O)[O-])c9ccccc9
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J12	compound treatment	1.157	-0.0395	-0.53	1.424	-0.00579	-0.08	-0.433	-0.803	1918085	CBDivE_008512	Cc1ccc2-c3c(C)c(cn3CCn12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J13	compound treatment	1.22	0.0235	0.32	1.383	-0.0468	-0.64	-0.2273	-0.3192	1918086	CBDivE_008513	C1C(=Cn2c3ccccc3c4ccccc24)CC1=Cn5c6ccccc6c7ccccc57
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J14	compound treatment	1.189	-0.00754	-0.1	1.346	-0.0838	-1.14	-0.8798	-0.767	1918087	CBDivE_008514	Oc1ccc(/C=N/NC(=O)CCCc2ccccc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J15	compound treatment	0.281	-0.916	-12.35	1.45	0.0202	0.28	-8.5387	-0.6912	1435313	CBDivE_008515	O=C(CCN1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J16	compound treatment	0.27	-0.927	-12.5	1.449	0.0192	0.26	-8.6533	-0.6921	1918088	CBDivE_008516	C/C(=N\NC(=O)CN1CCOCC1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J17	compound treatment	1.153	-0.0435	-0.59	1.44	0.0102	0.14	-0.3169	-0.5249	1596952	CBDivE_008517	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J18	compound treatment	1.113	-0.0835	-1.13	1.426	-0.00379	-0.05	-0.8334	-0.7387	1918089	CBDivE_008518	OC(=O)CC(N1C(=O)/C(=C/C=C/c2ccc(cc2)[N+](=O)[O-])/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J19	compound treatment	1.149	-0.0475	-0.64	1.462	0.0322	0.44	-0.1429	-0.1838	1918090	CBDivE_008519	O=C(NNc1ccccn1)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	J20	compound treatment	1.214	0.0175	0.24	1.457	0.0272	0.37	0.429	0.9759	1918091	CBDivE_008520	OC(=O)/C=C/c1ccc(o1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K01	compound treatment	1.218	0.0215	0.29	1.408	-0.0218	-0.3	-0.0054	-0.0129	1464216	CBDivE_008521	Nc1c2CCN(C3CCCCC3)c2nc4ccc(Br)cc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K02	compound treatment	1.198	0.00146	0.02	1.414	-0.0158	-0.22	-0.1383	-0.6397	1043460	CBDivE_008522	COC(=O)c1ccccc1NC(c2ccccc2)c3ccc4cccnc4c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K03	compound treatment	1.226	0.0295	0.4	1.459	0.0292	0.4	0.5627	1.0	1918092	CBDivE_008523	O=C(N/N=C/c1ccccn1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K04	compound treatment	1.189	-0.00754	-0.1	1.4	-0.0298	-0.41	-0.3591	-0.8577	1918093	CBDivE_008524	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K05	compound treatment	1.269	0.0725	0.98	1.445	0.0152	0.21	0.8379	0.8385	1918094	CBDivE_008525	Oc1ccccc1/C=N/NC(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K06	compound treatment	1.173	-0.0235	-0.32	1.42	-0.00979	-0.13	-0.3189	-0.9258	1918095	CBDivE_008526	C/C(=N\NC(=O)c1ccc(Br)cc1)/c2ccc(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K07	compound treatment	1.222	0.0255	0.34	1.441	0.0112	0.15	0.351	0.9336	1918096	CBDivE_008527	COc1ccc(OC)c(c1)c2n(C)c3ccccc3[n+]2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K08	compound treatment	1.184	-0.0125	-0.17	1.422	-0.00779	-0.11	-0.1947	-0.9748	1918097	CBDivE_008528	COc1ccc(/C=N/OC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K09	compound treatment	1.192	-0.00454	-0.06	1.48	0.0502	0.68	0.4409	0.6413	1411726	CBDivE_008529	COc1ccc(OC)c(c1)C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K10	compound treatment	1.212	0.0155	0.21	1.456	0.0262	0.36	0.4002	0.9671	1642761	CBDivE_008530	CCN(CC)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K11	compound treatment	1.218	0.0215	0.29	1.417	-0.0128	-0.17	0.0814	0.2409	1918098	CBDivE_008531	COc1cc(/C=N/NC(=O)CNc2cccc(C)c2)cc(I)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K12	compound treatment	1.177	-0.0195	-0.26	1.41	-0.0198	-0.27	-0.3772	-0.9999	1519768	CBDivE_008532	Ic1ccc(NC(=O)C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K13	compound treatment	1.22	0.0235	0.32	1.462	0.0322	0.44	0.5344	0.9871	1918099	CBDivE_008533	OS(=O)(=O)C1CCCCC1C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K14	compound treatment	1.156	-0.0405	-0.55	1.457	0.0272	0.37	-0.1243	-0.1881	1774501	CBDivE_008534	OC(=O)c1cc(ccc1C(=O)Nc2ccc3ccccc3c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K15	compound treatment	1.256	0.0595	0.8	1.565	0.135	1.84	1.871	0.9305	1918100	CBDivE_008535	O=C(Nc1cc2ccccc2cc1NC(=O)/C=C/c3ccco3)/C=C/c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K16	compound treatment	1.225	0.0285	0.38	1.468	0.0382	0.52	0.64	0.9887	1045432	CBDivE_008536	Cc1onc(c1C(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K17	compound treatment	1.233	0.0365	0.49	1.419	-0.0108	-0.15	0.2438	0.4749	1918101	CBDivE_008537	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K18	compound treatment	1.186	-0.0105	-0.14	1.391	-0.0388	-0.53	-0.4745	-0.8664	1918102	CBDivE_008538	CCCCOc1ccc(/C=N/Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K19	compound treatment	1.248	0.0515	0.69	1.508	0.0782	1.07	1.2451	0.9784	1096152	CBDivE_008539	Nc1ccccc1NC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	K20	compound treatment	1.231	0.0345	0.46	1.475	0.0452	0.62	0.7647	0.9903	1918103	CBDivE_008540	CCN(CC)CCn1c2ccccc2c3nc4ccc(cc4cc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L01	compound treatment	1.152	-0.0445	-0.6	1.398	-0.0318	-0.43	-0.7314	-0.9872	1918104	CBDivE_008541	COc1cc(/C=N\NC(=O)c2ccncc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L02	compound treatment	1.149	-0.0475	-0.64	1.35	-0.0798	-1.09	-1.2228	-0.9682	3015476	CBDivE_008542	C[N+]1=C(SCC1)/C=C/Nc2ccccc2.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L03	compound treatment	1.217	0.0205	0.28	1.402	-0.0278	-0.38	-0.0728	-0.1552	1918106	CBDivE_008543	CCC(C)(C)c1ccc(OCCCC(=O)Nc2ccc3nc(C)sc3c2)c(c1)C(C)(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L04	compound treatment	1.131	-0.0655	-0.88	1.375	-0.0548	-0.75	-1.1535	-0.9965	1918107	CBDivE_008544	CC[n+]1c(C)n(c2ccccc2)c3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L05	compound treatment	1.088	-0.109	-1.46	1.422	-0.00779	-0.11	-1.1105	-0.7564	1918108	CBDivE_008545	[O-][N+](=O)c1ccc(cc1)c2csc(N/N=C/c3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L06	compound treatment	1.192	-0.00454	-0.06	1.374	-0.0558	-0.76	-0.5812	-0.7616	1191305	CBDivE_008546	CCN(CC)S(=O)(=O)c1ccc(cc1)c2csc(Nc3cccc4ccccc34)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L07	compound treatment	1.149	-0.0475	-0.64	1.406	-0.0238	-0.32	-0.6829	-0.9501	1918109	CBDivE_008547	CN(C)NC(=O)CC1Nc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L08	compound treatment	1.146	-0.0505	-0.68	1.44	0.0102	0.14	-0.3836	-0.5513	1776897	CBDivE_008548	CC(C)c1ccc(C)cc1Oc2ccc(Cl)cc2NC(=O)c3cc(Cl)cc(Cl)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L09	compound treatment	1.183	-0.0135	-0.18	1.408	-0.0218	-0.3	-0.3392	-0.9727	1071558	CBDivE_008549	O=C1CC(N2CC2)C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L10	compound treatment	1.168	-0.0285	-0.39	1.382	-0.0478	-0.65	-0.733	-0.9685	1359067	CBDivE_008550	Oc1ccc(Cl)cc1C(=O)Nc2ccc(C(=O)c3ccc(Cl)cc3)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L11	compound treatment	1.162	-0.0345	-0.47	1.381	-0.0488	-0.67	-0.7999	-0.9848	1918110	CBDivE_008551	Brc1ccc(cc1)c2nc(c([nH]2)c3ccc(cc3)c4[nH]c(nc4c5ccccc5)c6ccc(Br)cc6)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L12	compound treatment	1.17	-0.0265	-0.36	1.397	-0.0328	-0.45	-0.5693	-0.9939	1918111	CBDivE_008552	Oc1cc([nH]n1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L13	compound treatment	1.204	0.00746	0.1	1.377	-0.0528	-0.72	-0.4378	-0.6024	1248209	CBDivE_008553	CC(=C)CNC(=S)N1CCNCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L14	compound treatment	1.194	-0.00254	-0.03	1.396	-0.0338	-0.46	-0.35	-0.7576	1918112	CBDivE_008554	COc1ccc(/C=N/NC(=O)CSCc2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L15	compound treatment	1.2	0.00346	0.05	1.362	-0.0678	-0.92	-0.6206	-0.6705	1495068	CBDivE_008555	O=c1[nH]nc(Cc2ccncc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L16	compound treatment	1.166	-0.0305	-0.41	1.404	-0.0258	-0.35	-0.54	-0.9969	1918113	CBDivE_008556	O=C(CN1CCCCC1)N/N=C/c2ccccc2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L17	compound treatment	1.188	-0.00854	-0.12	1.431	0.00121	0.02	-0.0698	-0.5994	1497765	CBDivE_008557	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L18	compound treatment	1.161	-0.0355	-0.48	1.397	-0.0328	-0.45	-0.6552	-0.9994	1918114	CBDivE_008558	CO/C(=N\C(NC(=S)N1CCOCC1)C(Cl)(Cl)Cl)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L19	compound treatment	1.201	0.00446	0.06	1.474	0.0442	0.6	0.4689	0.7738	1918115	CBDivE_008559	O=S(=O)(N/N=C/c1c[nH]c2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	L20	compound treatment	1.148	-0.0485	-0.65	1.464	0.0342	0.47	-0.1331	-0.1656	1918116	CBDivE_008560	[O-][N+](=O)c1ccc(cc1)c2ccc(C=C3C(=O)NC(=O)NC3=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M01	compound treatment	1.246	0.0495	0.67	1.399	-0.0308	-0.42	0.175	0.2219	1918117	CBDivE_008561	Fc1c(F)c(F)c(C(=O)NCc2ccco2)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M02	compound treatment	1.163	-0.0335	-0.45	1.391	-0.0388	-0.53	-0.6939	-0.997	1338650	CBDivE_008562	CC1OC(Nc2ccc(C)c(C)c2)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M03	compound treatment	1.228	0.0315	0.42	1.409	-0.0208	-0.28	0.0997	0.1953	1918118	CBDivE_008563	CCOc1ccc(/C=N/NC(=O)COc2cccc(C)c2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M04	compound treatment	1.16	-0.0365	-0.49	1.433	0.00321	0.04	-0.3176	-0.6417	1918119	CBDivE_008564	COc1ccc(OCC(=O)N/N=C\c2c(OC)ccc3ccccc23)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M05	compound treatment	1.322	0.125	1.69	1.384	-0.0458	-0.62	0.7553	0.4187	1918120	CBDivE_008565	Oc1ccc2ccccc2c1N=Nc3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M06	compound treatment	1.17	-0.0265	-0.36	1.438	0.00821	0.11	-0.174	-0.4638	1918121	CBDivE_008566	FC(F)(F)c1ccccc1NC(=O)c2ccc(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M07	compound treatment	1.235	0.0385	0.52	1.451	0.0212	0.29	0.5714	0.9619	1918122	CBDivE_008567	Cc1c(/N=C/c2ccc(F)cc2)c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M08	compound treatment	1.201	0.00446	0.06	1.401	-0.0288	-0.39	-0.235	-0.5918	1918123	CBDivE_008568	Fc1c(F)c(F)c(C(=O)N2CCCCCC2)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M09	compound treatment	1.254	0.0575	0.78	1.445	0.0152	0.21	0.6948	0.8659	1918124	CBDivE_008569	Clc1ccc(OC(=O)NC(=O)COc2cc(Cl)c(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M10	compound treatment	1.22	0.0235	0.32	1.464	0.0342	0.47	0.5537	0.9821	1918125	CBDivE_008570	[O-][N+](=O)c1cccc(c1)c2nc(no2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M11	compound treatment	1.165	-0.0315	-0.43	1.441	0.0112	0.15	-0.1927	-0.4263	1918126	CBDivE_008571	COc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M12	compound treatment	1.191	-0.00554	-0.07	1.395	-0.0348	-0.47	-0.3883	-0.8085	1918127	CBDivE_008572	Clc1cccc(NC(=O)c2ccccc2C(=O)Nc3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M13	compound treatment	1.206	0.00946	0.13	1.479	0.0492	0.67	0.5648	0.8268	1918128	CBDivE_008573	COC(=O)C(C(/C=C/c1ccccc1)S(=O)(=O)O)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M14	compound treatment	1.217	0.0205	0.28	1.409	-0.0208	-0.28	-0.0053	-0.0133	1061386	CBDivE_008574	CCOP(=O)(CCC(=O)OC)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M15	compound treatment	1.262	0.0655	0.88	1.398	-0.0318	-0.43	0.3179	0.3232	1422191	CBDivE_008575	Clc1cccc(Cl)c1NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M16	compound treatment	1.173	-0.0235	-0.32	1.455	0.0252	0.34	0.0186	0.0397	1918129	CBDivE_008576	OS(=O)(=O)c1ccc(N/N=C/2\CCc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M17	compound treatment	1.309	0.112	1.52	1.487	0.0572	0.78	1.6245	0.9522	1918130	CBDivE_008577	C/C(=N\NC(=O)c1sc2ccccc2c1Cl)/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M18	compound treatment	1.206	0.00946	0.13	1.426	-0.00379	-0.05	0.0537	0.3903	1918131	CBDivE_008578	Fc1cccc(c1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M19	compound treatment	1.274	0.0775	1.04	1.535	0.105	1.43	1.7534	0.9879	1181200	CBDivE_008579	COC(=O)C1=C(C)NC(=C(C1C(=O)O)C(=O)OC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	M20	compound treatment	1.207	0.0105	0.14	1.462	0.0322	0.44	0.4104	0.8895	1918132	CBDivE_008580	Cc1cc([nH]n1)C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N01	compound treatment	1.152	-0.0445	-0.6	1.373	-0.0568	-0.77	-0.9724	-0.9921	1918133	CBDivE_008581	COc1ccc(/C=N\NC(=O)c2cc3ccccc3cc2OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N02	compound treatment	1.118	-0.0785	-1.06	1.371	-0.0588	-0.8	-1.3161	-0.9905	1918134	CBDivE_008582	C[N+]1=C(CCC1)/C=C/Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N03	compound treatment	1.18	-0.0165	-0.22	1.355	-0.0748	-1.02	-0.8789	-0.8419	1918135	CBDivE_008583	COc1cc2ccccc2cc1C(=O)N/N=C/c3cccc(CC=C)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N04	compound treatment	1.165	-0.0315	-0.43	1.314	-0.116	-1.58	-1.4173	-0.8667	1918136	CBDivE_008584	CCn1c(C)[n+](CC=C)c2cc(Cl)c(Cl)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N05	compound treatment	1.213	0.0165	0.22	1.378	-0.0518	-0.71	-0.3423	-0.4624	1918137	CBDivE_008585	CC(=O)N/N=C(\C)/c1ccc(NC(=O)c2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N06	compound treatment	1.196	-5.4E-4	-0.01	1.372	-0.0578	-0.79	-0.5624	-0.7136	1712932	CBDivE_008586	O=S(=O)(N1CCCCC1)c2ccc(cc2)c3csc(Nc4cccc5ccccc45)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N07	compound treatment	1.127	-0.0695	-0.94	1.417	-0.0128	-0.17	-0.7867	-0.8244	1197120	CBDivE_008587	CN(C)N1C(=O)CC(C1=O)n2nccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N08	compound treatment	1.129	-0.0675	-0.91	1.35	-0.0798	-1.09	-1.4136	-0.9961	1778179	CBDivE_008588	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc(Oc3ccc(Cl)c4cccnc34)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N09	compound treatment	1.168	-0.0285	-0.39	1.377	-0.0528	-0.72	-0.7812	-0.957	1918138	CBDivE_008589	CN(C)N1C(=O)CC(N2CCN(CC2)C3CC(=O)N(N(C)C)C3=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N10	compound treatment	1.164	-0.0325	-0.44	1.383	-0.0468	-0.64	-0.7615	-0.9834	1918139	CBDivE_008590	Oc1c(I)cc(Cl)cc1C(=O)Nc2cc(Cl)ccc2Oc3ccc4ccccc4c3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N11	compound treatment	1.17	-0.0265	-0.36	1.394	-0.0358	-0.49	-0.5982	-0.9884	1918140	CBDivE_008591	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N12	compound treatment	1.127	-0.0695	-0.94	1.366	-0.0638	-0.87	-1.2784	-0.9993	1918141	CBDivE_008592	CCc1[n+](CC#C)ccn2c(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N13	compound treatment	1.184	-0.0125	-0.17	1.377	-0.0528	-0.72	-0.6286	-0.8501	1918142	CBDivE_008593	Oc1ccc(/C=N/N(Cc2ccccc2)Cc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N14	compound treatment	1.174	-0.0225	-0.3	1.398	-0.0318	-0.43	-0.5215	-0.985	1918143	CBDivE_008594	Brc1ccc(/C=N/NC(=O)CSCc2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N15	compound treatment	1.172	-0.0245	-0.33	1.378	-0.0518	-0.71	-0.7334	-0.9404	1918144	CBDivE_008595	Cc1ccc(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N16	compound treatment	1.215	0.0185	0.25	1.388	-0.0418	-0.57	-0.2268	-0.3648	1918145	CBDivE_008596	Cc1cccc(c1)C2(CC2C(=O)N/N=C/c3ccccc3O)c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N17	compound treatment	1.101	-0.0955	-1.29	1.404	-0.0258	-0.35	-1.16	-0.8683	1918146	CBDivE_008597	C(COc1cccc2cccnc12)Oc3ccccc3OCCOc4cccc5cccnc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N18	compound treatment	1.22	0.0235	0.32	1.393	-0.0368	-0.5	-0.1309	-0.2207	1918147	CBDivE_008598	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N19	compound treatment	1.166	-0.0305	-0.41	1.472	0.0422	0.58	0.1157	0.1635	1918148	CBDivE_008599	Cc1nc(N)nc(N/N=C/c2cccc(c2)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	N20	compound treatment	1.185	-0.0115	-0.16	1.412	-0.0178	-0.24	-0.2816	-0.977	1918149	CBDivE_008600	[O-][N+](=O)c1cc(ccc1NS(=O)(=O)c2ccc(Cl)cc2)S(=O)(=O)c3ccc(NS(=O)(=O)c4ccc(Cl)cc4)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O01	compound treatment	1.242	0.0455	0.61	1.482	0.0522	0.71	0.9371	0.9972	1918150	CBDivE_008601	Cc1nc2nc([nH]c2cc1Br)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O02	compound treatment	1.146	-0.0505	-0.68	1.427	-0.00279	-0.04	-0.509	-0.7454	1780918	CBDivE_008602	CC1OC(Nc2cc(ccc2C)[N+](=O)[O-])C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O03	compound treatment	1.199	0.00246	0.03	1.48	0.0502	0.68	0.5076	0.7405	1918151	CBDivE_008603	CCOc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O04	compound treatment	1.239	0.0425	0.57	1.413	-0.0168	-0.23	0.2432	0.3942	1918152	CBDivE_008604	CC(=O)c1ccc(NC(=O)CCCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O05	compound treatment	1.244	0.0475	0.64	1.462	0.0322	0.44	0.7634	0.9831	1918153	CBDivE_008605	Cc1nc2sc3CCCCc3c2c(=O)n1/N=C/c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O06	compound treatment	1.197	4.6E-4	0.01	1.412	-0.0178	-0.24	-0.1671	-0.6888	1918154	CBDivE_008606	COc1cc(/C=N/NC(=O)Cc2ccc(Br)c3ccccc23)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O07	compound treatment	1.222	0.0255	0.34	1.404	-0.0258	-0.35	-0.0058	-0.0117	1918155	CBDivE_008607	Cn1ncc(/N=C/c2c(O)ccc3ccccc23)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O08	compound treatment	1.204	0.00746	0.1	1.446	0.0162	0.22	0.2275	0.9365	1918156	CBDivE_008608	FC(F)C(=O)N1CCN(CC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O09	compound treatment	1.262	0.0655	0.88	1.456	0.0262	0.36	0.8772	0.9208	1918157	CBDivE_008609	Clc1ccc(Oc2ccc(NC(=O)NC(=O)COc3cc(Cl)c(Cl)cc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O10	compound treatment	1.148	-0.0485	-0.65	1.415	-0.0148	-0.2	-0.6056	-0.8839	1918158	CBDivE_008610	[O-][N+](=O)c1ccc(cc1)c2nc(no2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O11	compound treatment	1.289	0.0925	1.25	1.449	0.0192	0.26	1.0673	0.8374	1918159	CBDivE_008611	Cn1ncc(C(=O)c2ccccc2)c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O12	compound treatment	1.229	0.0325	0.44	1.444	0.0142	0.19	0.4467	0.9328	1918160	CBDivE_008612	CCCCCC(=O)N/N=C/c1ccc(O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O13	compound treatment	1.23	0.0335	0.45	1.432	0.00221	0.03	0.3405	0.7527	1232024	CBDivE_008613	CC(=O)Oc1ccc(cc1)S(=NS(=O)(=O)c2ccccc2)c3ccc(OC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O14	compound treatment	1.173	-0.0235	-0.32	1.407	-0.0228	-0.31	-0.4443	-0.9999	1918161	CBDivE_008614	CCCCCC(=O)N/N=C/c1ccc2cc(OC)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O15	compound treatment	1.249	0.0525	0.71	1.527	0.0972	1.33	1.4378	0.9568	1918162	CBDivE_008615	Clc1cccc(Cl)c1/C=N/NC(=O)CNc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O16	compound treatment	1.21	0.0135	0.18	1.432	0.00221	0.03	0.1497	0.8135	1918163	CBDivE_008616	Fc1ccccc1/C=N/NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O17	compound treatment	1.244	0.0475	0.64	1.549	0.119	1.63	1.6022	0.917	1918164	CBDivE_008617	FC(F)(F)C(=O)NNC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O18	compound treatment	1.187	-0.00954	-0.13	1.465	0.0352	0.48	0.2485	0.4999	1918165	CBDivE_008618	COc1ccc(/C=C/C(=O)NCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O19	compound treatment	1.279	0.0825	1.11	1.508	0.0782	1.07	1.5408	0.9998	1918166	CBDivE_008619	Cc1cccc(C)c1OCC(=O)N/N=C/c2cc(N=Nc3ccccc3)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	O20	compound treatment	1.146	-0.0505	-0.68	1.467	0.0372	0.51	-0.1233	-0.1451	1918167	CBDivE_008620	Oc1ccc(cc1)C(=O)N/N=C\c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P01	compound treatment	1.199	0.00246	0.03	1.41	-0.0198	-0.27	-0.1673	-0.6155	1288538	CBDivE_008621	COc1ccc(NC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P02	compound treatment	1.188	-0.00854	-0.12	1.378	-0.0518	-0.71	-0.5808	-0.8117	1918168	CBDivE_008622	CSc1sc(SC)c(C=O)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P03	compound treatment	1.213	0.0165	0.22	1.309	-0.121	-1.65	-1.0077	-0.6063	1918169	CBDivE_008623	C1C/C(=N/Nc2ccccc2)/Nc3ccccc3C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P04	compound treatment	1.125	-0.0715	-0.97	1.392	-0.0378	-0.52	-1.0468	-0.9568	1918170	CBDivE_008624	CCn1c(/C=C/Nc2ccccc2)[n+](CC)c3cc(Cl)c(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P05	compound treatment	1.143	-0.0535	-0.72	1.398	-0.0318	-0.43	-0.8172	-0.9702	1918171	CBDivE_008625	C/C(=N\NC(=O)c1ccccc1O)/c2ccc(NC(=O)c3ccc(C)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P06	compound treatment	1.143	-0.0535	-0.72	1.36	-0.0698	-0.95	-1.1836	-0.9907	1918172	CBDivE_008626	Brc1ccc(cc1)c2csc(Nc3cccc4ccccc34)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P07	compound treatment	1.159	-0.0375	-0.51	1.385	-0.0448	-0.61	-0.79	-0.9957	1448740	CBDivE_008627	CN(C)N1C(=O)CC(C1=O)n2ccnc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P08	compound treatment	1.214	0.0175	0.24	1.44	0.0102	0.14	0.265	0.9686	1918173	CBDivE_008628	CCN(CC)CCCC(C)Nc1cc(/C=C/c2ccc(cc2)[N+](=O)[O-])nc3ccc(OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P09	compound treatment	1.093	-0.104	-1.4	1.295	-0.135	-1.84	-2.2874	-0.9908	1918174	CBDivE_008629	O=C1CC(N2CCCCCC2)C(=O)N1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P10	compound treatment	0.605	-0.592	-7.98	0.858	-0.572	-7.8	-11.1563	-0.9999	1442757	CBDivE_008630	COC(=O)NC(=S)Nc1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P11	compound treatment	1.163	-0.0335	-0.45	1.395	-0.0348	-0.47	-0.6554	-0.9997	1474780	CBDivE_008631	CCN(CC)CC(O)Cn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P12	compound treatment	1.14	-0.0565	-0.76	1.329	-0.101	-1.37	-1.5112	-0.9614	1918175	CBDivE_008632	CCc1ccc(SC(CC(=O)c2ccccc2)c3cccc(c3)[N+](=O)[O-])s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P13	compound treatment	1.182	-0.0145	-0.2	1.403	-0.0268	-0.37	-0.397	-0.9575	1918176	CBDivE_008633	O=C(Cc1ccccc1)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P14	compound treatment	1.166	-0.0305	-0.41	1.421	-0.00879	-0.12	-0.3761	-0.8764	1918177	CBDivE_008634	COc1ccccc1/C=N/NC(=O)CSCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P15	compound treatment	1.226	0.0295	0.4	1.416	-0.0138	-0.19	0.1481	0.3368	1404995	CBDivE_008635	OCC(O)CN(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P16	compound treatment	1.161	-0.0355	-0.48	1.399	-0.0308	-0.42	-0.6359	-0.9978	1918178	CBDivE_008636	Cc1ccc(NC(=O)C2C(C3CC2C=C3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P17	compound treatment	1.152	-0.0445	-0.6	1.354	-0.0758	-1.03	-1.1556	-0.9667	1918179	CBDivE_008637	COC(=O)C(CCCCCNC(=O)C)NC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P18	compound treatment	1.099	-0.0975	-1.32	1.433	0.00321	0.04	-0.8995	-0.6832	1918180	CBDivE_008638	COc1ccccc1NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P19	compound treatment	1.197	4.6E-4	0.01	1.399	-0.0308	-0.42	-0.2925	-0.6966	1776965	CBDivE_008639	[O-][N+](=O)c1ccccc1S(=O)(=O)NC2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.27	P20	compound treatment	1.179	-0.0175	-0.24	1.388	-0.0418	-0.57	-0.5702	-0.9242	1918181	CBDivE_008640	Clc1ccc(NC(=O)OCCNS(=O)(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A01	compound treatment	1.235	0.026	0.35	1.421	-0.0171	-0.23	0.083	0.1974	1918182	CBDivE_008641	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNC(C)(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A02	compound treatment	1.233	0.024	0.32	1.437	-0.00108	-0.01	0.2182	0.6741	1918183	CBDivE_008642	CC(Nc1c(cc([N+](=O)[O-])c2ccccc12)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A03	compound treatment	1.232	0.023	0.31	1.45	0.0119	0.16	0.3341	0.9546	1192475	CBDivE_008643	Cc1ccc2n(C)c3C(O)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A04	compound treatment	1.247	0.038	0.51	1.43	-0.00808	-0.11	0.2843	0.5425	1918184	CBDivE_008644	OC(=O)CCCNc1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A05	compound treatment	1.28	0.071	0.96	1.491	0.0529	0.72	1.1873	0.9903	1504388	CBDivE_008645	CC1(C)Oc2ccccc2C3CC(=NN31)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A06	compound treatment	1.203	-0.00603	-0.08	1.382	-0.0561	-0.76	-0.5983	-0.7779	1264518	CBDivE_008646	COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A07	compound treatment	1.262	0.053	0.71	1.565	0.127	1.73	1.7291	0.9235	1918185	CBDivE_008647	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNCCO)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A08	compound treatment	1.259	0.05	0.67	1.549	0.111	1.51	1.5462	0.9337	1507580	CBDivE_008648	O=S(=O)(c1ccccc1)c2ccc(cc2)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A09	compound treatment	1.261	0.052	0.7	1.42	-0.0181	-0.25	0.3214	0.4324	1390016	CBDivE_008649	O=C(CC1(CC2CC3C1)CC(CC(=O)N4CCCCC4)(C2)C3)N5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A10	compound treatment	1.251	0.042	0.57	1.437	-0.00108	-0.01	0.39	0.6884	1918186	CBDivE_008650	COc1ccc(NSc2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A11	compound treatment	1.167	-0.042	-0.57	1.538	0.0999	1.36	0.5625	0.3812	1147219	CBDivE_008651	CC(C)OC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A12	compound treatment	1.238	0.029	0.39	1.499	0.0609	0.83	0.8638	0.9409	1918187	CBDivE_008652	CC(CNC(=O)c1cccs1)NC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A13	compound treatment	1.258	0.049	0.66	1.504	0.0659	0.9	1.1028	0.9885	1241415	CBDivE_008653	COc1ccc(cc1O)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A14	compound treatment	1.218	0.00897	0.12	1.491	0.0529	0.72	0.5958	0.8144	1561013	CBDivE_008654	OCCN(CCO)CC(O)Cn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A15	compound treatment	1.209	-2.51E-5	0.0	1.493	0.0549	0.75	0.5293	0.7068	1689793	CBDivE_008655	CN(CCO)CC(O)Cn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A16	compound treatment	1.174	-0.035	-0.47	1.465	0.0269	0.37	-0.0746	-0.1247	1918188	CBDivE_008656	Cc1cc(CSc2c(cc([N+](=O)[O-])c3cccnc23)[N+](=O)[O-])c(CSc4c(cc([N+](=O)[O-])c5cccnc45)[N+](=O)[O-])cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A17	compound treatment	1.332	0.123	1.66	1.544	0.106	1.44	2.1944	0.9976	1211061	CBDivE_008657	O=S(=O)(N1CCOCC1)c2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A18	compound treatment	1.244	0.035	0.47	1.401	-0.0371	-0.51	-0.0239	-0.0346	1455780	CBDivE_008658	CN1C2NC(=O)NC2N(Cc3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A19	compound treatment	1.228	0.019	0.26	1.501	0.0629	0.86	0.7877	0.8798	1918189	CBDivE_008659	COc1cccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	A20	compound treatment	1.165	-0.044	-0.59	1.475	0.0369	0.5	-0.064	-0.0822	1248652	CBDivE_008660	CCc1ccc(cc1)C2=C(O)C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B01	compound treatment	1.234	0.025	0.34	1.354	-0.0841	-1.15	-0.5725	-0.4791	1918190	CBDivE_008661	NC(=S)N/N=C(\Cc1ccccc1)/C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B02	compound treatment	1.259	0.05	0.67	1.447	0.00892	0.12	0.5627	0.8214	1918191	CBDivE_008662	Brc1ccc(o1)C(=O)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B03	compound treatment	1.209	-2.51E-5	0.0	1.407	-0.0311	-0.42	-0.3	-0.7077	1507492	CBDivE_008663	Cc1ccc(NC(=O)COc2ccc(Br)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B04	compound treatment	1.204	-0.00503	-0.07	1.462	0.0239	0.33	0.1827	0.5484	1918192	CBDivE_008664	CCOC(=O)C1=C(N)Oc2c(C1c3cccc(c3)[N+](=O)[O-])c(=O)oc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B05	compound treatment	1.19	-0.019	-0.26	1.476	0.0379	0.52	0.1841	0.319	1918193	CBDivE_008665	COc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B06	compound treatment	1.164	-0.045	-0.61	1.413	-0.0251	-0.34	-0.6714	-0.9631	1918194	CBDivE_008666	Clc1ccc(/C=N\NC(=O)COc2ccc(Cl)c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B07	compound treatment	1.229	0.02	0.27	1.454	0.0159	0.22	0.344	0.9942	1918195	CBDivE_008667	COc1ccc(cc1)N2C(c3ccc(Cl)cc3)S(=O)(=O)/C(=C/c4ccc(Cl)cc4)/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B08	compound treatment	1.28	0.071	0.96	1.399	-0.0391	-0.53	0.3002	0.2739	1918196	CBDivE_008668	Oc1ccc(/C=N/c2cccc(c2)C(F)(F)F)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B09	compound treatment	1.154	-0.055	-0.74	1.462	0.0239	0.33	-0.2943	-0.363	1918197	CBDivE_008669	N/C(=N\Nc1ccccc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B10	compound treatment	1.275	0.066	0.89	1.474	0.0359	0.49	0.9757	0.9604	1257097	CBDivE_008670	COc1ccc2C3N(C(Cc4c3[nH]c5ccccc45)C(=O)OC(C)C)C(=O)c2c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B11	compound treatment	1.19	-0.019	-0.26	1.386	-0.0521	-0.71	-0.6837	-0.9053	1918198	CBDivE_008671	Oc1ccccc1C(=O)N/N=C/C=N/NC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B12	compound treatment	1.2	-0.00903	-0.12	1.428	-0.0101	-0.14	-0.1833	-0.9982	1918199	CBDivE_008672	COc1ccc(NC(=O)COc2cccc(c2)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B13	compound treatment	1.228	0.019	0.26	1.351	-0.0871	-1.19	-0.6587	-0.5422	1609291	CBDivE_008673	O=S(=O)(c1ccccc1)c2ccc(cc2)n3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B14	compound treatment	1.182	-0.027	-0.36	1.468	0.0299	0.41	0.0307	0.056	1314980	CBDivE_008674	O=S(=O)(N=S(N1CCCCC1)N2CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B15	compound treatment	1.211	0.00197	0.03	1.436	-0.00208	-0.03	-0.0013	-0.0324	1553585	CBDivE_008675	OC(Cn1cnc(c1c2ccccc2)c3ccccc3)Cn4c5ccccc5c6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B16	compound treatment	1.177	-0.032	-0.43	1.445	0.00692	0.09	-0.2388	-0.5401	1592719	CBDivE_008676	CCC(N)C1CCCCNC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B17	compound treatment	1.195	-0.014	-0.19	1.452	0.0139	0.19	4.0E-4	0.0014	1685850	CBDivE_008677	COc1ccc(cc1)C(=O)Oc2cc(=O)oc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B18	compound treatment	1.167	-0.042	-0.57	1.493	0.0549	0.75	0.1286	0.1369	1918200	CBDivE_008678	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)COc2ccc(Cl)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B19	compound treatment	1.179	-0.03	-0.41	1.379	-0.0591	-0.81	-0.8561	-0.9494	1331088	CBDivE_008679	Brc1ccc(cc1)N(Cc2ccc(I)cc2)C(=O)COc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	B20	compound treatment	1.146	-0.063	-0.85	1.45	0.0119	0.16	-0.4863	-0.5618	1918201	CBDivE_008680	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C01	compound treatment	1.166	-0.043	-0.58	1.415	-0.0231	-0.31	-0.633	-0.9587	1918202	CBDivE_008681	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCNCCO)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C02	compound treatment	1.217	0.00797	0.11	1.443	0.00492	0.07	0.1235	0.9741	1918203	CBDivE_008682	COc1cc(C=c2sc3=NCCCn3c2=O)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C03	compound treatment	1.33	0.121	1.63	1.471	0.0329	0.45	1.4714	0.8693	1321422	CBDivE_008683	Cc1ccc2n(C)c3C(CCCc3c2c1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C04	compound treatment	1.193	-0.016	-0.22	1.409	-0.0291	-0.4	-0.4333	-0.9593	1918204	CBDivE_008684	CC(C)C(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(=O)c(coc2c1)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C05	compound treatment	1.234	0.025	0.34	1.508	0.0699	0.95	0.9124	0.9023	1660580	CBDivE_008685	Oc1cc2c(coc2c3ccccc13)C(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C06	compound treatment	1.205	-0.00403	-0.05	1.494	0.0559	0.76	0.5008	0.6551	1918205	CBDivE_008686	CC(C)CNC(=O)c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C07	compound treatment	1.247	0.038	0.51	1.513	0.0749	1.02	1.0846	0.9491	1918206	CBDivE_008687	O=Cc1ccc(SCCSc2ccc(C=O)s2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C08	compound treatment	1.205	-0.00403	-0.05	1.445	0.00692	0.09	0.0283	0.2599	1918207	CBDivE_008688	Cc1ccc(O)c(NC=C2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C09	compound treatment	1.207	-0.00203	-0.03	1.49	0.0519	0.71	0.4813	0.6793	1918208	CBDivE_008689	O=S(=O)(CCN1CCCCC1)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C10	compound treatment	1.209	-2.51E-5	0.0	1.499	0.0609	0.83	0.5871	0.7068	1918209	CBDivE_008690	Fc1cccc(C=C2C(=O)NC(=O)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C11	compound treatment	1.35	0.141	1.9	1.517	0.0789	1.08	2.1057	0.9636	1121586	CBDivE_008691	CCOC(=O)N(C)c1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C12	compound treatment	1.212	0.00297	0.04	1.451	0.0129	0.18	0.1529	0.8465	1633169	CBDivE_008692	O=C(Nc1ccccc1c2ccccc2NC(=O)C3C4CCCCC34)C5C6CCCCC56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C13	compound treatment	1.243	0.034	0.46	1.523	0.0849	1.16	1.1429	0.9177	1918210	CBDivE_008693	COc1cccc(C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C14	compound treatment	1.266	0.057	0.77	1.488	0.0499	0.68	1.0248	0.9982	1918211	CBDivE_008694	CC1(C)CC(=O)C(=CNCCCN2CCOCC2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C15	compound treatment	1.281	0.072	0.97	1.516	0.0779	1.06	1.4379	0.999	1420180	CBDivE_008695	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C16	compound treatment	1.195	-0.014	-0.19	1.462	0.0239	0.33	0.0968	0.2568	1918212	CBDivE_008696	Nc1cc(nn1c2ccc(Oc3ccccc3)c(c2)S(=O)(=O)O)c4ccc(N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C17	compound treatment	1.213	0.00397	0.05	1.488	0.0499	0.68	0.5192	0.7605	1385633	CBDivE_008697	COC(=O)Cn1c2C(CCCc2c3cc(C)ccc13)NC(C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C18	compound treatment	1.203	-0.00603	-0.08	1.446	0.00792	0.11	0.0188	0.1395	1918213	CBDivE_008698	[O-][N+](=O)c1ccc(cc1)c2n[nH]c(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C19	compound treatment	1.23	0.021	0.28	1.528	0.0899	1.23	1.0671	0.848	1134172	CBDivE_008699	CCc1c(C)c(=N)c2ccccc2n1CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	C20	compound treatment	1.25	0.041	0.55	1.433	-0.00508	-0.07	0.3418	0.6136	1528543	CBDivE_008700	OC1=C(C(=O)c2ccccc2C1=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D01	compound treatment	1.17	-0.039	-0.53	1.363	-0.0751	-1.02	-1.0963	-0.9522	1918214	CBDivE_008701	Clc1ccc(NC(=O)COc2ccc(Br)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D02	compound treatment	1.206	-0.00303	-0.04	1.371	-0.0671	-0.91	-0.6757	-0.7379	1918215	CBDivE_008702	C/C(=N\NC(=O)c1sc2ccccc2c1Cl)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D03	compound treatment	1.076	-0.133	-1.79	1.416	-0.0221	-0.3	-1.4819	-0.8144	1918216	CBDivE_008703	Clc1c(sc2ccccc12)C(=O)NN=C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D04	compound treatment	1.175	-0.034	-0.46	1.403	-0.0351	-0.48	-0.6629	-0.9998	3106942	CBDivE_008704	CC[n+]1ccc(cc1)c2ncc(o2)c3ccc(C)cc3C.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D05	compound treatment	1.163	-0.046	-0.62	1.443	0.00492	0.07	-0.3917	-0.6271	1918218	CBDivE_008705	Clc1cccc(NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4cccc(Cl)c4)C3=O)/SC2=S)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D06	compound treatment	1.259	0.05	0.67	1.427	-0.0111	-0.15	0.3698	0.5353	1918219	CBDivE_008706	O/N=C\1/CCCSc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D07	compound treatment	1.195	-0.014	-0.19	1.455	0.0169	0.23	0.0293	0.0983	1735411	CBDivE_008707	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)N4CCN(C)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D08	compound treatment	1.165	-0.044	-0.59	1.416	-0.0221	-0.3	-0.6329	-0.9504	1918220	CBDivE_008708	O=C(N/N=C\c1nc2ccccc2[nH]1)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D09	compound treatment	1.182	-0.027	-0.36	1.4	-0.0381	-0.52	-0.625	-0.985	1270748	CBDivE_008709	CCC(O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D10	compound treatment	1.174	-0.035	-0.47	1.425	-0.0131	-0.18	-0.4603	-0.9113	1918221	CBDivE_008710	O=C(Nc1ccccc1)c2cc(=Nc3ccccc3)c4ccccc4o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D11	compound treatment	1.177	-0.032	-0.43	1.476	0.0379	0.52	0.0601	0.0892	1696480	CBDivE_008711	Cc1ccc(NCC(O)Cn2c3ccccc3c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D12	compound treatment	1.233	0.024	0.32	1.486	0.0479	0.65	0.6907	0.9474	1918222	CBDivE_008712	[O-][N+](=O)c1ccc(cc1)C(=O)CC(NC(=O)Nc2ccc(Cl)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D13	compound treatment	1.277	0.068	0.92	1.432	-0.00608	-0.08	0.5898	0.6405	1180733	CBDivE_008713	O=S(=O)(c1ccccc1)c2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D14	compound treatment	1.193	-0.016	-0.22	1.392	-0.0461	-0.63	-0.5972	-0.8987	1918223	CBDivE_008714	Oc1ccc(cc1)C(=O)N/N=C/2\CCc3nonc3C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D15	compound treatment	1.162	-0.047	-0.63	1.456	0.0179	0.24	-0.2758	-0.4058	1592592	CBDivE_008715	CCOC(=O)c1sc(NC(=O)c2sc3ccccc3c2Cl)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D16	compound treatment	1.212	0.00297	0.04	1.375	-0.0631	-0.86	-0.5799	-0.6734	1918224	CBDivE_008716	Cc1ccc(OCC(=O)N/N=C/C=C/c2ccc(cc2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D17	compound treatment	1.168	-0.041	-0.55	1.414	-0.0241	-0.33	-0.6236	-0.969	1918225	CBDivE_008717	COC(=O)CCCCc1sc(cc1NC(=O)C)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D18	compound treatment	1.165	-0.044	-0.59	1.42	-0.0181	-0.25	-0.5943	-0.9242	1918226	CBDivE_008718	Cc1ccc(OCC(=O)N/N=C/c2cc(N=Nc3ccccc3)ccc2O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D19	compound treatment	1.234	0.025	0.34	1.479	0.0409	0.56	0.6328	0.9708	1918227	CBDivE_008719	OCCSc1cc[n+]([O-])c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	D20	compound treatment	1.206	-0.00303	-0.04	1.493	0.0549	0.75	0.5007	0.6676	1918228	CBDivE_008720	Oc1c(/C=N/NC(=O)CNc2cccc3ccccc23)cc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E01	compound treatment	1.291	0.082	1.11	1.458	0.0199	0.27	0.974	0.8553	1918229	CBDivE_008721	CCN(CC)CC(=O)Nc1ccc2CCc3ccccc3N(C(=O)c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E02	compound treatment	1.206	-0.00303	-0.04	1.425	-0.0131	-0.18	-0.155	-0.847	1264483	CBDivE_008722	COc1cccc(C2CC(=NCCS2)c3c(O)cc(C)oc3=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E03	compound treatment	1.225	0.016	0.22	1.447	0.00892	0.12	0.2384	0.9633	1918230	CBDivE_008723	CCN(CC)c1ccc(/N=C\2/C(=O)Nc3cc(Br)c(C)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E04	compound treatment	1.198	-0.011	-0.15	1.461	0.0229	0.31	0.1158	0.3346	1137572	CBDivE_008724	Nc1nc(cs1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E05	compound treatment	1.235	0.026	0.35	1.48	0.0419	0.57	0.6519	0.9724	1572939	CBDivE_008725	OC(CN(c1ccccc1)c2ccccc2)CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E06	compound treatment	1.227	0.018	0.24	1.484	0.0459	0.63	0.6142	0.9148	1917481	CBDivE_008726	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E07	compound treatment	1.209	-2.51E-5	0.0	1.546	0.108	1.47	1.0403	0.7069	1268388	CBDivE_008727	CC(C)(C)S(=O)(=O)c1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E08	compound treatment	1.224	0.015	0.2	1.475	0.0369	0.5	0.4988	0.9196	1918231	CBDivE_008728	Cc1[nH]n(c2ccc(Br)cc2Br)c(=O)c1/C=N/CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E09	compound treatment	1.305	0.096	1.29	1.45	0.0119	0.16	1.0304	0.7896	1048387	CBDivE_008729	O=S(=O)(CCc1ccccc1)CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E10	compound treatment	1.225	0.016	0.22	1.483	0.0449	0.61	0.5855	0.9017	1531409	CBDivE_008730	Fc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E11	compound treatment	1.289	0.08	1.08	1.508	0.0699	0.95	1.4371	0.9981	1177467	CBDivE_008731	COc1cc(cc(OC)c1O)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E12	compound treatment	1.177	-0.032	-0.43	1.439	9.15E-4	0.01	-0.2967	-0.6864	1151940	CBDivE_008732	Cc1cc(ccc1NC(=O)C2C3CCCCC23)c4ccc(NC(=O)C5C6CCCCC56)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E13	compound treatment	1.231	0.022	0.3	1.432	-0.00608	-0.08	0.151	0.4904	1706602	CBDivE_008733	Cc1ccc2nc(C)n3c4ccccc4c(NC(=O)Cc5ccccc5)c3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E14	compound treatment	1.166	-0.043	-0.58	1.449	0.0109	0.15	-0.3052	-0.5093	1918232	CBDivE_008734	Clc1ccc(Cl)c(NC=C2C(=O)NC(=O)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E15	compound treatment	1.294	0.085	1.15	1.468	0.0299	0.41	1.0991	0.9032	1283908	CBDivE_008735	CCOc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E16	compound treatment	1.193	-0.016	-0.22	1.428	-0.0101	-0.14	-0.2501	-0.9761	1918233	CBDivE_008736	CCCCc1nc2ccccc2c(NC(=O)CN3CCN(CC3)C(=O)c4ccccc4)c1CCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E17	compound treatment	1.296	0.087	1.17	1.438	-8.46E-5	0.0	0.8289	0.7064	1259349	CBDivE_008737	CC(NC1CCCc2c1[nH]c3ccc(cc23)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E18	compound treatment	1.215	0.00597	0.08	1.471	0.0329	0.45	0.3744	0.821	1918234	CBDivE_008738	CCn1c(C)nc2cc(Cl)c(Cl)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E19	compound treatment	1.258	0.049	0.66	1.523	0.0849	1.16	1.286	0.9646	1918235	CBDivE_008739	COc1cc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	E20	compound treatment	1.28	0.071	0.96	1.447	0.00892	0.12	0.763	0.7905	1918236	CBDivE_008740	CC1(C)CC(=O)C=C(C1)Nc2ccc(Cl)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F01	compound treatment	1.175	-0.034	-0.46	1.368	-0.0701	-0.96	-1.0004	-0.9435	1295860	CBDivE_008741	Ic1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F02	compound treatment	1.157	-0.052	-0.7	1.373	-0.0651	-0.89	-1.1239	-0.9932	1133625	CBDivE_008742	Clc1c(sc2ccccc12)C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F03	compound treatment	1.149	-0.06	-0.81	1.429	-0.00908	-0.12	-0.6602	-0.8059	1539576	CBDivE_008743	O=C(NCCN1CCOCC1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F04	compound treatment	1.186	-0.023	-0.31	1.353	-0.0851	-1.16	-1.0401	-0.8659	1918237	CBDivE_008744	CCCCc1nc2ccccc2c(NC(=O)CN(CC)CC)c1CCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F05	compound treatment	1.204	-0.00503	-0.07	1.432	-0.00608	-0.08	-0.1066	-0.995	1918238	CBDivE_008745	Clc1ccc(NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4ccc(Cl)cc4)C3=O)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F06	compound treatment	1.176	-0.033	-0.45	1.392	-0.0461	-0.63	-0.7594	-0.9858	1918239	CBDivE_008746	FC(F)(F)c1ccc2S(=O)c3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F07	compound treatment	1.201	-0.00803	-0.11	1.392	-0.0461	-0.63	-0.5209	-0.8169	1918240	CBDivE_008747	OS(=O)(=O)c1ccc(N/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F08	compound treatment	1.208	-0.00103	-0.01	1.463	0.0249	0.34	0.2305	0.6778	1918241	CBDivE_008748	Oc1ccccc1Oc2c(cc([N+](=O)[O-])c3cccnc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F09	compound treatment	1.14	-0.069	-0.93	1.425	-0.0131	-0.18	-0.7846	-0.8275	1918242	CBDivE_008749	CCOC(=O)CC1(C(=O)c2ccccc2C1=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F10	compound treatment	1.189	-0.02	-0.27	1.452	0.0139	0.19	-0.0568	-0.1722	1649184	CBDivE_008750	OC(=O)CCCC(=O)Nc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F11	compound treatment	1.193	-0.016	-0.22	1.466	0.0279	0.38	0.1163	0.2657	1265422	CBDivE_008751	COc1ccc(NCC(O)Cn2c3ccccc3c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F12	compound treatment	1.09	-0.119	-1.61	1.411	-0.0271	-0.37	-1.3966	-0.8476	1146123	CBDivE_008752	OC(=O)C(CCc1nc2ccccc2[nH]1)NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F13	compound treatment	1.17	-0.039	-0.53	1.485	0.0469	0.64	0.0801	0.0967	1309531	CBDivE_008753	Cc1ccccc1NCC(O)Cn2c3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F14	compound treatment	1.176	-0.033	-0.45	1.444	0.00592	0.08	-0.258	-0.5698	1918243	CBDivE_008754	CC(=O)N(CCCn1c2ccccc2c3nc4ccc(cc4cc13)[N+](=O)[O-])C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F15	compound treatment	1.217	0.00797	0.11	1.474	0.0359	0.49	0.4224	0.8424	1918244	CBDivE_008755	Oc1ccc2ccccc2c1/C=N/c3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F16	compound treatment	1.175	-0.034	-0.46	1.443	0.00492	0.07	-0.2772	-0.5975	1918245	CBDivE_008756	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)COc3ccc(Cl)cc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F17	compound treatment	1.156	-0.053	-0.72	1.478	0.0399	0.54	-0.1209	-0.1345	1470036	CBDivE_008757	CCC(C)(c1ccc(s1)C(=O)OC)c2ccc(s2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F18	compound treatment	1.211	0.00197	0.03	1.445	0.00692	0.09	0.0855	0.8727	1237218	CBDivE_008758	Fc1ccccc1C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccccc4F)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F19	compound treatment	1.173	-0.036	-0.49	1.479	0.0409	0.56	0.0509	0.0687	1918246	CBDivE_008759	COc1cc(/C=C/c2ccc(cc2)[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	F20	compound treatment	1.162	-0.047	-0.63	1.376	-0.0621	-0.85	-1.0472	-0.9899	1918247	CBDivE_008760	Cc1[n+](CC#C)ccn2cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G01	compound treatment	1.187	-0.022	-0.3	1.434	-0.00408	-0.06	-0.2495	-0.8253	1918248	CBDivE_008761	CCOC(=O)Nc1ccc2C=Cc3ccccc3N(C(=O)CN(CC)CC)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G02	compound treatment	1.156	-0.053	-0.72	1.409	-0.0291	-0.4	-0.7863	-0.9613	1628585	CBDivE_008762	COc1cc(cc(OC)c1O)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G03	compound treatment	1.28	0.071	0.96	1.447	0.00892	0.12	0.763	0.7905	1602793	CBDivE_008763	CCOC(=O)c1c(C)n(C)c2cc(Nc3ccccc3)c(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G04	compound treatment	1.236	0.027	0.36	1.466	0.0279	0.38	0.5265	0.9997	1264253	CBDivE_008764	CC(C)(C)OC(=O)N1CCCC1C(=O)Oc2ccc3c(=O)c(coc3c2)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G05	compound treatment	1.223	0.014	0.19	1.468	0.0299	0.41	0.4218	0.9385	1918249	CBDivE_008765	CC(C)(C)c1ccc(cc1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G06	compound treatment	1.229	0.02	0.27	1.441	0.00292	0.04	0.2187	0.8027	1918250	CBDivE_008766	CC(=O)c1ccc(/N=C/c2cc(Cl)cc(Cl)c2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G07	compound treatment	1.236	0.027	0.36	1.442	0.00392	0.05	0.2951	0.8023	1918251	CBDivE_008767	Brc1cccc(c1)C(=O)N/N=C\c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G08	compound treatment	1.218	0.00897	0.12	1.44	0.00192	0.03	0.1041	0.8403	1445635	CBDivE_008768	Oc1cccc(NC(=O)COc2ccc(Br)cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G09	compound treatment	1.265	0.056	0.76	1.501	0.0629	0.86	1.1406	0.998	1918252	CBDivE_008769	O=C(CCCNc1ccccc1)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G10	compound treatment	1.203	-0.00603	-0.08	1.484	0.0459	0.63	0.3853	0.6102	1918253	CBDivE_008770	O=C(NNC(=O)c1ccccc1)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G11	compound treatment	1.291	0.082	1.11	1.487	0.0489	0.67	1.2536	0.9707	1918254	CBDivE_008771	COc1cc(cc(OC)c1OC)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G12	compound treatment	1.157	-0.052	-0.7	1.449	0.0109	0.15	-0.391	-0.545	1393331	CBDivE_008772	CCCCN1CCCC1C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G13	compound treatment	1.235	0.026	0.35	1.485	0.0469	0.64	0.7002	0.9599	1918255	CBDivE_008773	Brc1ccccc1/C=N/NC(=O)CN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G14	compound treatment	1.213	0.00397	0.05	1.442	0.00392	0.05	0.0757	1.0	1918256	CBDivE_008774	[O-][N+](=O)c1cccc(/C=N\NC(=O)COc2ccc(Cl)c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G15	compound treatment	1.284	0.075	1.01	1.542	0.104	1.42	1.7172	0.9863	1918257	CBDivE_008775	COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(F)c(F)c3)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G16	compound treatment	1.196	-0.013	-0.18	1.521	0.0829	1.13	0.6753	0.5901	1204162	CBDivE_008776	CCN1C(=O)N(CC)C(O)(c2ccccc2)C1(O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G17	compound treatment	1.253	0.044	0.59	1.502	0.0639	0.87	1.0358	0.9824	1918258	CBDivE_008777	CCC(C)NC(=O)c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G18	compound treatment	1.215	0.00597	0.08	1.409	-0.0291	-0.4	-0.2234	-0.5521	1918259	CBDivE_008778	Fc1ccc(NC=C2C(=O)c3ccccc3C2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G19	compound treatment	1.274	0.065	0.88	1.448	0.00992	0.14	0.7154	0.8066	1263931	CBDivE_008779	Cc1ccc2nc(C)n3c4ccccc4c(NC(=O)c5ccccc5)c3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	G20	compound treatment	1.241	0.032	0.43	1.525	0.0869	1.19	1.1431	0.9063	1918260	CBDivE_008780	[O-][n+]1ccc(N/N=C/c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H01	compound treatment	1.173	-0.036	-0.49	1.313	-0.125	-1.71	-1.5498	-0.8738	1918261	CBDivE_008781	CCCCOC(=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H02	compound treatment	1.191	-0.018	-0.24	1.415	-0.0231	-0.31	-0.3945	-0.9919	1918262	CBDivE_008782	Cc1cc(ccc1C(c2ccc(cc2C)N(CCO)CCO)c3ccccc3Cl)N(CCO)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H03	compound treatment	1.208	-0.00103	-0.01	1.369	-0.0691	-0.94	-0.6759	-0.7174	1918263	CBDivE_008783	C/C(=N/NC(=O)c1sc2ccccc2c1Cl)/c3ccc(Cl)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H04	compound treatment	1.218	0.00897	0.12	1.382	-0.0561	-0.76	-0.4552	-0.5878	1918264	CBDivE_008784	CCCCc1nc2ccccc2c(NC(=O)CNC(C)(C)C)c1CCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H05	compound treatment	1.143	-0.066	-0.89	1.437	-0.00108	-0.01	-0.6403	-0.7187	1918265	CBDivE_008785	CCc1ccccc1NC(=S)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H06	compound treatment	1.189	-0.02	-0.27	1.384	-0.0541	-0.74	-0.7125	-0.9072	1451908	CBDivE_008786	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H07	compound treatment	1.179	-0.03	-0.41	1.415	-0.0231	-0.31	-0.509	-0.9922	1918266	CBDivE_008787	COc1cccc(/C=N/c2cc(ccc2O)S(=O)(=O)c3ccc(O)c(\N=C\c4cccc(OC)c4O)c3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H08	compound treatment	1.215	0.00597	0.08	1.39	-0.0481	-0.66	-0.4067	-0.6155	1918267	CBDivE_008788	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4cccc(I)c4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H09	compound treatment	1.151	-0.058	-0.78	1.387	-0.0511	-0.7	-1.0461	-0.9983	1918268	CBDivE_008789	OC(=O)CCCC(=O)OCCCCc1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H10	compound treatment	1.216	0.00697	0.09	1.444	0.00592	0.08	0.1236	0.9971	1918269	CBDivE_008790	O=C(N/N=C\c1c[nH]c2ccccc12)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H11	compound treatment	1.299	0.09	1.21	1.404	-0.0341	-0.46	0.5296	0.4075	1332723	CBDivE_008791	Clc1c(sc2ccccc12)C(=O)NC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H12	compound treatment	1.231	0.022	0.3	1.442	0.00392	0.05	0.2474	0.8212	3107014	CBDivE_008792	NCCc1ccccc1.O=C(NCCc1ccccc1)c2ccccc2[S-](=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H13	compound treatment	1.248	0.039	0.53	1.505	0.0669	0.91	1.017	0.9657	1918271	CBDivE_008793	Clc1c(sc2ccccc12)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H14	compound treatment	1.212	0.00297	0.04	1.438	-8.46E-5	0.0	0.0276	0.6865	1366722	CBDivE_008794	CC1(C)C2CCC1(C)CN(CC(O)Cn3c4ccccc4c5ccccc35)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H15	compound treatment	1.18	-0.029	-0.39	1.435	-0.00308	-0.04	-0.3066	-0.7786	1918272	CBDivE_008795	CCOC(=O)CC1(C(=O)c2ccccc2C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H16	compound treatment	1.149	-0.06	-0.81	1.447	0.00892	0.12	-0.4866	-0.5943	1918273	CBDivE_008796	Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/C=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H17	compound treatment	1.182	-0.027	-0.36	1.466	0.0279	0.38	0.0114	0.0216	1918274	CBDivE_008797	Clc1c(sc2ccccc12)C(=O)NNC(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H18	compound treatment	1.232	0.023	0.31	1.374	-0.0641	-0.87	-0.3988	-0.4301	1918275	CBDivE_008798	OC(=O)CN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H19	compound treatment	1.201	-0.00803	-0.11	1.462	0.0239	0.33	0.154	0.4483	1918276	CBDivE_008799	Cc1cccc(OCC(=O)N/N=C/c2ccc(O)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	H20	compound treatment	1.176	-0.033	-0.45	1.416	-0.0221	-0.3	-0.528	-0.9818	1918277	CBDivE_008800	SC(=S)N1N=CCC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I01	compound treatment	1.24	0.031	0.42	1.392	-0.0461	-0.63	-0.1489	-0.1973	1918278	CBDivE_008801	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CN(CC)CC)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I02	compound treatment	1.199	-0.01	-0.14	1.421	-0.0171	-0.23	-0.2604	-0.9665	1170357	CBDivE_008802	CC(C)(C)OC(=O)N1CCCC1C(=O)Oc2ccc3c(=O)c(coc3c2)c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I03	compound treatment	1.201	-0.00803	-0.11	1.484	0.0459	0.63	0.3662	0.5763	1918279	CBDivE_008803	O=C(N/N=C\1/C(=O)Nc2ccccc12)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I04	compound treatment	1.165	-0.044	-0.59	1.427	-0.0111	-0.15	-0.5269	-0.8597	1303291	CBDivE_008804	CC(C)(C)NC(=O)c1ccccc1C(=O)NC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I05	compound treatment	1.207	-0.00203	-0.03	1.426	-0.0121	-0.16	-0.1358	-0.8132	1918280	CBDivE_008805	CC(C)(C)c1cc(c2oc3c(cc(c(O)c3c2c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I06	compound treatment	1.198	-0.011	-0.15	1.464	0.0259	0.35	0.1447	0.3774	1219516	CBDivE_008806	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3F)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I07	compound treatment	1.27	0.061	0.82	1.496	0.0579	0.79	1.1401	0.9998	1561823	CBDivE_008807	Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I08	compound treatment	1.249	0.04	0.54	1.497	0.0589	0.8	0.9494	0.9812	1345158	CBDivE_008808	Cc1ccc(o1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I09	compound treatment	1.238	0.029	0.39	1.513	0.0749	1.02	0.9988	0.9131	1012478	CBDivE_008809	CN(C)Cc1cc(cc(c1O)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I10	compound treatment	1.247	0.038	0.51	1.448	0.00992	0.14	0.4579	0.8641	1476386	CBDivE_008810	O=C(Oc1ccc2ccccc2c1)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I11	compound treatment	1.245	0.036	0.49	1.471	0.0329	0.45	0.6606	0.9992	1918281	CBDivE_008811	Cc1cc(C)n2nc(nc2n1)C(=O)N/N=C/C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I12	compound treatment	1.181	-0.028	-0.38	1.523	0.0849	1.16	0.5514	0.4527	1918282	CBDivE_008812	CCCCCC1=C(O)C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I13	compound treatment	1.284	0.075	1.01	1.456	0.0179	0.24	0.888	0.8534	1918283	CBDivE_008813	OS(=O)(=O)c1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I14	compound treatment	1.261	0.052	0.7	1.431	-0.00708	-0.1	0.4275	0.604	1267101	CBDivE_008814	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I15	compound treatment	1.236	0.027	0.36	1.497	0.0589	0.8	0.8254	0.9359	1453602	CBDivE_008815	OCCN(CCO)CC(O)Cn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I16	compound treatment	1.23	0.021	0.28	1.433	-0.00508	-0.07	0.1511	0.5185	1918284	CBDivE_008816	COc1cc(/C=C/2\SC(=S)N(CC(=O)O)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I17	compound treatment	1.254	0.045	0.61	1.475	0.0369	0.5	0.785	0.9957	1918285	CBDivE_008817	COC(=O)c1sc2c(Cl)c(OC)ccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I18	compound treatment	1.202	-0.00703	-0.09	1.492	0.0539	0.74	0.4529	0.6109	1162639	CBDivE_008818	CC1(C)CC(=O)C=C(C1)NCCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I19	compound treatment	1.254	0.045	0.61	1.448	0.00992	0.14	0.5246	0.844	1241597	CBDivE_008819	Cc1nc2ccc(Cl)cc2c3c(N)c4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	I20	compound treatment	1.218	0.00897	0.12	1.445	0.00692	0.09	0.1523	0.9924	1918286	CBDivE_008820	CCOc1ccc(/C=N/c2ccc(cc2C)c3ccc(\N=C\c4ccc(OCC)cc4)c(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J01	compound treatment	1.17	-0.039	-0.53	1.393	-0.0451	-0.61	-0.807	-0.997	1918287	CBDivE_008821	CCCCOC(=O)c1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J02	compound treatment	1.188	-0.021	-0.28	1.427	-0.0111	-0.15	-0.3074	-0.9566	1776898	CBDivE_008822	[O-][N+](=O)c1ccc(Cc2nc3ccccc3[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J03	compound treatment	1.131	-0.078	-1.05	1.37	-0.0681	-0.93	-1.4008	-0.998	1664581	CBDivE_008823	Brc1ccc(o1)C(=O)N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J04	compound treatment	1.18	-0.029	-0.39	1.396	-0.0421	-0.57	-0.6827	-0.9826	1918288	CBDivE_008824	CCCc1nc2ccccc2c(NC(=O)CNC3CCCCC3)c1CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J05	compound treatment	1.176	-0.033	-0.45	1.414	-0.0241	-0.33	-0.5473	-0.9887	1564768	CBDivE_008825	COC(=O)c1cccc(NC(=O)COc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J06	compound treatment	1.185	-0.024	-0.32	1.352	-0.0861	-1.17	-1.0592	-0.8698	1918289	CBDivE_008826	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)C=C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J07	compound treatment	1.212	0.00297	0.04	1.401	-0.0371	-0.51	-0.3292	-0.6489	1918290	CBDivE_008827	Cc1ccc(/C=N/c2cc(ccc2O)S(=O)(=O)c3ccc(O)c(\N=C\c4ccc(C)cc4)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J08	compound treatment	1.224	0.015	0.2	1.444	0.00592	0.08	0.1999	0.9189	1918291	CBDivE_008828	CCCCCc1ccc(cc1)C(=O)/C=C/2\C=C(Oc3ccc(OC)cc23)c4ccc(CCCCC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J09	compound treatment	1.164	-0.045	-0.61	1.453	0.0149	0.2	-0.2857	-0.446	1918292	CBDivE_008829	CCOC(=O)/C(=N\Nc1ccc(OC)cc1OC)/CCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J10	compound treatment	1.199	-0.01	-0.14	1.447	0.00892	0.12	-0.0097	-0.0532	1918293	CBDivE_008830	O=C(N/N=C/c1nc2ccccc2[nH]1)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J11	compound treatment	1.206	-0.00303	-0.04	1.439	9.15E-4	0.01	-0.02	-0.4694	1918294	CBDivE_008831	CCOc1cc(/C=N/NC(=O)c2sc3ccccc3c2Cl)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J12	compound treatment	1.182	-0.027	-0.36	1.448	0.00992	0.14	-0.1622	-0.4171	1918295	CBDivE_008832	C/C(=N\OCO\N=C(\C)/c1ccc(Cl)c(Cl)c1)/c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J13	compound treatment	1.231	0.022	0.3	1.395	-0.0431	-0.59	-0.2058	-0.3128	1918296	CBDivE_008833	O=C1N(N=C2CCCCC2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J14	compound treatment	1.183	-0.026	-0.35	1.355	-0.0831	-1.13	-1.0494	-0.8847	1918297	CBDivE_008834	FC(F)S(=O)(=O)c1ccc(cc1)c2ncc(o2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J15	compound treatment	1.16	-0.049	-0.66	1.457	0.0189	0.26	-0.2853	-0.4019	1918298	CBDivE_008835	OC1=C(C(=O)c2ccccc2C1=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J16	compound treatment	1.158	-0.051	-0.69	1.426	-0.0121	-0.16	-0.6033	-0.8523	1918299	CBDivE_008836	C/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)/CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J17	compound treatment	1.152	-0.057	-0.77	1.445	0.00692	0.09	-0.4773	-0.6158	1918300	CBDivE_008837	O=C(/C=C\1/OC(=O)c2ccccc12)N3CCCc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J18	compound treatment	1.116	-0.093	-1.25	1.397	-0.0411	-0.56	-1.2836	-0.9339	1918301	CBDivE_008838	CC(Nc1nc(Nc2cccc(c2)C(F)(F)F)nc(n1)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J19	compound treatment	1.164	-0.045	-0.61	1.474	0.0359	0.49	-0.0832	-0.1066	1374529	CBDivE_008839	COC(=O)C1=C(C)NC2=C(C1c3ccc(cc3)c4ccccc4)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	J20	compound treatment	1.225	0.016	0.22	1.452	0.0139	0.19	0.2866	0.998	1918302	CBDivE_008840	COc1cc(/C=C/2\SC(=O)N(CC(=O)NNC(=O)c3ccccc3O)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K01	compound treatment	1.256	0.047	0.63	1.452	0.0139	0.19	0.5823	0.8802	1918303	CBDivE_008841	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)NCCCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K02	compound treatment	1.209	-2.51E-5	0.0	1.396	-0.0421	-0.57	-0.406	-0.7075	1918304	CBDivE_008842	CC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(=O)c(c(C)oc2c1)c3ccc4OCCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K03	compound treatment	1.201	-0.00803	-0.11	1.441	0.00292	0.04	-0.0484	-0.42	1592193	CBDivE_008843	OC(CN(c1ccccc1)c2ccccc2)Cn3cnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K04	compound treatment	1.21	9.75E-4	0.01	1.434	-0.00408	-0.06	-0.0301	-0.5257	1118735	CBDivE_008844	OC(C(=O)N1CCCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K05	compound treatment	1.3	0.091	1.23	1.452	0.0139	0.19	1.002	0.8068	1626120	CBDivE_008845	NC(=S)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K06	compound treatment	1.194	-0.015	-0.2	1.452	0.0139	0.19	-0.0092	-0.033	1918305	CBDivE_008846	O=C/1NC(=S)S\C1=C\Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K07	compound treatment	1.23	0.021	0.28	1.444	0.00592	0.08	0.2571	0.8739	1918306	CBDivE_008847	COc1ccc(/N=C\2/CCCc3ccccc3N2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K08	compound treatment	1.207	-0.00203	-0.03	1.448	0.00992	0.14	0.0763	0.5531	1918307	CBDivE_008848	COc1ccccc1/C=C/C2=NN(C(C2)c3ccccc3OC)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K09	compound treatment	1.216	0.00697	0.09	1.462	0.0239	0.33	0.2971	0.8754	1676636	CBDivE_008849	CC(C)(C)c1cc(CN(CCO)CCO)c(O)c(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K10	compound treatment	1.225	0.016	0.22	1.476	0.0379	0.52	0.518	0.9247	1775204	CBDivE_008850	O=C(Nc1ccc(Cc2ccc(NC(=O)C3C4CCCCC34)cc2)cc1)C5C6CCCCC56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K11	compound treatment	1.247	0.038	0.51	1.422	-0.0161	-0.22	0.2072	0.3717	1918308	CBDivE_008851	C/C(=N/NC(=O)c1nc2nc(C)cc(C)n2n1)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K12	compound treatment	1.188	-0.021	-0.28	1.422	-0.0161	-0.22	-0.3557	-0.9919	1918309	CBDivE_008852	CC1(C)CC(=O)C(=CNc2cc(Cl)ccc2O)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K13	compound treatment	1.244	0.035	0.47	1.477	0.0389	0.53	0.7089	0.9983	1373083	CBDivE_008853	CC(=O)Nc1c2ccccc2n3c(C)nc4ccccc4c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K14	compound treatment	1.164	-0.045	-0.61	1.454	0.0159	0.22	-0.276	-0.428	1918310	CBDivE_008854	C[C@H]1C2[C@H](C)N(C)C(=O)N(C)C2N(C)C(=O)N1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K15	compound treatment	1.272	0.063	0.85	1.537	0.0989	1.35	1.5545	0.9752	1918311	CBDivE_008855	Cn1c(=NC(=O)c2cccc(Br)c2)sc3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K16	compound treatment	1.206	-0.00303	-0.04	1.489	0.0509	0.69	0.4621	0.6644	3107053	CBDivE_008856	OCCNCCO.OC(=O)CN1C(=O)/C(=C/c2ccc(F)cc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K17	compound treatment	1.28	0.071	0.96	1.465	0.0269	0.37	0.9366	0.9134	1044404	CBDivE_008857	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K18	compound treatment	1.193	-0.016	-0.22	1.39	-0.0481	-0.66	-0.6165	-0.893	1918313	CBDivE_008858	COC(=O)c1ccc(NC=C2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K19	compound treatment	1.221	0.012	0.16	1.528	0.0899	1.23	0.9812	0.7934	1918314	CBDivE_008859	FC(F)(F)/C(=N\NC(=O)c1ccccc1)/Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	K20	compound treatment	1.248	0.039	0.53	1.499	0.0609	0.83	0.9592	0.9757	1583800	CBDivE_008860	COC(=O)C1=C(C)NC2=C(C1c3cccc(F)c3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L01	compound treatment	1.17	-0.039	-0.53	1.384	-0.0541	-0.74	-0.8938	-0.9863	1526325	CBDivE_008861	O=C(NCCc1ccccc1)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L02	compound treatment	1.161	-0.048	-0.65	1.345	-0.0931	-1.27	-1.3557	-0.9513	1671651	CBDivE_008862	CCOC(=O)C1(O)N(C)C(=O)Nc2ccccc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L03	compound treatment	1.236	0.027	0.36	1.413	-0.0251	-0.34	0.0154	0.0309	1527601	CBDivE_008863	OC(C(=O)Nc1ccc2OCOc2c1)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L04	compound treatment	1.164	-0.045	-0.61	1.382	-0.0561	-0.76	-0.9703	-0.9935	1918315	CBDivE_008864	CCOCc1c(C)cc(C)c(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L05	compound treatment	1.104	-0.105	-1.42	1.441	0.00292	0.04	-0.9738	-0.687	1918316	CBDivE_008865	O=C/1NC(=S)S\C1=C\c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L06	compound treatment	1.205	-0.00403	-0.05	1.37	-0.0681	-0.93	-0.6949	-0.7472	1186510	CBDivE_008866	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L07	compound treatment	1.162	-0.047	-0.63	1.426	-0.0121	-0.16	-0.5651	-0.8622	1918317	CBDivE_008867	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=O)C)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L08	compound treatment	1.154	-0.055	-0.74	1.442	0.00392	0.05	-0.4871	-0.6546	1918318	CBDivE_008868	COc1ccc(cc1OC)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L09	compound treatment	1.203	-0.00603	-0.08	1.426	-0.0121	-0.16	-0.174	-0.947	1918319	CBDivE_008869	CCOC(=O)Nc1ccc2C=Cc3ccccc3N(C(=O)CCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L10	compound treatment	1.17	-0.039	-0.53	1.368	-0.0701	-0.96	-1.0481	-0.9605	1918320	CBDivE_008870	CN(C)CC(=O)N1c2ccccc2CCc3ccc(N)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L11	compound treatment	1.185	-0.024	-0.32	1.404	-0.0341	-0.46	-0.5578	-0.9845	1918321	CBDivE_008871	CC(=NNC(=O)c1sc2ccccc2c1Cl)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L12	compound treatment	1.19	-0.019	-0.26	1.398	-0.0401	-0.55	-0.568	-0.9406	1918322	CBDivE_008872	OC(=O)COCc1nnc(S)n1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L13	compound treatment	1.23	0.021	0.28	1.41	-0.0281	-0.38	-0.0707	-0.1485	1918323	CBDivE_008873	CC/C(=N/NC(=O)c1sc2ccccc2c1Cl)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L14	compound treatment	1.214	0.00497	0.07	1.417	-0.0211	-0.29	-0.1558	-0.5279	3107055	CBDivE_008874	CC[n+]1ccc(cc1)c2ncc(o2)c3ccc(cc3)C(C)(C)C.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L15	compound treatment	1.219	0.00997	0.13	1.368	-0.0701	-0.96	-0.5806	-0.6016	1918325	CBDivE_008875	C/C(=N/NC(=O)c1sc2ccccc2c1Cl)/c3ccc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L16	compound treatment	1.152	-0.057	-0.77	1.415	-0.0231	-0.31	-0.7666	-0.9222	1918326	CBDivE_008876	CCOc1cccc(/C=N/NC(=O)CNc2ccccc2C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L17	compound treatment	1.207	-0.00203	-0.03	1.445	0.00692	0.09	0.0474	0.4824	1918327	CBDivE_008877	C(=N/c1ccc(N=Nc2ccccc2)cc1)\c3ccc[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L18	compound treatment	1.163	-0.046	-0.62	1.397	-0.0411	-0.56	-0.8352	-0.9987	1918328	CBDivE_008878	COc1cc2ccccc2cc1C(=O)N/N=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L19	compound treatment	1.194	-0.015	-0.2	1.474	0.0359	0.49	0.203	0.383	1675762	CBDivE_008879	COC(=O)C1=C(C)NC(=O)NC1c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	L20	compound treatment	1.158	-0.051	-0.69	1.454	0.0159	0.22	-0.3333	-0.4618	1918329	CBDivE_008880	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CN4CCN(C)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M01	compound treatment	1.227	0.018	0.24	1.408	-0.0301	-0.41	-0.1186	-0.2489	1918330	CBDivE_008881	Oc1c(Cl)cc(Cl)cc1[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M02	compound treatment	1.184	-0.025	-0.34	1.418	-0.0201	-0.27	-0.4324	-0.9946	1918331	CBDivE_008882	[O-][N+](=O)c1ccc(Sc2ccsc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M03	compound treatment	1.192	-0.017	-0.23	1.437	-0.00108	-0.01	-0.1729	-0.7511	1918332	CBDivE_008883	CC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(=O)c(coc2c1)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M04	compound treatment	1.209	-2.51E-5	0.0	1.418	-0.0201	-0.27	-0.1939	-0.708	1918333	CBDivE_008884	O=C1NC2(CCCC2)C(=O)N1CCS(=O)(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M05	compound treatment	1.286	0.077	1.04	1.402	-0.0361	-0.49	0.3863	0.3362	1229837	CBDivE_008885	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN(CC)CC)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M06	compound treatment	1.179	-0.03	-0.41	1.458	0.0199	0.27	-0.0944	-0.1935	1085480	CBDivE_008886	Clc1cccc(NC(=O)COc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M07	compound treatment	1.254	0.045	0.61	1.445	0.00692	0.09	0.4957	0.8073	1918334	CBDivE_008887	Oc1ccc2occ(C(=O)c3ccccc3)c2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M08	compound treatment	1.21	9.75E-4	0.01	1.404	-0.0341	-0.46	-0.3194	-0.6868	1057093	CBDivE_008888	[O-][N+](=O)c1ccccc1C=C2C(=O)NC(=O)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M09	compound treatment	1.3	0.091	1.23	1.483	0.0449	0.61	1.3009	0.9484	1359487	CBDivE_008889	CC(C)(C)c1cc(CN2CCOCC2)c(O)c(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M10	compound treatment	1.193	-0.016	-0.22	1.44	0.00192	0.03	-0.1344	-0.6172	1775205	CBDivE_008890	[O-][N+](=O)c1cccc(OC(=O)C2C3CCCCC23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M11	compound treatment	1.232	0.023	0.31	1.425	-0.0131	-0.18	0.093	0.26	1918335	CBDivE_008891	O=C(N/N=C\c1c[nH]c2ccccc12)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M12	compound treatment	1.21	9.75E-4	0.01	1.408	-0.0301	-0.41	-0.2808	-0.6841	1710817	CBDivE_008892	CCN(CC)CCCn1cccc1C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M13	compound treatment	1.198	-0.011	-0.15	1.483	0.0449	0.61	0.3279	0.5203	1193080	CBDivE_008893	CCOC(=O)C1=C(N)OC2=C(C1c3ccc4OCOc4c3)C(=O)CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M14	compound treatment	1.214	0.00497	0.07	1.429	-0.00908	-0.12	-0.0401	-0.2849	1918336	CBDivE_008894	CC(=O)c1cccc(/N=C/c2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M15	compound treatment	1.273	0.064	0.86	1.511	0.0729	0.99	1.3134	0.9975	1556892	CBDivE_008895	O=C(CC(C1C(=O)NC(=O)NC1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M16	compound treatment	1.196	-0.013	-0.18	1.464	0.0259	0.35	0.1256	0.3183	1918337	CBDivE_008896	Cc1ccc(O)c(NC=C2C(=O)CC(C)(C)CC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M17	compound treatment	1.284	0.075	1.01	1.485	0.0469	0.64	1.1676	0.9756	1344237	CBDivE_008897	Cc1cc(C)nc(NC(=O)Nc2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M18	compound treatment	1.232	0.023	0.31	1.474	0.0359	0.49	0.5655	0.9756	1918338	CBDivE_008898	CC1(C)CC(=O)C=C(C1)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M19	compound treatment	1.226	0.017	0.23	1.526	0.0879	1.2	1.0096	0.8272	1047922	CBDivE_008899	COc1ccc(cc1)C2NCCc3[nH]cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	M20	compound treatment	1.225	0.016	0.22	1.491	0.0529	0.72	0.6626	0.8799	1150997	CBDivE_008900	CC(C)OC(=O)C1=C(C)NC2=C(C1c3cccc(F)c3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N01	compound treatment	1.173	-0.036	-0.49	1.386	-0.0521	-0.71	-0.8459	-0.9829	1487357	CBDivE_008901	Brc1ccc(OCC(=O)NCCc2ccccc2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N02	compound treatment	1.145	-0.064	-0.86	1.385	-0.0531	-0.72	-1.1226	-0.9961	1918339	CBDivE_008902	CC(C)(C)S(=O)(=O)c1ccc(s1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N03	compound treatment	1.211	0.00197	0.03	1.362	-0.0761	-1.04	-0.7148	-0.6887	1918340	CBDivE_008903	CC1CCC(=NNC(=O)c2sc3ccccc3c2Cl)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N04	compound treatment	1.171	-0.038	-0.51	1.338	-0.1	-1.36	-1.3278	-0.9107	1774655	CBDivE_008904	[O-][N+](=O)c1cccc(c1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N05	compound treatment	1.24	0.031	0.42	1.396	-0.0421	-0.57	-0.1103	-0.1554	1918341	CBDivE_008905	CCCCOc1ccc(cc1)C2CC(=O)C3=C(C2)c4c(NC3c5ccc6OCOc6c5)ccc7ccccc47
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N06	compound treatment	1.223	0.014	0.19	1.354	-0.0841	-1.15	-0.6775	-0.583	1918342	CBDivE_008906	Clc1ccc(/N=C/c2ccc3OCOc3c2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N07	compound treatment	1.152	-0.057	-0.77	1.42	-0.0181	-0.25	-0.7184	-0.8892	1918343	CBDivE_008907	CC(C)CCN1CCCC1C(=O)Nc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N08	compound treatment	1.131	-0.078	-1.05	1.36	-0.0781	-1.06	-1.4972	-1.0	1918344	CBDivE_008908	CCCCC1CC1C(=O)Nc2ccc(NC(=O)C3CC3CCCC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N09	compound treatment	1.192	-0.017	-0.23	1.369	-0.0691	-0.94	-0.8286	-0.8545	1918345	CBDivE_008909	Oc1ccccc1C(=O)NN=C2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N10	compound treatment	1.177	-0.032	-0.43	1.412	-0.0261	-0.36	-0.557	-0.9953	1120172	CBDivE_008910	CCOC(=O)Nc1ccc2S(=O)c3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N11	compound treatment	1.202	-0.00703	-0.09	1.417	-0.0211	-0.29	-0.2703	-0.8929	1918346	CBDivE_008911	C/C(=N/NC(=O)c1nc2nc(C)cc(C)n2n1)/c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N12	compound treatment	1.158	-0.051	-0.69	1.357	-0.0811	-1.11	-1.2686	-0.974	1918347	CBDivE_008912	C/C(=N\NC(=O)COc1c(Cl)cc(Cl)cc1Cl)/CC2(O)C(=O)Nc3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N13	compound treatment	1.206	-0.00303	-0.04	1.39	-0.0481	-0.66	-0.4925	-0.7497	1392387	CBDivE_008913	Brc1ccc(o1)C(=O)Nc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N14	compound treatment	1.186	-0.023	-0.31	1.391	-0.0471	-0.64	-0.6737	-0.9445	1918348	CBDivE_008914	COc1ccc(/C=C/2\SC(=S)N(CC(=O)Nc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N15	compound treatment	1.171	-0.038	-0.51	1.389	-0.0491	-0.67	-0.836	-0.9914	1918349	CBDivE_008915	COc1ncccc1C(=O)NCC(CC(=O)O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N16	compound treatment	1.202	-0.00703	-0.09	1.381	-0.0571	-0.78	-0.6174	-0.7874	1918350	CBDivE_008916	COc1ccc(OCC(=O)N/N=C(\C)/CC2(O)C(=O)Nc3ccccc32)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N17	compound treatment	1.125	-0.084	-1.13	1.402	-0.0361	-0.49	-1.1495	-0.9302	1918351	CBDivE_008917	Oc1ccc2ccccc2c1C(/N=C/c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N18	compound treatment	1.238	0.029	0.39	1.394	-0.0441	-0.6	-0.1487	-0.2073	1363044	CBDivE_008918	COc1ccccc1NC(=O)c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N19	compound treatment	1.179	-0.03	-0.41	1.461	0.0229	0.31	-0.0655	-0.128	1918352	CBDivE_008919	CC1=C(C(NC(=O)N1)c2ccccc2)C(=O)OCCCBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	N20	compound treatment	1.177	-0.032	-0.43	1.374	-0.0641	-0.87	-0.9234	-0.9473	1918353	CBDivE_008920	Cn1c(=NC(=O)c2ccccc2)sc3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O01	compound treatment	1.257	0.048	0.65	1.482	0.0439	0.6	0.8811	0.9992	1435853	CBDivE_008921	Oc1c(Br)cc2occ(C(=O)c3ccccc3)c2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O02	compound treatment	1.17	-0.039	-0.53	1.452	0.0139	0.19	-0.2381	-0.4255	1918354	CBDivE_008922	CCSc1sc(cc1C(=O)C)C(C)(CC)c2cc(C(=O)C)c(SCC)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O03	compound treatment	1.231	0.022	0.3	1.528	0.0899	1.23	1.0766	0.8535	1516432	CBDivE_008923	Cc1ccc(cc1)C(=O)c2coc3c2cc(O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O04	compound treatment	1.278	0.069	0.93	1.451	0.0129	0.18	0.7825	0.8263	1534129	CBDivE_008924	O=C(Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)c3ccc(cc3)S(=O)(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O05	compound treatment	1.225	0.016	0.22	1.424	-0.0141	-0.19	0.0166	0.0574	1555697	CBDivE_008925	COC(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O06	compound treatment	1.18	-0.029	-0.39	1.441	0.00292	0.04	-0.2488	-0.6321	1496779	CBDivE_008926	O=S(=O)(c1ccccc1)c2ccc(cc2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O07	compound treatment	1.232	0.023	0.31	1.42	-0.0181	-0.25	0.0448	0.1131	1309275	CBDivE_008927	CC(=O)n1cc(N2N=C(C)CC2=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O08	compound treatment	1.224	0.015	0.2	1.446	0.00792	0.11	0.2192	0.9569	1663139	CBDivE_008928	O=C(CCN1C(=O)c2ccccc2C1=O)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O09	compound treatment	1.278	0.069	0.93	1.447	0.00892	0.12	0.7439	0.7928	1918355	CBDivE_008929	CCS(=O)(=O)c1ccc(s1)S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O10	compound treatment	1.165	-0.044	-0.59	1.437	-0.00108	-0.01	-0.4304	-0.7245	1660450	CBDivE_008930	Brc1ccc(o1)C(=O)N(C2CCCCC2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O11	compound treatment	1.259	0.05	0.67	1.436	-0.00208	-0.03	0.4566	0.6767	1918356	CBDivE_008931	OC1(CCCCC1)/C=C/C2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O12	compound treatment	1.234	0.025	0.34	1.438	-8.46E-5	0.0	0.2374	0.7047	1715561	CBDivE_008932	COc1ccc(OC)c(c1)C2N(C)c3ccccc3N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O13	compound treatment	1.299	0.09	1.21	1.434	-0.00408	-0.06	0.8189	0.6739	1002045	CBDivE_008933	Oc1c(ccc2cccnc12)C(Nc3ccc(cc3)[N+](=O)[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O14	compound treatment	1.188	-0.021	-0.28	1.429	-0.00908	-0.12	-0.2882	-0.931	1918357	CBDivE_008934	CCc1ccc(cc1)C(C)/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O15	compound treatment	1.287	0.078	1.05	1.503	0.0649	0.89	1.3698	0.9963	1918358	CBDivE_008935	CC(=O)c1c(C)oc2ccc(O)c(CN3CCOCC3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O16	compound treatment	1.254	0.045	0.61	1.415	-0.0231	-0.31	0.2064	0.302	1705345	CBDivE_008936	OC1=C(C(c2ccccc2)c3ccc(Cl)cc3)C(=O)c4ccccc4C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O17	compound treatment	1.27	0.061	0.82	1.521	0.0829	1.13	1.3812	0.9878	1388990	CBDivE_008937	COc1ccc(cc1O)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O18	compound treatment	1.188	-0.021	-0.28	1.483	0.0449	0.61	0.2325	0.3445	1918359	CBDivE_008938	Cc1n[nH]c(C(=O)N/N=C/c2ccc(O)c(c2)[N+](=O)[O-])c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O19	compound treatment	1.311	0.102	1.38	1.486	0.0479	0.65	1.4348	0.9421	1918360	CBDivE_008939	COc1ccc(/C=C/c2ccc3ccccc3[n+]2[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	O20	compound treatment	1.167	-0.042	-0.57	1.474	0.0359	0.49	-0.0546	-0.0729	1005175	CBDivE_008940	O=C(NN=C1CCCCC1)C(=O)NN=C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P01	compound treatment	1.229	0.02	0.27	1.422	-0.0161	-0.22	0.0355	0.102	1918361	CBDivE_008941	Cc1ccc(NC(=O)COc2ccc(cc2C)[N+](=O)[O-])c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P02	compound treatment	1.188	-0.021	-0.28	1.402	-0.0361	-0.49	-0.5485	-0.9657	1918362	CBDivE_008942	Cc1c(C)c(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c(C)c(C)c1/C=N/Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P03	compound treatment	1.243	0.034	0.46	1.336	-0.102	-1.39	-0.6602	-0.4505	1407195	CBDivE_008943	Clc1ccc(s1)C(=O)Nc2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P04	compound treatment	1.137	-0.072	-0.97	1.366	-0.0721	-0.98	-1.3821	-1.0	1918363	CBDivE_008944	Brc1ccc(o1)C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P05	compound treatment	1.167	-0.042	-0.57	1.359	-0.0791	-1.08	-1.1635	-0.9549	1918364	CBDivE_008945	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccc(F)cc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P06	compound treatment	1.139	-0.07	-0.94	1.367	-0.0711	-0.97	-1.3534	-0.9999	1918365	CBDivE_008946	Oc1ccc(Cl)cc1/C=N/c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P07	compound treatment	1.181	-0.028	-0.38	1.377	-0.0611	-0.83	-0.8563	-0.9361	1619738	CBDivE_008947	Cc1cc(C)c(c(C)c1)n2cccc2CNC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P08	compound treatment	1.193	-0.016	-0.22	1.357	-0.0811	-1.11	-0.9347	-0.8297	1918366	CBDivE_008948	CC(C)c1ccc(cc1)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P09	compound treatment	1.11	-0.099	-1.34	1.323	-0.115	-1.57	-2.0543	-0.9968	1457949	CBDivE_008949	CC(NC(=O)N)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P10	compound treatment	0.641	-0.568	-7.66	0.914	-0.524	-7.15	-10.472	-0.9994	1918367	CBDivE_008950	C/C(=N\NC(=O)c1nc2nc(C)cc(C)n2n1)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P11	compound treatment	1.187	-0.022	-0.3	1.35	-0.0881	-1.2	-1.0595	-0.8562	1415060	CBDivE_008951	CCN1C(=O)c2cccc3c(NC(=O)c4ccc(F)c(F)c4)ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P12	compound treatment	1.157	-0.052	-0.7	1.323	-0.115	-1.57	-1.606	-0.9342	1918368	CBDivE_008952	COc1ccc(cc1N)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P13	compound treatment	1.203	-0.00603	-0.08	1.403	-0.0351	-0.48	-0.3958	-0.8156	1918369	CBDivE_008953	Cc1cccc2sc(NC(=O)c3ccco3)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P14	compound treatment	1.162	-0.047	-0.63	1.396	-0.0421	-0.57	-0.8544	-0.9987	1179421	CBDivE_008954	COc1cccc(c1)C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P15	compound treatment	1.24	0.031	0.42	1.422	-0.0161	-0.22	0.1404	0.2975	1918370	CBDivE_008955	Oc1ccc(cc1/N=C/c2ccc(Br)s2)S(=O)(=O)c3ccc(O)c(/N=C/c4ccc(Br)s4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P16	compound treatment	1.181	-0.028	-0.38	1.383	-0.0551	-0.75	-0.7985	-0.9495	1918371	CBDivE_008956	[O-][N+](=O)c1ccccc1OCC(=O)N/N=C/c2cc3ccccc3nc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P17	compound treatment	1.157	-0.052	-0.7	1.37	-0.0681	-0.93	-1.1528	-0.9905	1918372	CBDivE_008957	Nc1nc(Cl)nc2cc(Cl)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P18	compound treatment	1.103	-0.106	-1.43	1.414	-0.0241	-0.33	-1.2436	-0.8474	1918373	CBDivE_008958	NNC(=O)C(CCO)CC1CCC(O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P19	compound treatment	1.232	0.023	0.31	1.406	-0.0321	-0.44	-0.0902	-0.1682	1207795	CBDivE_008959	CC(C)COC(=O)C1=C(C)NC(=S)NC1c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.28	P20	compound treatment	1.199	-0.01	-0.14	1.367	-0.0711	-0.97	-0.7811	-0.798	3016206	CBDivE_008960	CC[n+]1c(C)n(c2ccccc2)c3ccc(cc13)S(=O)(=O)Nc4ccccc4.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A01	compound treatment	1.237	0.00933	0.13	1.427	-0.0178	-0.24	-0.0828	-0.3027	1918375	CBDivE_008961	CC(C)OC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNCCO)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A02	compound treatment	1.265	0.0373	0.5	1.427	-0.0178	-0.24	0.1843	0.3296	1918376	CBDivE_008962	Brc1ccc(/C=N/NC(=O)C2CC32CCC3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A03	compound treatment	1.27	0.0423	0.57	1.452	0.00718	0.1	0.473	0.8165	1918377	CBDivE_008963	CCc1[n+](C)ccn2cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A04	compound treatment	1.279	0.0513	0.69	1.433	-0.0118	-0.16	0.3757	0.5284	1406896	CBDivE_008964	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3ccc(OC(=O)c4ccccc4)cc3)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A05	compound treatment	1.296	0.0683	0.92	1.488	0.0432	0.59	1.0682	0.9766	1411866	CBDivE_008965	CC(=O)Nc1sc2CCCCc2c1CN3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A06	compound treatment	1.225	-0.00267	-0.04	1.382	-0.0628	-0.86	-0.6312	-0.7362	1918378	CBDivE_008966	C/C(=N/OC(=O)C1CC1c2ccccc2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A07	compound treatment	1.333	0.105	1.42	1.543	0.0982	1.34	1.9515	0.9996	1736144	CBDivE_008967	Cc1ccccc1C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A08	compound treatment	1.298	0.0703	0.95	1.537	0.0922	1.26	1.5597	0.9904	1918379	CBDivE_008968	CC/C(=N/NC(=O)N)/c1ccc(CCCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A09	compound treatment	1.289	0.0613	0.83	1.449	0.00418	0.06	0.6254	0.7541	1918380	CBDivE_008969	CCCCOc1nc(OCCCC)nc(n1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A10	compound treatment	1.281	0.0533	0.72	1.415	-0.0298	-0.41	0.2212	0.2677	1405895	CBDivE_008970	CN(C)CCC(=O)N1c2ccccc2Sc3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A11	compound treatment	1.262	0.0343	0.46	1.503	0.0582	0.79	0.8885	0.9671	1659706	CBDivE_008971	CCOC(=O)C1=C(C)NC(=O)NC1c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A12	compound treatment	1.251	0.0233	0.31	1.475	0.0302	0.41	0.5136	0.9912	1582319	CBDivE_008972	NCCC1CCCCC(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A13	compound treatment	1.322	0.0943	1.27	1.475	0.0302	0.41	1.1909	0.8904	1918381	CBDivE_008973	O=C(NC(=S)n1cnc2ccccc12)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A14	compound treatment	1.223	-0.00467	-0.06	1.475	0.0302	0.41	0.2465	0.5919	1918382	CBDivE_008974	OC(=O)CCCCC(=O)c1ccc(CC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A15	compound treatment	1.239	0.0113	0.15	1.493	0.0482	0.66	0.5727	0.8489	1918383	CBDivE_008975	Cc1nc2ccccc2c3c(NC(=O)c4ccccc4)c5ccccc5n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A16	compound treatment	1.201	-0.0267	-0.36	1.461	0.0162	0.22	-0.0984	-0.2331	1918384	CBDivE_008976	C/C(=N\NC(=O)CC(=O)O)/CN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A17	compound treatment	1.328	0.1	1.35	1.537	0.0922	1.26	1.8459	0.9993	1918385	CBDivE_008977	OS(=O)(=O)c1cc(ccc1/C=C/c2ccccc2)n3nc4ccc5c(cccc5c4n3)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A18	compound treatment	1.251	0.0233	0.31	1.41	-0.0348	-0.47	-0.1132	-0.1987	1221426	CBDivE_008978	CC(C)(C)S(=O)(=O)c1cc(sc1S(=O)(=O)C)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A19	compound treatment	1.267	0.0393	0.53	1.5	0.0552	0.75	0.9073	0.9854	1918386	CBDivE_008979	CN1CCN(CC1)C2=CC(=O)N(C2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	A20	compound treatment	1.192	-0.0357	-0.48	1.441	-0.00382	-0.05	-0.3771	-0.7791	1918387	CBDivE_008980	Cc1nn(CCc2ccccn2)c3[nH]c(=O)cc(C)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B01	compound treatment	1.233	0.00533	0.07	1.373	-0.0718	-0.98	-0.6417	-0.6534	1918388	CBDivE_008981	CCC(=O)c1ccc(CCCCC(=O)OC)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B02	compound treatment	1.246	0.0183	0.25	1.463	0.0182	0.25	0.3502	1.0	1918389	CBDivE_008982	NC(=O)N/N=C(\CCCCC(=O)O)/c1ccc(CC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B03	compound treatment	1.228	3.29E-4	0.0	1.409	-0.0358	-0.49	-0.3422	-0.7006	1410692	CBDivE_008983	CC1CN(C)CCC1OC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B04	compound treatment	1.232	0.00433	0.06	1.462	0.0172	0.23	0.207	0.8571	1918390	CBDivE_008984	CC(=O)OCCNC(=O)c1c(ncn1C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B05	compound treatment	1.218	-0.00967	-0.13	1.497	0.0522	0.71	0.4109	0.568	1918391	CBDivE_008985	CCN(CC)CC(O)CNC(=S)NC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B06	compound treatment	1.172	-0.0557	-0.75	1.408	-0.0368	-0.5	-0.8861	-0.9808	1918392	CBDivE_008986	Oc1ccc(/C=N/c2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B07	compound treatment	1.241	0.0133	0.18	1.48	0.0352	0.48	0.4664	0.9103	1918393	CBDivE_008987	Oc1nc2SCCCn2c(=O)c1C(c3ccc(Br)cc3)c4c(O)n5CCCSc5nc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B08	compound treatment	1.31	0.0823	1.11	1.404	-0.0408	-0.56	0.3918	0.3154	1918394	CBDivE_008988	CCCCCCc1cc(N)c(CCCCC(=O)O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B09	compound treatment	1.18	-0.0477	-0.64	1.458	0.0132	0.18	-0.3276	-0.4907	1283195	CBDivE_008989	CN(C)c1cc(NC(=O)CCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B10	compound treatment	1.29	0.0623	0.84	1.463	0.0182	0.25	0.7699	0.8782	1918395	CBDivE_008990	COc1cccc(/C=N/NC(=O)C2C3CCCCC23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B11	compound treatment	1.196	-0.0317	-0.43	1.387	-0.0578	-0.79	-0.8596	-0.9586	1918396	CBDivE_008991	[O-][N+](=O)/C(=C/1\NCCO1)/C(=C(/Cl)\N2CCOCC2)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B12	compound treatment	1.241	0.0133	0.18	1.438	-0.00682	-0.09	0.0614	0.3033	1116950	CBDivE_008992	Oc1c(Br)cc(Br)cc1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B13	compound treatment	1.268	0.0403	0.54	1.355	-0.0898	-1.22	-0.4814	-0.3592	1562269	CBDivE_008993	CC1(C)Oc2ccccc2C3OC(C)(CCC31)C=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B14	compound treatment	1.177	-0.0507	-0.68	1.455	0.0102	0.14	-0.3852	-0.5522	1434439	CBDivE_008994	Cc1nccn1CC2CCc3c(C2=O)c4ccccc4n3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B15	compound treatment	1.233	0.00533	0.07	1.399	-0.0458	-0.62	-0.391	-0.6216	1918397	CBDivE_008995	C/C(=N\NC(=O)Cc1c[nH]c2ccccc12)/c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B16	compound treatment	1.184	-0.0437	-0.59	1.446	0.00118	0.02	-0.4052	-0.6875	1180290	CBDivE_008996	CC1(C)CC(O)c2c(NCc3ccc(Cl)cc3)c4ccccc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B17	compound treatment	1.225	-0.00267	-0.04	1.446	0.00118	0.02	-0.0141	-0.3568	1865017	CBDivE_008997	Cn1cnc([N+](=O)[O-])c1C(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B18	compound treatment	1.175	-0.0527	-0.71	1.504	0.0592	0.81	0.0682	0.0634	1918398	CBDivE_008998	Oc1ccccc1C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B19	compound treatment	1.195	-0.0327	-0.44	1.381	-0.0638	-0.87	-0.927	-0.9503	1918399	CBDivE_008999	COc1ccc(/C=C/C(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	B20	compound treatment	1.168	-0.0597	-0.8	1.435	-0.00982	-0.13	-0.6639	-0.8135	1374039	CBDivE_009000	Fc1ccc(cc1)C(=O)Oc2ccc(OC(=O)c3ccc(F)cc3)c(c2)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C01	compound treatment	1.201	-0.0267	-0.36	1.429	-0.0158	-0.22	-0.4069	-0.9701	1684032	CBDivE_009001	COc1cc2CCNC(c3ccc(Br)cc3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C02	compound treatment	1.236	0.00833	0.11	1.434	-0.0108	-0.15	-0.0249	-0.1341	1918400	CBDivE_009002	Cc1ccsc1/C=N/c2cccc3c(=O)[nH][nH]c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C03	compound treatment	1.348	0.12	1.62	1.47	0.0252	0.34	1.3907	0.8381	1667480	CBDivE_009003	C[N+]1=C(Cc2ccccc2)c3cccn3CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C04	compound treatment	1.234	0.00633	0.09	1.398	-0.0468	-0.64	-0.3911	-0.6071	1401807	CBDivE_009004	CCOC(=O)c1[nH]c2c(OC)cc(OC)cc2c1CCN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C05	compound treatment	1.237	0.00933	0.13	1.509	0.0642	0.88	0.7079	0.8006	1918401	CBDivE_009005	OC1COC(Nc2cc(cc(c2)[N+](=O)[O-])C(=O)O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C06	compound treatment	1.236	0.00833	0.11	1.49	0.0452	0.62	0.5151	0.8225	1918402	CBDivE_009006	Cc1cc(C)n(/N=C\c2cc3ccccc3[nH]2)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C07	compound treatment	1.309	0.0813	1.1	1.451	0.00618	0.08	0.8354	0.7592	1918403	CBDivE_009007	Oc1ccc(Sc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C08	compound treatment	1.224	-0.00367	-0.05	1.435	-0.00982	-0.13	-0.1297	-0.9085	1679536	CBDivE_009008	Sc1nc2-c3ccccc3CC4(CCCCC4)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C09	compound treatment	1.253	0.0253	0.34	1.478	0.0332	0.45	0.5616	0.9904	1918404	CBDivE_009009	C=CCN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@H](N2C1=S)c5ccc6OCOc6c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C10	compound treatment	1.276	0.0483	0.65	1.506	0.0612	0.83	1.051	0.9926	1918405	CBDivE_009010	OC(=O)CN1C(=O)/C(=C\c2ccc(o2)c3ccccc3)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C11	compound treatment	1.267	0.0393	0.53	1.434	-0.0108	-0.15	0.2709	0.4918	1918406	CBDivE_009011	C/C(=N\NC(=O)C1CC21CCC2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C12	compound treatment	1.24	0.0123	0.17	1.377	-0.0678	-0.92	-0.5363	-0.5708	1918407	CBDivE_009012	O/N=C/1\CCCc2sc3CCC/C(=N\O)/c3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C13	compound treatment	1.302	0.0743	1.0	1.491	0.0462	0.63	1.1544	0.9749	1386473	CBDivE_009013	CC(=O)Nc1c(Cl)n(C(=O)C)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C14	compound treatment	1.271	0.0433	0.58	1.485	0.0402	0.55	0.8008	0.9995	1628042	CBDivE_009014	O=C(NC1CCCCC1NC(=O)C2CC32CCC3)C4CC54CCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C15	compound treatment	1.295	0.0673	0.91	1.49	0.0452	0.62	1.0779	0.9821	1918408	CBDivE_009015	OS(=O)(=O)c1ccccc1/C=C/c2ccc(cc2)c3ccc(\C=C\c4ccccc4S(=O)(=O)O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C16	compound treatment	1.207	-0.0207	-0.28	1.489	0.0442	0.6	0.2288	0.3447	1918409	CBDivE_009016	CC(C)(C)c1cc(Br)cc(/C=N/N2C(=O)c3ccccc3C2=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C17	compound treatment	1.301	0.0733	0.99	1.482	0.0372	0.51	1.058	0.9518	1918410	CBDivE_009017	CCOc1ccc(NC2OC(CO)C(O)C2O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C18	compound treatment	1.214	-0.0137	-0.18	1.482	0.0372	0.51	0.2281	0.4228	1263469	CBDivE_009018	OC1CCCCC1C2(CCCCC2)NC(=S)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C19	compound treatment	1.215	-0.0127	-0.17	1.506	0.0612	0.83	0.4691	0.5508	1918411	CBDivE_009019	Brc1cccc(/C=N/NC(=O)CNc2ccc(I)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	C20	compound treatment	1.211	-0.0167	-0.22	1.437	-0.00782	-0.11	-0.2344	-0.9418	1198565	CBDivE_009020	Cc1ccc(cc1)S(=O)(=O)c2ccc(Oc3cccc(C)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D01	compound treatment	1.205	-0.0227	-0.31	1.403	-0.0418	-0.57	-0.6195	-0.9574	1776735	CBDivE_009021	OC(CN1CCN(C/C=C/c2ccccc2)CC1)Cn3c4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D02	compound treatment	1.229	0.00133	0.02	1.377	-0.0678	-0.92	-0.6413	-0.6933	1918412	CBDivE_009022	CCCC1(CCC)C(=N)N(C)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D03	compound treatment	1.085	-0.143	-1.92	1.44	-0.00482	-0.07	-1.4074	-0.7308	1337959	CBDivE_009023	CN1C(=O)C(C2c3ccccc3Oc4c2c(=O)n(C)c(=O)n4C)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D04	compound treatment	1.21	-0.0177	-0.24	1.398	-0.0468	-0.64	-0.62	-0.9098	1918413	CBDivE_009024	Nc1nonc1Sc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D05	compound treatment	1.156	-0.0717	-0.97	1.448	0.00318	0.04	-0.653	-0.6747	1918414	CBDivE_009025	CN(C)/C=N/c1cc(C)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D06	compound treatment	1.26	0.0323	0.44	1.469	0.0242	0.33	0.5416	0.9905	1667475	CBDivE_009026	O=C(Oc1ccc(OC(=O)C2C3CCCCC23)cc1)C4C5CCCCC45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D07	compound treatment	1.223	-0.00467	-0.06	1.462	0.0172	0.23	0.1211	0.4992	1562840	CBDivE_009027	CC(C)Cc1ccc(cc1)C(C)C(=O)NC(C)Cc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D08	compound treatment	1.192	-0.0357	-0.48	1.401	-0.0438	-0.6	-0.7628	-0.9942	1447394	CBDivE_009028	COc1cc(CC2C(=O)N(C)C(=O)N(C)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D09	compound treatment	1.193	-0.0347	-0.47	1.402	-0.0428	-0.58	-0.7436	-0.994	1918415	CBDivE_009029	Cc1sc(c(C(=O)O)c1Br)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D10	compound treatment	1.163	-0.0647	-0.87	1.45	0.00518	0.07	-0.567	-0.6477	1918416	CBDivE_009030	[O-][N+](=O)c1ccccc1N/N=C/C(=N\Nc2ccccc2[N+](=O)[O-])/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D11	compound treatment	1.166	-0.0617	-0.83	1.547	0.102	1.39	0.397	0.2446	1918417	CBDivE_009031	Clc1cccc(c1)C(=O)NN=C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D12	compound treatment	1.257	0.0293	0.4	1.475	0.0302	0.41	0.5708	0.9998	1539897	CBDivE_009032	Cc1cc(C)c2nc3CC(C)(C)CC(=O)c3c(N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D13	compound treatment	1.249	0.0213	0.29	1.423	-0.0218	-0.3	-0.0069	-0.0167	1918418	CBDivE_009033	Nc1c(O)cc(c2cc(O)ccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D14	compound treatment	1.208	-0.0197	-0.27	1.398	-0.0468	-0.64	-0.6391	-0.9244	1262918	CBDivE_009034	CSc1ccc2C(=O)NC(=O)c3cccc1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D15	compound treatment	1.183	-0.0447	-0.6	1.461	0.0162	0.22	-0.2701	-0.4209	1918419	CBDivE_009035	CCN(CC)CCN1C(=O)N(CCN(CC)CC)C(=O)C(CC)(CC)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D16	compound treatment	1.246	0.0183	0.25	1.378	-0.0668	-0.91	-0.4694	-0.4972	1918420	CBDivE_009036	NC(=S)N/N=C/1\c2ccccc2-c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D17	compound treatment	1.195	-0.0327	-0.44	1.421	-0.0238	-0.32	-0.5413	-0.9887	1918421	CBDivE_009037	CCCCCCNC(=O)c1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D18	compound treatment	1.203	-0.0247	-0.33	1.417	-0.0278	-0.38	-0.5036	-0.9979	1664989	CBDivE_009038	O=C(Nc1cc(nn1c2ccccc2)c3ccc(NC(=O)c4ccccc4)cc3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D19	compound treatment	1.263	0.0353	0.48	1.488	0.0432	0.59	0.7534	0.9945	1918422	CBDivE_009039	O=C1C2C(C3C=CC2C4C3C(=O)N(C4=O)c5nnn[nH]5)C(=O)N1c6nnn[nH]6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	D20	compound treatment	1.194	-0.0337	-0.45	1.479	0.0342	0.47	0.0084	0.0129	1458798	CBDivE_009040	Cc1ccc2nc3N(CCc3c(N)c2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E01	compound treatment	1.215	-0.0127	-0.17	1.433	-0.0118	-0.16	-0.2348	-0.9996	1571294	CBDivE_009041	C1C2N(N=C1c3ccccc3)C4(CCCCC4)Oc5ccccc25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E02	compound treatment	1.21	-0.0177	-0.24	1.424	-0.0208	-0.28	-0.3693	-0.9962	1352267	CBDivE_009042	Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E03	compound treatment	1.189	-0.0387	-0.52	1.496	0.0512	0.7	0.1246	0.143	1918423	CBDivE_009043	O=C(N/N=C/c1ccco1)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E04	compound treatment	1.243	0.0153	0.21	1.481	0.0362	0.49	0.4951	0.9255	1918424	CBDivE_009044	C/C(=N\OC(=O)c1ccccc1c2ccccc2C(=O)O/N=C(\C)/c3ccccc3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E05	compound treatment	1.279	0.0513	0.69	1.488	0.0432	0.59	0.906	0.9967	1128519	CBDivE_009045	CC(=O)OC1C2SCC1(CCC2OC(=O)C)NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E06	compound treatment	1.205	-0.0227	-0.31	1.468	0.0232	0.32	0.0073	0.0165	1918425	CBDivE_009046	Cc1cc(C)n(/N=C\c2c(O)ccc3ccccc23)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E07	compound treatment	1.246	0.0183	0.25	1.549	0.104	1.42	1.1794	0.8179	1694366	CBDivE_009047	CCOc1ccc(NCC(O)Cn2c3ccccc3c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E08	compound treatment	1.259	0.0313	0.42	1.502	0.0572	0.78	0.8502	0.9586	1918426	CBDivE_009048	CCCCOc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E09	compound treatment	1.322	0.0943	1.27	1.419	-0.0258	-0.35	0.6509	0.493	1288863	CBDivE_009049	Ic1ccc(cc1)C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E10	compound treatment	1.245	0.0173	0.23	1.463	0.0182	0.25	0.3406	0.9996	1918427	CBDivE_009050	CCN(CC)C(=O)/C(=C(/Sc1ncccn1)\c2ccccc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E11	compound treatment	1.292	0.0643	0.87	1.491	0.0462	0.63	1.059	0.9876	1387947	CBDivE_009051	O=C(NC(=S)n1cnc2ccccc12)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E12	compound treatment	1.213	-0.0147	-0.2	1.451	0.00618	0.08	-0.0803	-0.3735	1918428	CBDivE_009052	OC(=O)c1ccccc1NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E13	compound treatment	1.269	0.0413	0.56	1.541	0.0962	1.31	1.3217	0.9274	1661768	CBDivE_009053	Cc1ccc(cc1)C(=O)c2coc3ccc(O)c(Cl)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E14	compound treatment	1.213	-0.0147	-0.2	1.445	1.82E-4	0.0	-0.1382	-0.6982	1721636	CBDivE_009054	O=C(N1CCc2ccccc12)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E15	compound treatment	1.302	0.0743	1.0	1.425	-0.0198	-0.27	0.518	0.4987	1918429	CBDivE_009055	OC(=O)c1cccc(c1)N2C(=O)C3C(C4C=CC3C5C4C(=O)N(C5=O)c6cccc(c6)C(=O)O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E16	compound treatment	1.377	0.149	2.01	1.42	-0.0248	-0.34	1.1852	0.5802	1918430	CBDivE_009056	CCCCC/C(=N\NC(=O)Nc1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E17	compound treatment	1.281	0.0533	0.72	1.447	0.00218	0.03	0.5298	0.7357	1780911	CBDivE_009057	OCC1OC(Nc2ccc(Br)cc2)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E18	compound treatment	1.216	-0.0117	-0.16	1.45	0.00518	0.07	-0.0614	-0.3556	1918431	CBDivE_009058	CC(C)c1cc(Cl)c(C)cc1OC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E19	compound treatment	1.286	0.0583	0.79	1.519	0.0742	1.01	1.2717	0.9923	1008205	CBDivE_009059	Cc1ccc(cc1)S(=O)(=O)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	E20	compound treatment	1.28	0.0523	0.71	1.442	-0.00282	-0.04	0.472	0.6676	1918432	CBDivE_009060	O=C(Oc1cccc2C(=O)c3cccc(OC(=O)C4C5CCCCC45)c3C(=O)c12)C6C7CCCCC67
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F01	compound treatment	1.171	-0.0567	-0.76	1.373	-0.0718	-0.98	-1.2331	-0.9925	1918433	CBDivE_009061	CC(C)Cc1ccc(cc1)C(C)C(=O)NC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F02	compound treatment	1.17	-0.0577	-0.78	1.395	-0.0498	-0.68	-1.0305	-0.9977	1223600	CBDivE_009062	CN(C)c1cc(NC(=O)CCc2ccccc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F03	compound treatment	1.157	-0.0707	-0.95	1.429	-0.0158	-0.22	-0.8267	-0.8457	1615414	CBDivE_009063	O=C(C1C2CCCCC12)N3CCc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F04	compound treatment	1.206	-0.0217	-0.29	1.352	-0.0928	-1.27	-1.1017	-0.8481	1918434	CBDivE_009064	Clc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F05	compound treatment	1.241	0.0133	0.18	1.448	0.00318	0.04	0.1578	0.8532	1918435	CBDivE_009065	Clc1ccc(NC(=O)NN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F06	compound treatment	1.199	-0.0287	-0.39	1.41	-0.0348	-0.47	-0.6092	-0.9948	1918436	CBDivE_009066	O=C1NC(=O)/C(=C\NCCc2c[nH]c3ccccc23)/C(=O)N1Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F07	compound treatment	1.235	0.00733	0.1	1.377	-0.0678	-0.92	-0.584	-0.6279	1918437	CBDivE_009067	OS(=O)(=O)c1ccc(N/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F08	compound treatment	1.245	0.0173	0.23	1.468	0.0232	0.32	0.3888	0.989	1918438	CBDivE_009068	O=C(NNC(=O)c1ccccc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F09	compound treatment	1.14	-0.0877	-1.18	1.439	-0.00582	-0.08	-0.8924	-0.7528	1918439	CBDivE_009069	CCOc1ccc(/N=C/c2ccc(cc2O)N(CC)CC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F10	compound treatment	1.217	-0.0107	-0.14	1.474	0.0292	0.4	0.1796	0.4244	1918440	CBDivE_009070	CN(C)CC(=O)Nc1cc(C)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F11	compound treatment	1.179	-0.0487	-0.66	1.503	0.0582	0.79	0.0967	0.0939	1918441	CBDivE_009071	Cc1cccc(c1)c2nc(c([nH]2)c3ccc(cc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F12	compound treatment	1.141	-0.0867	-1.17	1.414	-0.0308	-0.42	-1.1239	-0.9046	1918442	CBDivE_009072	Brc1ccccc1C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccccc4Br)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F13	compound treatment	1.201	-0.0267	-0.36	1.493	0.0482	0.66	0.2102	0.2806	1918443	CBDivE_009073	CCOC(=O)N/N=C(\C)/CC(=O)Nc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F14	compound treatment	1.204	-0.0237	-0.32	1.439	-0.00582	-0.08	-0.2819	-0.8567	1388347	CBDivE_009074	CC1(C)CC(=O)c2c(N)c3ccccc3nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F15	compound treatment	1.239	0.0113	0.15	1.487	0.0422	0.58	0.5148	0.865	1779142	CBDivE_009075	CCOC(=O)c1c(NC(=O)c2ccc(Cl)c(c2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F16	compound treatment	1.217	-0.0107	-0.14	1.438	-0.00682	-0.09	-0.1675	-0.9776	1918444	CBDivE_009076	CC(C)(C)S(=O)(=O)c1sc(C=O)cc1C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F17	compound treatment	1.182	-0.0457	-0.62	1.475	0.0302	0.41	-0.1446	-0.1952	1536764	CBDivE_009077	O=C(Nc1ccc(Nc2ccccc2)cc1)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F18	compound treatment	1.239	0.0113	0.15	1.456	0.0112	0.15	0.2159	1.0	1918445	CBDivE_009078	CCN1C(=O)c2cccc3c(ccc1c23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F19	compound treatment	1.179	-0.0487	-0.66	1.484	0.0392	0.53	-0.0865	-0.1022	1125472	CBDivE_009079	CNS(=O)(=O)c1ccc2c(O)cc(cc2c1)S(=O)(=O)NC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	F20	compound treatment	1.182	-0.0457	-0.62	1.387	-0.0578	-0.79	-0.9932	-0.9926	1918446	CBDivE_009080	CCOC(=O)Cc1ccc2sc(C)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G01	compound treatment	1.2	-0.0277	-0.37	1.425	-0.0198	-0.27	-0.4551	-0.9874	1161091	CBDivE_009081	COc1ccc(cc1O)C2N(CCN2c3ccc(C)cc3)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G02	compound treatment	1.181	-0.0467	-0.63	1.399	-0.0458	-0.62	-0.887	-1.0	1370466	CBDivE_009082	C(N1CCCCC1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G03	compound treatment	1.314	0.0863	1.16	1.469	0.0242	0.33	1.0567	0.873	1918447	CBDivE_009083	C/C(=N\NC(=O)C1CC21CCC2)/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G04	compound treatment	1.246	0.0183	0.25	1.451	0.00618	0.08	0.2345	0.8974	1918448	CBDivE_009084	Oc1ccc(/C=C\2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G05	compound treatment	1.249	0.0213	0.29	1.467	0.0222	0.3	0.4174	0.9997	1918449	CBDivE_009085	COC(=O)C(/N=C/c1cc(Br)ccc1O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G06	compound treatment	1.236	0.00833	0.11	1.424	-0.0208	-0.28	-0.1213	-0.3972	1918450	CBDivE_009086	CCCC1(CCCCC1)OC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G07	compound treatment	1.258	0.0303	0.41	1.473	0.0282	0.38	0.5611	0.9995	1918451	CBDivE_009087	Fc1ccc(cc1)[C@H]2N3[C@H](Cc4c2[nH]c5ccccc45)C(=O)N(C6CCCCC6)C3=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G08	compound treatment	1.236	0.00833	0.11	1.462	0.0172	0.23	0.2451	0.9433	1547473	CBDivE_009088	CC(=C1C(=O)N(C(=S)N(C1=O)c2ccccc2)c3ccccc3)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G09	compound treatment	1.258	0.0303	0.41	1.494	0.0492	0.67	0.7636	0.9719	1918452	CBDivE_009089	Clc1ccc(cc1)N(CCCCN2C(=O)c3ccccc3C2=O)C(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G10	compound treatment	1.231	0.00333	0.04	1.492	0.0472	0.64	0.4867	0.7546	1918453	CBDivE_009090	CN(C)CCO/N=C/1\CCCc2sccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G11	compound treatment	1.319	0.0913	1.23	1.497	0.0522	0.71	1.3744	0.966	1918454	CBDivE_009091	C/C(=N/NC(=O)C1C2CCCCC12)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G12	compound treatment	1.168	-0.0597	-0.8	1.477	0.0322	0.44	-0.2589	-0.2824	1918455	CBDivE_009092	COc1cc2ccccc2cc1C(=O)N/N=C/c3cc(Br)cc(Br)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G13	compound treatment	1.256	0.0283	0.38	1.432	-0.0128	-0.17	0.1466	0.3489	1267926	CBDivE_009093	COc1ccc(OC)c(c1)C(=O)c2coc3c(Cl)c(Cl)c(O)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G14	compound treatment	1.237	0.00933	0.13	1.477	0.0322	0.44	0.3993	0.8746	1640140	CBDivE_009094	O=C(Oc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G15	compound treatment	1.248	0.0203	0.27	1.548	0.103	1.41	1.1888	0.8293	1918456	CBDivE_009095	Oc1ccccc1C2=Nc3ccccc3SC(C2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G16	compound treatment	1.233	0.00533	0.07	1.501	0.0562	0.77	0.5926	0.7701	1918457	CBDivE_009096	Clc1ccc(N/C=C\2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G17	compound treatment	1.294	0.0663	0.89	1.559	0.114	1.56	1.7337	0.9654	1775453	CBDivE_009097	OCC1OC(Nc2cccc3ccccc23)C(O)C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G18	compound treatment	1.253	0.0253	0.34	1.437	-0.00782	-0.11	0.1662	0.4644	1483199	CBDivE_009098	COc1ccc(NC(=O)C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G19	compound treatment	1.294	0.0663	0.89	1.495	0.0502	0.68	1.1166	0.9912	1918458	CBDivE_009099	CN(C)c1ccc(cc1)/C(=N/N=C(\C)/c2ccc(cc2)N(C)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	G20	compound treatment	1.235	0.00733	0.1	1.42	-0.0248	-0.34	-0.1694	-0.4804	1918459	CBDivE_009100	CC(=O)OC1(CCCCC1)C(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H01	compound treatment	1.178	-0.0497	-0.67	1.326	-0.119	-1.62	-1.6195	-0.9237	1918460	CBDivE_009101	O=C(N/N=C/c1ccccc1)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H02	compound treatment	1.2	-0.0277	-0.37	1.422	-0.0228	-0.31	-0.484	-0.9959	1873537	CBDivE_009102	[O-][N+](=O)c1cccc(c1)C(=O)NN2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H03	compound treatment	1.231	0.00333	0.04	1.389	-0.0558	-0.76	-0.5065	-0.6642	1477072	CBDivE_009103	Cc1c[nH]c2cccc(OCC(O)CNC(C)(C)C)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H04	compound treatment	1.241	0.0133	0.18	1.381	-0.0638	-0.87	-0.4882	-0.5494	1918461	CBDivE_009104	C/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])/c2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H05	compound treatment	1.162	-0.0657	-0.89	1.409	-0.0358	-0.49	-0.9718	-0.9606	1918462	CBDivE_009105	COc1ccc(/C=N/NC(=O)C(NC(=O)c2ccccc2)c3n[nH]c(=O)c4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H06	compound treatment	1.223	-0.00467	-0.06	1.4	-0.0448	-0.61	-0.4767	-0.7759	1918463	CBDivE_009106	CN1CCN(CCC(=O)N/N=C/c2ccccc2O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H07	compound treatment	1.183	-0.0447	-0.6	1.42	-0.0248	-0.34	-0.6654	-0.9628	1598067	CBDivE_009107	COc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3cccc(F)c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H08	compound treatment	1.233	0.00533	0.07	1.411	-0.0338	-0.46	-0.2753	-0.5897	1400796	CBDivE_009108	Cc1ccc(NC(=O)C(Nc2ccc(C)c(C)c2)(c3ccccc3)c4ccccc4)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H09	compound treatment	1.18	-0.0477	-0.64	1.426	-0.0188	-0.26	-0.6362	-0.9188	1918464	CBDivE_009109	CC(C)OC(=O)c1ccccc1C(=O)c2ccc(N)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H10	compound treatment	1.251	0.0233	0.31	1.456	0.0112	0.15	0.3304	0.9447	1918465	CBDivE_009110	Oc1ccccc1/C=N/NS(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H11	compound treatment	1.317	0.0893	1.21	1.381	-0.0638	-0.87	0.2368	0.1593	1918466	CBDivE_009111	CCN/1C(=O)CS\C1=N\C2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H12	compound treatment	1.25	0.0223	0.3	1.488	0.0432	0.59	0.6294	0.9516	1340388	CBDivE_009112	CN(C)c1cc(NC(=O)Cc2ccccc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H13	compound treatment	1.285	0.0573	0.77	1.521	0.0762	1.04	1.2815	0.9894	1597597	CBDivE_009113	CN1CCCc2c(N)c3cc(Br)ccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H14	compound treatment	1.224	-0.00367	-0.05	1.467	0.0222	0.3	0.1789	0.5836	1918467	CBDivE_009114	Cc1cccc2c(N)c3C(=O)CC(C)(C)Cc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H15	compound treatment	1.204	-0.0237	-0.32	1.42	-0.0248	-0.34	-0.4651	-0.9996	1918468	CBDivE_009115	C(c1ccccc1)n2nc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H16	compound treatment	1.172	-0.0557	-0.75	1.439	-0.00582	-0.08	-0.5872	-0.7775	1918469	CBDivE_009116	O/N=C(\CCc1ccccc1)/C2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H17	compound treatment	1.193	-0.0347	-0.47	1.473	0.0282	0.38	-0.059	-0.0975	1918470	CBDivE_009117	NC(=O)NC(=O)Nc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H18	compound treatment	1.252	0.0243	0.33	1.385	-0.0598	-0.82	-0.3447	-0.392	1918471	CBDivE_009118	Brc1cc(Br)c(OC(=O)c2ccccc2C(=O)OCC#C)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H19	compound treatment	1.207	-0.0207	-0.28	1.486	0.0412	0.56	0.1999	0.3188	1918472	CBDivE_009119	Brc1cccc(/C=N/NC(=O)C2CC2C(=O)N\N=C\c3cccc(Br)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	H20	compound treatment	1.189	-0.0387	-0.52	1.436	-0.00882	-0.12	-0.4539	-0.8479	1918473	CBDivE_009120	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N/N=C/c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I01	compound treatment	1.243	0.0153	0.21	1.413	-0.0318	-0.43	-0.1606	-0.3341	1235323	CBDivE_009121	Cc1cc(NS(=O)(=O)c2ccccc2)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I02	compound treatment	1.193	-0.0347	-0.47	1.441	-0.00382	-0.05	-0.3676	-0.781	1918474	CBDivE_009122	CCN1/C(=C/C(=O)c2ccccc2)/Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I03	compound treatment	1.27	0.0423	0.57	1.502	0.0572	0.78	0.9552	0.9883	1918475	CBDivE_009123	Brc1ccc(/C=N/NC(=O)CN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I04	compound treatment	1.197	-0.0307	-0.41	1.435	-0.00982	-0.13	-0.3873	-0.8905	1232652	CBDivE_009124	COC(=O)CCC(=O)Nc1cccc2c(NC(=O)CCC(=O)OC)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I05	compound treatment	1.253	0.0253	0.34	1.477	0.0322	0.44	0.5519	0.9923	1918476	CBDivE_009125	COc1ccc(/C=N/c2ccc(O)c(c2)c3nc4ccccc4s3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I06	compound treatment	1.218	-0.00967	-0.13	1.453	0.00818	0.11	-0.0134	-0.0778	1641573	CBDivE_009126	CN1CCN(CCCn2nnc3c(=O)oc4ccccc4c23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I07	compound treatment	1.286	0.0583	0.79	1.528	0.0832	1.13	1.3585	0.984	1918477	CBDivE_009127	COC(=O)c1ccc2nc(NC(=O)c3ccccc3[N+](=O)[O-])sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I08	compound treatment	1.229	0.00133	0.02	1.502	0.0572	0.78	0.564	0.7232	1177099	CBDivE_009128	CC(N)C1(CC2CC3CC(O)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I09	compound treatment	1.235	0.00733	0.1	1.483	0.0382	0.52	0.4381	0.8266	1918478	CBDivE_009129	Cc1cc(C)c(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c(C)c1CCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I10	compound treatment	1.257	0.0293	0.4	1.514	0.0692	0.94	0.9469	0.9256	1918479	CBDivE_009130	CCCCCCC(=O)NC(Nc1cccc2ccccc12)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I11	compound treatment	1.319	0.0913	1.23	1.498	0.0532	0.73	1.384	0.9681	1625189	CBDivE_009131	C(Sc1nccs1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I12	compound treatment	1.204	-0.0237	-0.32	1.501	0.0562	0.77	0.3159	0.3806	1725100	CBDivE_009132	CC1CC(OC(=O)c2ccccc2)(C#C)C(C)CN1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I13	compound treatment	1.284	0.0563	0.76	1.472	0.0272	0.37	0.7994	0.9455	1493255	CBDivE_009133	CCC(=O)N(Cc1ccncc1)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I14	compound treatment	1.263	0.0353	0.48	1.454	0.00918	0.13	0.4256	0.8636	1918480	CBDivE_009134	CCCCC1CC1C(=O)NNC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I15	compound treatment	1.252	0.0243	0.33	1.499	0.0542	0.74	0.7545	0.9333	1918481	CBDivE_009135	Oc1ccc(cc1[C@H]2NCC[C@@]3(O)CCCC[C@H]23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I16	compound treatment	1.234	0.00633	0.09	1.455	0.0102	0.14	0.1586	0.9727	1466749	CBDivE_009136	CCC(C)NC(=O)c1ccc(cc1)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I17	compound treatment	1.304	0.0763	1.03	1.508	0.0632	0.86	1.3374	0.9961	1918482	CBDivE_009137	[O-][N+](=O)c1cccc(Sc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I18	compound treatment	1.228	3.29E-4	0.0	1.519	0.0742	1.01	0.7184	0.7102	1879025	CBDivE_009138	Cc1cc(ccc1NC(=O)C2CC32CCC3)c4ccc(NC(=O)C5CC65CCC6)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I19	compound treatment	1.322	0.0943	1.27	1.531	0.0862	1.18	1.7308	0.9992	1918483	CBDivE_009139	[O-][N+](=O)c1ccc(SCCNc2ccccc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	I20	compound treatment	1.244	0.0163	0.22	1.452	0.00718	0.1	0.225	0.9334	1459340	CBDivE_009140	Oc1ccccc1NC(=O)CCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J01	compound treatment	1.194	-0.0337	-0.45	1.423	-0.0218	-0.3	-0.5316	-0.979	1918484	CBDivE_009141	OCCc1ccc(cc1)N2C(=O)C3C(C4C=CC3C5C4C(=O)N(C5=O)c6ccc(CCO)cc6)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J02	compound treatment	1.21	-0.0177	-0.24	1.485	0.0402	0.55	0.2189	0.3663	1918485	CBDivE_009142	Nc1nc(N)nc(n1)c2cccc(c2)c3nc(N)nc(N)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J03	compound treatment	1.152	-0.0757	-1.02	1.378	-0.0668	-0.91	-1.3661	-0.9984	1691661	CBDivE_009143	CCCCn1c(=O)[nH]c2nc3cc(NC(=O)C)ccc3nc2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J04	compound treatment	1.217	-0.0107	-0.14	1.452	0.00718	0.1	-0.0325	-0.1869	1918486	CBDivE_009144	COc1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J05	compound treatment	1.157	-0.0707	-0.95	1.437	-0.00782	-0.11	-0.7495	-0.7813	1393066	CBDivE_009145	CC1(C)CC(=O)C2=C(C1)Nc3cc(Cl)ccc3S2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J06	compound treatment	1.233	0.00533	0.07	1.395	-0.0498	-0.68	-0.4295	-0.6288	1598183	CBDivE_009146	Oc1c(Br)cc(Cl)cc1C(=O)Nc2cc(ccc2Cl)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J07	compound treatment	1.229	0.00133	0.02	1.432	-0.0128	-0.17	-0.1109	-0.6313	1918487	CBDivE_009147	O=C(NNC(=O)c1ccccc1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J08	compound treatment	1.246	0.0183	0.25	1.464	0.0192	0.26	0.3598	0.9996	1616649	CBDivE_009148	OC(=O)CCCC(=O)Nc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J09	compound treatment	1.175	-0.0527	-0.71	1.451	0.00618	0.08	-0.4428	-0.6189	1117764	CBDivE_009149	CN(C)c1cc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c5ccccc5n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J10	compound treatment	1.231	0.00333	0.04	1.44	-0.00482	-0.07	-0.0147	-0.1847	1918488	CBDivE_009150	CC1=NN(C(=O)C1Cc2ccccc2)c3c(F)c(F)c(F)c(F)c3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J11	compound treatment	1.224	-0.00367	-0.05	1.433	-0.0118	-0.16	-0.149	-0.8836	1393681	CBDivE_009151	O=C(N1CCCCC1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J12	compound treatment	1.203	-0.0247	-0.33	1.449	0.00418	0.06	-0.195	-0.5775	1127185	CBDivE_009152	CC1(C)CC(O)c2c(N)c3ccccc3nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J13	compound treatment	1.244	0.0163	0.22	1.425	-0.0198	-0.27	-0.0353	-0.1013	1918489	CBDivE_009153	CN1CCN(CCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J14	compound treatment	1.2	-0.0277	-0.37	1.362	-0.0828	-1.13	-1.0625	-0.8933	1918490	CBDivE_009154	CCCCC1(CCCC)C(=N)N(C)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J15	compound treatment	1.202	-0.0257	-0.35	1.492	0.0472	0.64	0.2101	0.2875	1559233	CBDivE_009155	CC1(C)Oc2ccccc2C3OC(C)(CCC31)C#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J16	compound treatment	1.155	-0.0727	-0.98	1.443	-0.00182	-0.02	-0.7108	-0.7248	1918491	CBDivE_009156	Oc1[nH]c(SC(c2ccccc2)c3ccccc3)nc(=O)c1C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J17	compound treatment	1.18	-0.0477	-0.64	1.456	0.0112	0.15	-0.3469	-0.5249	1918492	CBDivE_009157	CCCCOc1ccc(cc1)C2CC(=O)C3=C(C2)c4c(NC3c5ccc6ccccc6n5)ccc7ccccc47
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J18	compound treatment	1.124	-0.104	-1.4	1.419	-0.0258	-0.35	-1.2379	-0.8583	1918493	CBDivE_009158	OC(CC=C)(CC=C)C1=CCC(CC=C)NC1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J19	compound treatment	1.183	-0.0447	-0.6	1.491	0.0462	0.63	0.0192	0.022	1918494	CBDivE_009159	C/C(=N\Nc1ccc(cc1)S(=O)(=O)O)/CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	J20	compound treatment	1.232	0.00433	0.06	1.469	0.0242	0.33	0.2745	0.8196	1273526	CBDivE_009160	CCn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K01	compound treatment	1.267	0.0393	0.53	1.459	0.0142	0.19	0.5119	0.9065	1918495	CBDivE_009161	COc1ccc(cc1)C2CC(=Nc3cc(ccc3S2)C(F)(F)F)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K02	compound treatment	1.227	-6.71E-4	-0.01	1.418	-0.0268	-0.37	-0.265	-0.7244	1144029	CBDivE_009162	Clc1ccc(cc1)S(=O)(=O)n2c(nc3ccccc23)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K03	compound treatment	1.266	0.0383	0.52	1.438	-0.00682	-0.09	0.2999	0.5708	1918496	CBDivE_009163	[O-][N+](=O)c1ccccc1/C=N/NC(=O)CN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K04	compound treatment	1.201	-0.0267	-0.36	1.442	-0.00282	-0.04	-0.2816	-0.7782	1918497	CBDivE_009164	Clc1cccc(c1)C(=O)N/N=C/c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K05	compound treatment	1.318	0.0903	1.22	1.458	0.0132	0.18	0.9888	0.8027	1918498	CBDivE_009165	COc1ccc(/C=C/2\SC(=O)N(CC(=O)NNC(=O)c3ccccc3O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K06	compound treatment	1.248	0.0203	0.27	1.435	-0.00982	-0.13	0.0993	0.3252	1918499	CBDivE_009166	Cc1cc2n(n1)c3cc(C)nn3c4cc(C)nn24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K07	compound treatment	1.233	0.00533	0.07	1.459	0.0142	0.19	0.1876	0.9092	1241978	CBDivE_009167	OC(CNc1cccc2ccccc12)Cn3c4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K08	compound treatment	1.201	-0.0267	-0.36	1.477	0.0322	0.44	0.0559	0.0985	1373999	CBDivE_009168	COc1cc(=O)[nH]c(=O)n1C(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K09	compound treatment	1.251	0.0233	0.31	1.476	0.0312	0.43	0.5232	0.989	1918500	CBDivE_009169	O=C1OC2(CCCCC2)C(=C1)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K10	compound treatment	1.226	-0.00167	-0.02	1.49	0.0452	0.62	0.4197	0.6808	1918501	CBDivE_009170	CCC(CCCC1CCNC(=O)N1)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K11	compound treatment	1.295	0.0673	0.91	1.44	-0.00482	-0.07	0.5958	0.6542	1918502	CBDivE_009171	Nc1ccc(Sc2nc3ccccc3s2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K12	compound treatment	1.224	-0.00367	-0.05	1.425	-0.0198	-0.27	-0.2261	-0.823	1918503	CBDivE_009172	Cc1sc(CCCCC(=O)O)c(N)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K13	compound treatment	1.238	0.0103	0.14	1.498	0.0532	0.73	0.6113	0.8278	1918504	CBDivE_009173	[O-][N+](=O)c1ccc(c(Cl)c1)S(=O)(=O)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K14	compound treatment	1.191	-0.0367	-0.49	1.46	0.0152	0.21	-0.2034	-0.3793	1918505	CBDivE_009174	CC(C)(C)c1cc(Br)cc(/C=N/c2cccc3ccccc23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K15	compound treatment	1.244	0.0163	0.22	1.479	0.0342	0.47	0.4854	0.9414	1013662	CBDivE_009175	Cc1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K16	compound treatment	1.239	0.0113	0.15	1.49	0.0452	0.62	0.5437	0.8566	1918506	CBDivE_009176	OC(=O)CCCCc1sc2CCCC(=O)c2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K17	compound treatment	1.28	0.0523	0.71	1.464	0.0192	0.26	0.6841	0.9087	1918507	CBDivE_009177	[O-][N+](=O)c1ccc(cc1[N+](=O)[O-])N2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K18	compound treatment	1.229	0.00133	0.02	1.436	-0.00882	-0.12	-0.0723	-0.5951	1378375	CBDivE_009178	O=C(Oc1ccccc1OC(=O)C2C3CCCCC23)C4C5CCCCC45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K19	compound treatment	1.32	0.0923	1.25	1.485	0.0402	0.55	1.2682	0.932	1918508	CBDivE_009179	Cc1ccc2c(C)[n+](CC#C)ccn12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	K20	compound treatment	1.262	0.0343	0.46	1.516	0.0712	0.97	1.0138	0.9427	1918509	CBDivE_009180	COc1ccc(cc1)N2C(=O)CC(S/C(=N\c3ccccc3)/N)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L01	compound treatment	1.198	-0.0297	-0.4	1.382	-0.0628	-0.86	-0.8888	-0.94	1918510	CBDivE_009181	CN1CCc2c1nc3ccccc3c2NC(=O)CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L02	compound treatment	1.175	-0.0527	-0.71	1.362	-0.0828	-1.13	-1.301	-0.9751	1918511	CBDivE_009182	Cn1cnc([N+](=O)[O-])c1C(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L03	compound treatment	1.243	0.0153	0.21	1.422	-0.0228	-0.31	-0.0738	-0.1975	1918512	CBDivE_009183	COC(=O)CCCC(=O)c1cc(sc1C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L04	compound treatment	1.173	-0.0547	-0.74	1.399	-0.0458	-0.62	-0.9633	-0.9966	1314035	CBDivE_009184	O=C(Nc1cccc2ccccc12)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L05	compound treatment	1.128	-0.0997	-1.34	1.46	0.0152	0.21	-0.8044	-0.5913	1918513	CBDivE_009185	[O-][N+](=O)c1cccc(/C=N\OC(=O)C2CC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L06	compound treatment	1.234	0.00633	0.09	1.376	-0.0688	-0.94	-0.6032	-0.6401	1865016	CBDivE_009186	Cc1ccc(NC(=O)c2c(ncn2C)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L07	compound treatment	1.183	-0.0447	-0.6	1.437	-0.00782	-0.11	-0.5015	-0.8195	1918514	CBDivE_009187	Fc1c(F)c(C(=O)NCc2ccccc2)c(F)c(C(=O)NCc3ccccc3)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L08	compound treatment	1.181	-0.0467	-0.63	1.435	-0.00982	-0.13	-0.5399	-0.8387	1686352	CBDivE_009188	CC1CCN(CC1)C(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L09	compound treatment	1.221	-0.00667	-0.09	1.434	-0.0108	-0.15	-0.1679	-0.9719	1399995	CBDivE_009189	CCN(CC)CCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L10	compound treatment	1.216	-0.0117	-0.16	1.403	-0.0418	-0.57	-0.5146	-0.8698	1918515	CBDivE_009190	O=C1c2ccccc2-c3nc(nc4ccc(Nc5ccc(Oc6ccccc6)cc5)c1c34)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L11	compound treatment	1.197	-0.0307	-0.41	1.407	-0.0378	-0.52	-0.6572	-0.994	1918516	CBDivE_009191	O=C(N1CCCCCC1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L12	compound treatment	1.211	-0.0167	-0.22	1.402	-0.0428	-0.58	-0.5719	-0.914	1301241	CBDivE_009192	CCNc1c2C(=O)CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L13	compound treatment	1.248	0.0203	0.27	1.422	-0.0228	-0.31	-0.0261	-0.0629	3016493	CBDivE_009193	Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L14	compound treatment	1.219	-0.00867	-0.12	1.401	-0.0438	-0.6	-0.5052	-0.8298	1918517	CBDivE_009194	Brc1ccc2c3nc4ccccc4n3c(=O)c5cccc1c52
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L15	compound treatment	1.242	0.0143	0.19	1.364	-0.0808	-1.1	-0.6426	-0.5743	1918518	CBDivE_009195	CCSc1nc(=O)c(C(c2ccccc2)c3ccccc3)c(O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L16	compound treatment	1.207	-0.0207	-0.28	1.409	-0.0358	-0.49	-0.5426	-0.9647	1918519	CBDivE_009196	C/C(=N\NC(=O)c1cccs1)/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L17	compound treatment	1.196	-0.0317	-0.43	1.465	0.0202	0.28	-0.1075	-0.2116	1918520	CBDivE_009197	CC(C)CNC(=O)c1c(F)c(F)c(C(=O)NCC(C)C)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L18	compound treatment	1.207	-0.0207	-0.28	1.424	-0.0208	-0.28	-0.3979	-1.0	1918521	CBDivE_009198	COc1cccc(/C=N/NC(=S)SC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L19	compound treatment	1.227	-6.71E-4	-0.01	1.508	0.0632	0.86	0.6028	0.6996	1918522	CBDivE_009199	COc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	L20	compound treatment	1.186	-0.0417	-0.56	1.448	0.00318	0.04	-0.3668	-0.6506	1918523	CBDivE_009200	Cc1nc2cc(CCO)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M01	compound treatment	1.267	0.0393	0.53	1.417	-0.0278	-0.38	0.1069	0.164	1918524	CBDivE_009201	Cc1cc(O)c(C2=Nc3cc(ccc3SC(C2)c4cccc(CC=C)c4O)C(F)(F)F)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M02	compound treatment	1.169	-0.0587	-0.79	1.421	-0.0238	-0.32	-0.7893	-0.9226	1918525	CBDivE_009202	Clc1ccccc1/C=N/NC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M03	compound treatment	1.262	0.0343	0.46	1.461	0.0162	0.22	0.4835	0.9425	1623410	CBDivE_009203	COC(=O)CNC(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M04	compound treatment	1.194	-0.0337	-0.45	1.441	-0.00382	-0.05	-0.358	-0.783	1918526	CBDivE_009204	CC(C)Cc1sc(cc1[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M05	compound treatment	1.358	0.13	1.76	1.407	-0.0378	-0.52	0.8786	0.4795	1918527	CBDivE_009205	CN1CCN(CC(=O)Nc2c(C)c3ccccc3n2Cc4ccccc4)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M06	compound treatment	1.191	-0.0367	-0.49	1.452	0.00718	0.1	-0.2806	-0.5563	1408568	CBDivE_009206	CCN(CC)CCC(=O)OC1CC2CCC(C1)N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M07	compound treatment	1.266	0.0383	0.52	1.469	0.0242	0.33	0.5988	0.9764	1918528	CBDivE_009207	Cc1ccc(cc1)S(=O)(=O)NOCONS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M08	compound treatment	1.231	0.00333	0.04	1.407	-0.0378	-0.52	-0.3329	-0.6431	1724523	CBDivE_009208	Nc1ccc(cc1N)C(=O)c2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M09	compound treatment	1.25	0.0223	0.3	1.503	0.0582	0.79	0.774	0.9121	1918529	CBDivE_009209	OC(C(Br)C(O)C(Cl)(Cl)Cl)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M10	compound treatment	1.254	0.0263	0.36	1.451	0.00618	0.08	0.3108	0.8513	1918530	CBDivE_009210	Fc1ccc(NC(=O)c2ccccc2C(=O)OCC(=C(Cl)Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M11	compound treatment	1.245	0.0173	0.23	1.438	-0.00682	-0.09	0.0996	0.3957	1462532	CBDivE_009211	Cc1cc(O)nc(=O)n1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M12	compound treatment	1.225	-0.00267	-0.04	1.394	-0.0508	-0.69	-0.5155	-0.7429	1611350	CBDivE_009212	CCCCn1c(=O)[nH]c2nc3cc(N)ccc3nc2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M13	compound treatment	1.234	0.00633	0.09	1.55	0.105	1.43	1.0746	0.7479	1918531	CBDivE_009213	O=C1CC(S/C(=N\c2ccccc2)/Nc3ccccc3)C(=O)N1c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M14	compound treatment	1.243	0.0153	0.21	1.451	0.00618	0.08	0.2058	0.9217	1918532	CBDivE_009214	Oc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M15	compound treatment	1.245	0.0173	0.23	1.414	-0.0308	-0.42	-0.1319	-0.2742	1016553	CBDivE_009215	CCOC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M16	compound treatment	1.267	0.0393	0.53	1.485	0.0402	0.55	0.7626	0.9999	1918533	CBDivE_009216	CC(C)CCC1CC1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M17	compound treatment	1.314	0.0863	1.16	1.502	0.0572	0.78	1.3749	0.981	1508108	CBDivE_009217	Cc1cc2nc3n(C)c(=O)[nH]c(=O)c3nc2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M18	compound treatment	1.221	-0.00667	-0.09	1.46	0.0152	0.21	0.0828	0.3666	1779361	CBDivE_009218	[O-][N+](=O)c1cc2OCOc2cc1C3N(Cc4ccccc4)CCN3Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M19	compound treatment	1.25	0.0223	0.3	1.552	0.107	1.46	1.2465	0.8353	1777143	CBDivE_009219	[O-][N+](=O)c1ccc(cc1)C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	M20	compound treatment	1.222	-0.00567	-0.08	1.495	0.0502	0.68	0.4298	0.6242	1918534	CBDivE_009220	BrCCC(=O)NC(=O)Oc1ccc2ccccc2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N01	compound treatment	1.191	-0.0367	-0.49	1.388	-0.0568	-0.77	-0.8977	-0.9765	1918535	CBDivE_009221	Oc1c(CC=C)cccc1/C=C/2\SC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N02	compound treatment	1.175	-0.0527	-0.71	1.369	-0.0758	-1.03	-1.2335	-0.9833	1918536	CBDivE_009222	Clc1ccc(CC2(CC(=O)c3ccccc3)C(=O)c4ccccc4C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N03	compound treatment	1.227	-6.71E-4	-0.01	1.388	-0.0568	-0.77	-0.5543	-0.7153	1213805	CBDivE_009223	COc1ccc2c(CCNC(=O)c3ccco3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N04	compound treatment	1.186	-0.0417	-0.56	1.298	-0.147	-2.0	-1.8132	-0.8719	1305568	CBDivE_009224	Cc1ccc(cc1)S(=O)(=O)c2ccc(Oc3cccc(N)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N05	compound treatment	1.256	0.0283	0.38	1.433	-0.0118	-0.16	0.1563	0.3768	1918537	CBDivE_009225	O=C1NC(=O)/C(=C/c2cc3ccccc3[nH]2)/C(=O)N1c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N06	compound treatment	1.218	-0.00967	-0.13	1.37	-0.0748	-1.02	-0.8137	-0.7911	1240744	CBDivE_009226	CC1(CCC2(CO)COC3C1C2)Oc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N07	compound treatment	1.132	-0.0957	-1.29	1.425	-0.0198	-0.27	-1.1037	-0.837	1918538	CBDivE_009227	CC(C)Cc1sc(NC(=O)C)cc1NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N08	compound treatment	1.156	-0.0717	-0.97	1.374	-0.0708	-0.97	-1.3665	-1.0	1918539	CBDivE_009228	[O-][N+](=O)/C(=C/1\NCCO1)/C(=C(/Cl)\N2CCCCC2)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N09	compound treatment	1.146	-0.0817	-1.1	1.381	-0.0638	-0.87	-1.3944	-0.9932	1918540	CBDivE_009229	[O-][N+](=O)c1ccc(NN2C(=O)C3C4CC(C=C4)C3C2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N10	compound treatment	1.188	-0.0397	-0.54	1.422	-0.0228	-0.31	-0.5985	-0.9667	1918541	CBDivE_009230	Nc1nc(N)nc(n1)c2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N11	compound treatment	1.18	-0.0477	-0.64	1.4	-0.0448	-0.61	-0.8869	-0.9997	1918542	CBDivE_009231	[O-][N+](=O)c1ccc(NNC(=O)c2ccc(cc2)c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N12	compound treatment	1.181	-0.0467	-0.63	1.379	-0.0658	-0.9	-1.0799	-0.985	1918543	CBDivE_009232	Cc1ccc(/N=C/c2ccc(s2)[N+](=O)[O-])cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N13	compound treatment	1.225	-0.00267	-0.04	1.404	-0.0408	-0.56	-0.4191	-0.7513	1660304	CBDivE_009233	CCCc1c(CC)c(=N)c2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N14	compound treatment	1.168	-0.0597	-0.8	1.388	-0.0568	-0.77	-1.1171	-0.9998	3016466	CBDivE_009234	Cc1ccc(cc1)S(=O)(=O)O.C[n+]1c(CO)sc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N15	compound treatment	1.174	-0.0537	-0.72	1.427	-0.0178	-0.24	-0.6838	-0.8953	1918544	CBDivE_009235	CC(C)(C)Sc1ccc(s1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N16	compound treatment	1.235	0.00733	0.1	1.41	-0.0348	-0.47	-0.2658	-0.5481	1542130	CBDivE_009236	COC(=O)CCC(=O)Nc1ccc(Cc2ccc(NC(=O)CCC(=O)OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N17	compound treatment	1.17	-0.0577	-0.78	1.422	-0.0228	-0.31	-0.7702	-0.9191	1918545	CBDivE_009237	Oc1ccccc1/C=N/NC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N18	compound treatment	1.26	0.0323	0.44	1.39	-0.0548	-0.75	-0.2202	-0.2544	1776431	CBDivE_009238	Oc1c(Cl)cc(Cl)cc1C(=O)Nc2cc(Cl)ccc2Oc3ccc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N19	compound treatment	1.199	-0.0287	-0.39	1.483	0.0382	0.52	0.0947	0.1459	1918546	CBDivE_009239	C/C(=N\OC(=O)c1ccc(cc1)c2ccccc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	N20	compound treatment	1.199	-0.0287	-0.39	1.388	-0.0568	-0.77	-0.8214	-0.9485	1918547	CBDivE_009240	COC(=O)C(C(C)C(C(=O)OC)C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O01	compound treatment	1.25	0.0223	0.3	1.461	0.0162	0.22	0.369	0.9883	1918548	CBDivE_009241	CCc1[n+](C)c(C)cn2cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O02	compound treatment	1.202	-0.0257	-0.35	1.454	0.00918	0.13	-0.1563	-0.4246	1133262	CBDivE_009242	Clc1ccc(cc1)C(=O)NCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O03	compound treatment	1.224	-0.00367	-0.05	1.515	0.0702	0.96	0.6417	0.6696	1918549	CBDivE_009243	Brc1ccccc1/C=N/NC(=O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O04	compound treatment	1.271	0.0433	0.58	1.442	-0.00282	-0.04	0.3862	0.6592	1918550	CBDivE_009244	CC(CCc1ccc(CN)s1)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O05	compound treatment	1.254	0.0263	0.36	1.49	0.0452	0.62	0.6868	0.9658	1918551	CBDivE_009245	CC(=O)CC(C)(C)c1c[nH]c2c(cccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O06	compound treatment	1.235	0.00733	0.1	1.435	-0.00982	-0.13	-0.0248	-0.1487	1918552	CBDivE_009246	CC1(C)CC(C)(Cc2ccccc2)OC(=S)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O07	compound treatment	1.245	0.0173	0.23	1.439	-0.00582	-0.08	0.1092	0.4424	1918553	CBDivE_009247	Cc1ccc(cc1)N2CCN(C2c3ccccc3O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O08	compound treatment	1.257	0.0293	0.4	1.486	0.0412	0.56	0.6769	0.9853	1918554	CBDivE_009248	Oc1ccccc1C(=O)N/N=C/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O09	compound treatment	1.27	0.0423	0.57	1.463	0.0182	0.25	0.5791	0.9302	1918555	CBDivE_009249	OS(=O)(=O)SCCC(=O)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O10	compound treatment	1.206	-0.0217	-0.29	1.429	-0.0158	-0.22	-0.3593	-0.9888	1918556	CBDivE_009250	O/N=C/1\CCCCc2sc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O11	compound treatment	1.329	0.101	1.37	1.481	0.0362	0.49	1.3155	0.9052	1918557	CBDivE_009251	O=C(NC(=S)n1cnc2ccccc12)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O12	compound treatment	1.232	0.00433	0.06	1.45	0.00518	0.07	0.0913	0.9955	1918558	CBDivE_009252	CN1C(=O)N(C)C(=O)C(=CNC(Cc2c[nH]c3ccccc23)C(=O)O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O13	compound treatment	1.213	-0.0147	-0.2	1.473	0.0282	0.38	0.1318	0.3049	1741552	CBDivE_009253	Clc1ccc2SC3=C(CCCC3=O)Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O14	compound treatment	1.2	-0.0277	-0.37	1.438	-0.00682	-0.09	-0.3297	-0.857	1121866	CBDivE_009254	O=C(NCCc1c[nH]c2ccc(OCc3ccccc3)cc12)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O15	compound treatment	1.283	0.0553	0.75	1.454	0.00918	0.13	0.6163	0.8143	1918559	CBDivE_009255	OS(=O)(=O)c1ccc(cc1)c2[nH]c(=O)[nH]c2c3ccc(cc3)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O16	compound treatment	1.247	0.0193	0.26	1.455	0.0102	0.14	0.2826	0.9565	1918560	CBDivE_009256	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O17	compound treatment	1.283	0.0553	0.75	1.544	0.0992	1.35	1.4842	0.9607	1918561	CBDivE_009257	[O-][N+](=O)c1ccc(cc1[N+](=O)[O-])N2CCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O18	compound treatment	1.209	-0.0187	-0.25	1.473	0.0282	0.38	0.0936	0.2038	1918562	CBDivE_009258	O=C1NC(=O)/C(=C/c2ccco2)/C(=O)N1c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O19	compound treatment	1.323	0.0953	1.29	1.476	0.0312	0.43	1.21	0.8933	1918563	CBDivE_009259	Clc1ccc(/C=N/NC(=O)C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	O20	compound treatment	1.182	-0.0457	-0.62	1.481	0.0362	0.49	-0.0868	-0.11	1135162	CBDivE_009260	CCN(CC)c1ccc(NC(=O)C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P01	compound treatment	1.227	-6.71E-4	-0.01	1.435	-0.00982	-0.13	-0.1011	-0.7532	1918564	CBDivE_009261	CCOC(=O)C(Cc1ccc(OC(=O)C2C3CCCCC23)cc1)NC(=O)C4C5CCCCC45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P02	compound treatment	1.209	-0.0187	-0.25	1.391	-0.0538	-0.73	-0.697	-0.8984	1918565	CBDivE_009262	COc1cc(/C=N/c2ccc(c3nc4cc(C)ccc4o3)c(O)c2)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P03	compound treatment	1.251	0.0233	0.31	1.352	-0.0928	-1.27	-0.6724	-0.5156	1274802	CBDivE_009263	Clc1ccccc1C(=O)c2cc3OCCOc3cc2NC(=O)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P04	compound treatment	1.148	-0.0797	-1.07	1.394	-0.0508	-0.69	-1.25	-0.9775	1918566	CBDivE_009264	CSc1nc(=O)c(C(c2ccccc2)c3ccccc3)c(O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P05	compound treatment	1.199	-0.0287	-0.39	1.386	-0.0588	-0.8	-0.8406	-0.9441	1918567	CBDivE_009265	CCN(CC)c1ccc(/C=C\2/C(=O)NC(=O)N(C2=O)c3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P06	compound treatment	1.178	-0.0497	-0.67	1.365	-0.0798	-1.09	-1.2435	-0.9729	1918568	CBDivE_009266	CC(=CCC/C(=C/C=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P07	compound treatment	1.17	-0.0577	-0.78	1.403	-0.0418	-0.57	-0.9534	-0.9883	1918569	CBDivE_009267	O=C(N/N=C/1\C(=O)Nc2ccccc12)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P08	compound treatment	1.192	-0.0357	-0.48	1.382	-0.0628	-0.86	-0.946	-0.9628	3017481	CBDivE_009268	Cc1[nH]c2ccccc2c1CCN.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P09	compound treatment	1.148	-0.0797	-1.07	1.322	-0.123	-1.67	-1.9443	-0.977	1385721	CBDivE_009269	O=C(Oc1cccc2ccccc12)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P10	compound treatment	0.701	-0.527	-7.11	0.994	-0.451	-6.15	-9.3711	-0.9974	1504809	CBDivE_009270	Cc1ccc(c2nsnc12)S(=O)(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P11	compound treatment	1.189	-0.0387	-0.52	1.414	-0.0308	-0.42	-0.6661	-0.9943	1918570	CBDivE_009271	c1ccc(c2nnn[nH]2)c(c1)c3nnn[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P12	compound treatment	1.164	-0.0637	-0.86	1.335	-0.11	-1.5	-1.6663	-0.9652	1918571	CBDivE_009272	COc1ccc(/C=N/NC(=O)C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P13	compound treatment	1.198	-0.0297	-0.4	1.431	-0.0138	-0.19	-0.4163	-0.9409	1918572	CBDivE_009273	COc1ccc(/C=C/C(=N\NC(=O)c2cccc(Cl)c2)/c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P14	compound treatment	1.175	-0.0527	-0.71	1.421	-0.0238	-0.32	-0.7321	-0.9371	1246420	CBDivE_009274	CC(=O)Nc1nc2cc3nc(NC(=O)C)sc3cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P15	compound treatment	1.241	0.0133	0.18	1.413	-0.0318	-0.43	-0.1797	-0.3825	1918573	CBDivE_009275	Brc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2Cc4c(OC(=O)c5ccc(Br)cc5)ccc6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P16	compound treatment	1.211	-0.0167	-0.22	1.391	-0.0538	-0.73	-0.678	-0.8833	1918574	CBDivE_009276	CC(=O)c1ccc2ccccc2c1OC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P17	compound treatment	1.173	-0.0547	-0.74	1.363	-0.0818	-1.12	-1.3104	-0.9798	1779746	CBDivE_009277	[O-][N+](=O)c1ccccc1C2SCC(=O)N2CC3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P18	compound treatment	1.092	-0.136	-1.83	1.422	-0.0228	-0.31	-1.5142	-0.8156	1469600	CBDivE_009278	O=Cc1ccc(OCc2cn3ccccc3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P19	compound treatment	1.219	-0.00867	-0.12	1.411	-0.0338	-0.46	-0.4088	-0.8593	1918575	CBDivE_009279	Oc1[nH]c(SCc2ccccc2)nc(=O)c1C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.29	P20	compound treatment	1.191	-0.0367	-0.49	1.354	-0.0908	-1.24	-1.2255	-0.919	1918576	CBDivE_009280	CN(C)/C=C/C=C/C=C/C(=O)C1CCC/C(=C\C=C\C=C\N(C)C)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A01	compound treatment	1.114	0.0177	0.24	1.217	2.16E-4	0.0	0.1706	0.7158	1347157	CBDivE_000641	CCOC(=N)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A02	compound treatment	1.121	0.0247	0.33	1.273	0.0562	0.77	0.7774	0.9302	1594935	CBDivE_000642	COc1cccc(CCN2N=C(C)CC2=O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A03	compound treatment	1.089	-0.00733	-0.1	1.176	-0.0408	-0.56	-0.4632	-0.82	1912713	CBDivE_000643	CC(=O)SC(C[N+](=O)[O-])c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A04	compound treatment	1.155	0.0587	0.79	1.29	0.0732	1.0	1.2656	0.9934	1389430	CBDivE_000644	O=c1cc(c2ccccc2)n([nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A05	compound treatment	1.148	0.0517	0.7	1.21	-0.00678	-0.09	0.4275	0.6079	1330948	CBDivE_000645	OC(=O)CCC(=O)N1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A06	compound treatment	1.102	0.00567	0.08	1.244	0.0272	0.37	0.3165	0.8353	1912714	CBDivE_000646	CC(=O)Nc1ccc(cc1)C(=O)/C=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A07	compound treatment	1.121	0.0247	0.33	1.209	-0.00778	-0.11	0.1603	0.4588	1294024	CBDivE_000647	OCC(O)CN1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A08	compound treatment	1.04	-0.0563	-0.76	1.36	0.143	1.95	0.8436	0.4025	1068307	CBDivE_000648	[O-][N+](=O)c1ccc(SCCSc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A09	compound treatment	1.098	0.00167	0.02	1.238	0.0212	0.29	0.2205	0.7598	1019068	CBDivE_000649	CC(C)Oc1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A10	compound treatment	1.137	0.0407	0.55	1.162	-0.0548	-0.75	-0.1403	-0.1514	1912715	CBDivE_000650	COC(=O)Nc1cc(cc([N+](=O)[O-])c1Br)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A11	compound treatment	1.103	0.00667	0.09	1.231	0.0142	0.19	0.2007	0.9391	1161126	CBDivE_000651	NCCc1c([nH]c2ccc(cc12)S(=O)(=O)N)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A12	compound treatment	1.148	0.0517	0.7	1.257	0.0402	0.55	0.8807	0.993	1032995	CBDivE_000652	COc1ccc(cc1)C(=O)CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A13	compound treatment	1.087	-0.00933	-0.13	1.234	0.0172	0.23	0.077	0.289	1316454	CBDivE_000653	COc1ccc2c(CCN)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A14	compound treatment	1.099	0.00267	0.04	1.248	0.0312	0.43	0.3265	0.7642	1021204	CBDivE_000654	CC(=O)Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A15	compound treatment	1.105	0.00867	0.12	1.139	-0.0778	-1.06	-0.6673	-0.6254	1338402	CBDivE_000655	NC(=O)N1CCN(CC1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A16	compound treatment	1.097	6.69E-4	0.01	1.307	0.0902	1.23	0.8763	0.7123	1912716	CBDivE_000656	CC/1=NN(C(=O)\C1=C\c2ccco2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A17	compound treatment	1.081	-0.0153	-0.21	1.259	0.0422	0.58	0.2608	0.4264	1371911	CBDivE_000657	CC(C)Oc1ccc(NC(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A18	compound treatment	1.12	0.0237	0.32	1.22	0.00322	0.04	0.2568	0.7967	1912717	CBDivE_000658	COc1ccc(/C=C\2/C(=O)N(N=C2c3ccccc3)c4ccc(Br)cc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A19	compound treatment	1.112	0.0157	0.21	1.263	0.0462	0.63	0.5951	0.8953	1340827	CBDivE_000659	OC(=O)CN1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	A20	compound treatment	1.117	0.0207	0.28	1.193	-0.0238	-0.32	-0.0322	-0.0752	1912718	CBDivE_000660	COc1ccc(/C=C/2\C(=O)N(N=C2c3ccccc3)c4ccc(cc4)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B01	compound treatment	1.062	-0.0343	-0.46	1.171	-0.0458	-0.62	-0.769	-0.9892	1912719	CBDivE_000661	OC(=O)[C@@H]1CSC(N1)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B02	compound treatment	1.111	0.0147	0.2	1.267	0.0502	0.68	0.6241	0.8756	1344033	CBDivE_000662	OC(=O)c1ccc(C#Cc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B03	compound treatment	1.178	0.0817	1.1	1.197	-0.0198	-0.27	0.5883	0.5186	1912720	CBDivE_000663	OC(=O)[C@@H]1CSC(N1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B04	compound treatment	1.122	0.0257	0.35	1.242	0.0252	0.34	0.488	1.0	1912721	CBDivE_000664	NC(=O)c1ccc(C#Cc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B05	compound treatment	1.11	0.0137	0.18	1.232	0.0152	0.21	0.2771	0.9983	1912722	CBDivE_000665	COc1ccc(C2N[C@@H](CS2)C(=O)O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B06	compound treatment	1.165	0.0687	0.93	1.222	0.00522	0.07	0.7053	0.7592	1912723	CBDivE_000666	OCc1ccc(C#Cc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B07	compound treatment	1.145	0.0487	0.66	1.186	-0.0308	-0.42	0.1674	0.2148	1912724	CBDivE_000667	COc1ccc(cc1OC)C2N[C@@H](CS2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B08	compound treatment	1.131	0.0347	0.47	1.233	0.0162	0.22	0.4871	0.9415	1778515	CBDivE_000668	OC(=O)c1cccn1c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B09	compound treatment	1.105	0.00867	0.12	1.207	-0.00978	-0.13	-0.0117	-0.0657	1912725	CBDivE_000669	OC(=O)[C@@H]1CSC(N1)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B10	compound treatment	1.099	0.00267	0.04	1.248	0.0312	0.43	0.3265	0.7642	1019058	CBDivE_000670	COCc1c(C#N)c(Cl)nc(C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B11	compound treatment	1.065	-0.0313	-0.42	1.196	-0.0208	-0.28	-0.4993	-0.9811	1912726	CBDivE_000671	OC(=O)[C@@H]1CSC(N1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B12	compound treatment	1.14	0.0437	0.59	1.201	-0.0158	-0.22	0.2644	0.4215	1912727	CBDivE_000672	COCc1cc(C)nc(Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B13	compound treatment	1.104	0.00767	0.1	1.189	-0.0278	-0.38	-0.1948	-0.4959	1912728	CBDivE_000673	COc1ccc(cc1)[C@H]2SC[C@H](N2C(=O)C)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B14	compound treatment	1.115	0.0187	0.25	1.186	-0.0308	-0.42	-0.1187	-0.2426	1912729	CBDivE_000674	COCc1cc(C)[nH]c(=S)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B15	compound treatment	1.105	0.00867	0.12	1.239	0.0222	0.3	0.2969	0.9143	1912730	CBDivE_000675	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B16	compound treatment	1.165	0.0687	0.93	1.204	-0.0128	-0.17	0.5318	0.5641	1912731	CBDivE_000676	COCc1c(C#N)c(=S)[nH]c(C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B17	compound treatment	1.122	0.0257	0.35	1.242	0.0252	0.34	0.488	1.0	1912732	CBDivE_000677	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)S(=O)(=O)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B18	compound treatment	1.156	0.0597	0.8	1.166	-0.0508	-0.69	0.0795	0.0749	1912733	CBDivE_000678	CCCCNC(=O)c1c(CO)cc(C)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B19	compound treatment	1.123	0.0267	0.36	1.207	-0.00978	-0.13	0.1601	0.4171	1912734	CBDivE_000679	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	B20	compound treatment	1.054	-0.0423	-0.57	1.188	-0.0288	-0.39	-0.6814	-0.9833	1912735	CBDivE_000680	CCSc1nc(C)cc(COC)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C01	compound treatment	1.057	-0.0393	-0.53	1.225	0.00822	0.11	-0.296	-0.5458	1912736	CBDivE_000681	CC(=O)N1C(Cc2ccccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C02	compound treatment	1.08	-0.0163	-0.22	1.268	0.0512	0.7	0.3381	0.4616	1912737	CBDivE_000682	CC(NC(=O)c1ccc(Cl)c(c1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C03	compound treatment	1.085	-0.0113	-0.15	1.228	0.0112	0.15	1.0E-4	2.0E-4	1912738	CBDivE_000683	COc1cc(OC)c(/C=C/[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C04	compound treatment	1.151	0.0547	0.74	1.246	0.0292	0.4	0.8032	0.9582	1912739	CBDivE_000684	COc1ccccc1C2CC(=NN2c3ccc(Br)cc3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C05	compound treatment	1.122	0.0257	0.35	1.213	-0.00378	-0.05	0.2084	0.5952	1912740	CBDivE_000685	NC(=S)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C06	compound treatment	1.14	0.0437	0.59	1.228	0.0112	0.15	0.5247	0.8621	1912741	CBDivE_000686	COc1ccc(/C=C/2\C(=O)N(C(c3ccccc3)S2(=O)=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C07	compound treatment	1.121	0.0247	0.33	1.179	-0.0378	-0.52	-0.129	-0.2103	1912742	CBDivE_000687	[O-][N+](=O)c1ccc(N/N=C/CCC#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C08	compound treatment	1.084	-0.0123	-0.17	1.212	-0.00478	-0.07	-0.1638	-0.9165	1912743	CBDivE_000688	Fc1ccc(/C=C/2\C(=O)N(C(c3ccccc3)S2(=O)=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C09	compound treatment	1.142	0.0457	0.62	1.226	0.00922	0.13	0.5245	0.8342	1912744	CBDivE_000689	CCOC(=O)C/C(=N/c1sc2CCCCc2c1C#N)/N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C10	compound treatment	1.101	0.00467	0.06	1.245	0.0282	0.38	0.3166	0.8121	1912745	CBDivE_000690	Brc1ccc(/C=C/2\C(=O)N(C(c3ccccc3)S2(=O)=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C11	compound treatment	1.046	-0.0503	-0.68	1.247	0.0302	0.41	-0.1888	-0.2377	1106512	CBDivE_000691	Nc1nc(nc2sc3CCCCc3c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C12	compound treatment	1.159	0.0627	0.85	1.214	-0.00278	-0.04	0.571	0.6747	1912746	CBDivE_000692	COc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C13	compound treatment	1.144	0.0477	0.64	1.191	-0.0258	-0.35	0.2061	0.2812	1292811	CBDivE_000693	CC(=O)Nc1sc2CCCc2c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C14	compound treatment	1.102	0.00567	0.08	1.225	0.00822	0.11	0.1333	0.9827	1912747	CBDivE_000694	Brc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C15	compound treatment	1.105	0.00867	0.12	1.228	0.0112	0.15	0.1908	0.9912	1912748	CBDivE_000695	NNC(=O)CC1CC(=NN1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C16	compound treatment	1.104	0.00767	0.1	1.24	0.0232	0.32	0.297	0.8918	1912749	CBDivE_000696	COc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C17	compound treatment	1.11	0.0137	0.18	1.186	-0.0308	-0.42	-0.1664	-0.363	1912750	CBDivE_000697	NNC(=O)CC1CC(=NN1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C18	compound treatment	1.147	0.0507	0.68	1.206	-0.0108	-0.15	0.3794	0.5426	1912751	CBDivE_000698	Clc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C19	compound treatment	1.127	0.0307	0.41	1.218	0.00122	0.02	0.3043	0.7348	1912752	CBDivE_000699	COc1ccc(cc1)C2=NNC(CC(=O)NN)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	C20	compound treatment	1.123	0.0267	0.36	1.189	-0.0278	-0.38	-0.0135	-0.0259	1912753	CBDivE_000700	Clc1ccc(/C=C\2/S/C(=N/c3ccccc3)/NC2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D01	compound treatment	1.108	0.0117	0.16	1.203	-0.0138	-0.19	-0.0216	-0.0881	1912754	CBDivE_000701	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Cl)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D02	compound treatment	1.137	0.0407	0.55	1.228	0.0112	0.15	0.4961	0.871	1912755	CBDivE_000702	Cc1cc2CNC(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D03	compound treatment	1.095	-0.00133	-0.02	1.231	0.0142	0.19	0.1244	0.6389	1912756	CBDivE_000703	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3cccc4ccccc34)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D04	compound treatment	1.158	0.0617	0.83	1.17	-0.0468	-0.64	0.1372	0.1308	1912757	CBDivE_000704	Cc1cc2/C(=C/c3ccco3)/OC(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D05	compound treatment	1.085	-0.0113	-0.15	1.241	0.0242	0.33	0.1254	0.3446	1912758	CBDivE_000705	O=C1CC(N2CCN(CC2)S(=O)(=O)c3ccccc3)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D06	compound treatment	1.125	0.0287	0.39	1.23	0.0132	0.18	0.4009	0.9396	1912759	CBDivE_000706	Cc1ccc(/C=C/2\OC(=O)c3c2cc(C)[nH]c3=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D07	compound treatment	1.104	0.00767	0.1	1.238	0.0212	0.29	0.2777	0.9039	1912760	CBDivE_000707	O=C(N1CCN(CC1)C2CC(=O)N(C2=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D08	compound treatment	1.091	-0.00533	-0.07	1.23	0.0132	0.18	0.0766	0.3946	1912761	CBDivE_000708	Cc1ccc(/C=C/2\OC(=O)c3c2cc(C)[nH]c3=S)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D09	compound treatment	1.109	0.0127	0.17	1.154	-0.0628	-0.86	-0.4845	-0.555	1912762	CBDivE_000709	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C3CC(=O)N(C3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D10	compound treatment	1.091	-0.00533	-0.07	1.221	0.00422	0.06	-0.0102	-0.1109	1912763	CBDivE_000710	Cc1cc2/C(=C/c3ccco3)/OC(=O)c2c(=S)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D11	compound treatment	1.083	-0.0133	-0.18	1.209	-0.00778	-0.11	-0.2022	-0.9684	1912764	CBDivE_000711	OC(=O)[C@@H]1CSC(N1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D12	compound treatment	1.114	0.0177	0.24	1.232	0.0152	0.21	0.3153	0.9976	1912765	CBDivE_000712	Cc1cc2c(Cc3ccccc3)n[nH]c(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D13	compound treatment	1.11	0.0137	0.18	1.223	0.00622	0.08	0.1903	0.9378	1912766	CBDivE_000713	CC(=O)N1[C@@H](CS[C@@H]1c2ccc(Br)cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D14	compound treatment	1.092	-0.00433	-0.06	1.205	-0.0118	-0.16	-0.1549	-0.9062	1912767	CBDivE_000714	COc1ccc(/C=C/2\OC(=O)c3c2cc(C)[nH]c3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D15	compound treatment	1.099	0.00267	0.04	1.233	0.0162	0.22	0.1818	0.8116	1912768	CBDivE_000715	OC(=O)[C@@H]1CSC(N1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D16	compound treatment	1.099	0.00267	0.04	1.18	-0.0368	-0.5	-0.3292	-0.6547	1912769	CBDivE_000716	Cc1cc2/C(=C/c3ccc(Br)o3)/OC(=O)c2c(=S)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D17	compound treatment	1.048	-0.0483	-0.65	1.206	-0.0108	-0.15	-0.565	-0.8454	1912770	CBDivE_000717	OC(=O)[C@@H]1CSC(N1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D18	compound treatment	1.151	0.0547	0.74	1.241	0.0242	0.33	0.755	0.9343	1161952	CBDivE_000718	Cc1cc2c(Cc3ccco3)n[nH]c(=O)c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D19	compound treatment	1.089	-0.00733	-0.1	1.224	0.00722	0.1	-4.0E-4	-0.0026	1912771	CBDivE_000719	OC(=O)[C@@H]1CSC(N1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	D20	compound treatment	1.064	-0.0323	-0.44	1.237	0.0202	0.28	-0.1135	-0.22	1912772	CBDivE_000720	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E01	compound treatment	1.084	-0.0123	-0.17	1.253	0.0362	0.49	0.2316	0.4444	1912773	CBDivE_000721	NNC(=O)CC1NN=C2C1CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E02	compound treatment	1.14	0.0437	0.59	1.223	0.00622	0.08	0.4765	0.8006	1912774	CBDivE_000722	COc1ccc(cc1)C2CC(=NN2c3cccc(Cl)c3)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E03	compound treatment	1.11	0.0137	0.18	1.246	0.0292	0.4	0.4121	0.9387	1912775	CBDivE_000723	Oc1ccc(cc1)C2=NN(C(C2)C=C(Cl)Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E04	compound treatment	1.138	0.0417	0.56	1.199	-0.0178	-0.24	0.226	0.3692	1912776	CBDivE_000724	COc1ccc(/C=N/NC(=O)C(C)c2ccc(CC(C)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E05	compound treatment	0.995	-0.101	-1.37	1.143	-0.0738	-1.01	-1.6781	-0.9886	1912777	CBDivE_000725	CC(=O)C1C(CC(O)(CC1=O)c2ccccc2)C=C(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E06	compound treatment	1.12	0.0237	0.32	1.232	0.0152	0.21	0.3725	0.9782	1912778	CBDivE_000726	COC(=O)C(Cc1ccccc1)NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E07	compound treatment	1.111	0.0147	0.2	1.237	0.0202	0.28	0.3349	0.9868	1007924	CBDivE_000727	c1c(noc1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E08	compound treatment	1.138	0.0417	0.56	1.281	0.0642	0.88	1.0167	0.977	1912779	CBDivE_000728	CC(NC(=O)c1ccccc1/N=C/c2c(O)ccc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E09	compound treatment	1.096	-3.31E-4	0.0	1.23	0.0132	0.18	0.1243	0.6894	1912780	CBDivE_000729	COc1ccc(cc1)N(Cc2ccccc2)N=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E10	compound treatment	1.111	0.0147	0.2	1.187	-0.0298	-0.41	-0.1473	-0.3259	1912781	CBDivE_000730	CC(C)Cc1ccc(cc1)C(C)C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E11	compound treatment	1.111	0.0147	0.2	1.192	-0.0248	-0.34	-0.0991	-0.2529	1394770	CBDivE_000731	OCCCc1cn(c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E12	compound treatment	1.16	0.0637	0.86	1.185	-0.0318	-0.43	0.3009	0.3127	1912782	CBDivE_000732	CC(C)Cc1ccc(cc1)C(C)C(=O)N/N=C/c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E13	compound treatment	1.112	0.0157	0.21	1.209	-0.00778	-0.11	0.0744	0.3146	1015279	CBDivE_000733	COc1ccc2n(Cc3ccccc3)c(C)c(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E14	compound treatment	1.043	-0.0533	-0.72	1.211	-0.00578	-0.08	-0.5645	-0.78	1912783	CBDivE_000734	COc1ccc(cc1)C2CC(=NN2c3cccc(c3)C(F)(F)F)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E15	compound treatment	1.071	-0.0253	-0.34	1.229	0.0122	0.17	-0.1239	-0.3258	1912784	CBDivE_000735	CC(=O)c1ccc-2c(c1)C(=O)c3cc(ccc32)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E16	compound treatment	1.067	-0.0293	-0.4	1.237	0.0202	0.28	-0.0849	-0.176	1912785	CBDivE_000736	Fc1c(F)c(F)c(N/N=C/c2c3ccccc3cc4ccccc24)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E17	compound treatment	1.125	0.0287	0.39	1.234	0.0172	0.23	0.4395	0.9714	1113040	CBDivE_000737	COc1ccc(cc1)N(N)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E18	compound treatment	1.1	0.00367	0.05	1.225	0.00822	0.11	0.1142	0.9325	1912786	CBDivE_000738	CC(=O)Nc1ccc(/N=C/c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E19	compound treatment	1.059	-0.0373	-0.5	1.212	-0.00478	-0.07	-0.4022	-0.7921	1912787	CBDivE_000739	NN(CCc1ccccn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	E20	compound treatment	1.111	0.0147	0.2	1.215	-0.00178	-0.02	0.1227	0.6155	1912788	CBDivE_000740	O=C(Nc1ccc(N=Nc2ccccc2)cc1)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F01	compound treatment	1.055	-0.0413	-0.56	1.202	-0.0148	-0.2	-0.5368	-0.9054	1912789	CBDivE_000741	Clc1ccc(cc1Cl)N2N=C(CC2c3ccccc3)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F02	compound treatment	1.159	0.0627	0.85	1.226	0.00922	0.13	0.6867	0.8034	1912790	CBDivE_000742	CN(C)c1ccc(cc1)/C(=N\NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F03	compound treatment	1.116	0.0197	0.27	1.192	-0.0248	-0.34	-0.0514	-0.1195	1912791	CBDivE_000743	COc1ccc(/C=C/C2=NN(C(C2)c3ccc(OC)cc3)c4ccc(Cl)cc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F04	compound treatment	1.137	0.0407	0.55	1.194	-0.0228	-0.31	0.1683	0.2669	1912792	CBDivE_000744	[O-][N+](=O)c1ccccc1/C=N/NC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F05	compound treatment	1.099	0.00267	0.04	1.105	-0.112	-1.52	-1.0524	-0.6902	1912793	CBDivE_000745	CCCCN(CCCC)c1ccc(cc1)C(=C(C#N)C#N)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F06	compound treatment	1.093	-0.00333	-0.04	1.283	0.0662	0.9	0.6067	0.6711	1912794	CBDivE_000746	COc1ccc(/C=N/NC(=O)c2cccc3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F07	compound treatment	1.048	-0.0483	-0.65	1.123	-0.0938	-1.28	-1.3654	-0.9511	1912795	CBDivE_000747	CC(C)(C)c1ccc2C3C4C(C(c5ccc(cc35)C(C)(C)C)c2c1)C(=O)N(C4=O)c6ccc(Oc7ccc(Br)cc7)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F08	compound treatment	1.146	0.0497	0.67	1.282	0.0652	0.89	1.1026	0.9903	1912796	CBDivE_000748	Ic1cccc(/C=N/NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F09	compound treatment	1.103	0.00667	0.09	1.198	-0.0188	-0.26	-0.1175	-0.4328	1912797	CBDivE_000749	Cc1ccc(/C=N/c2ccc(O)cc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F10	compound treatment	1.12	0.0237	0.32	1.165	-0.0518	-0.71	-0.2735	-0.353	1912798	CBDivE_000750	CN(C)c1ccc(/C=N/NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F11	compound treatment	1.128	0.0317	0.43	1.217	2.16E-4	0.0	0.3042	0.712	1912799	CBDivE_000751	COC(=O)c1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F12	compound treatment	1.06	-0.0363	-0.49	1.224	0.00722	0.1	-0.277	-0.5541	1912800	CBDivE_000752	Oc1ccc2ccccc2c1/C=N/NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F13	compound treatment	1.122	0.0257	0.35	1.151	-0.0658	-0.9	-0.3895	-0.405	1912801	CBDivE_000753	[O-][N+](=O)c1cccc(c1)C(=O)/C=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F14	compound treatment	1.091	-0.00533	-0.07	1.187	-0.0298	-0.41	-0.338	-0.8196	1912802	CBDivE_000754	COc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F15	compound treatment	1.052	-0.0443	-0.6	1.164	-0.0528	-0.72	-0.9319	-0.9958	1912803	CBDivE_000755	C(=N/c1cccc2c(\N=C\c3c[nH]c4ccccc34)cccc12)\c5c[nH]c6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F16	compound treatment	1.13	0.0337	0.45	1.229	0.0122	0.17	0.439	0.9073	1912804	CBDivE_000756	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F17	compound treatment	1.066	-0.0303	-0.41	1.195	-0.0218	-0.3	-0.4994	-0.9876	1912805	CBDivE_000757	Oc1ccccc1/C=N/c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F18	compound treatment	1.058	-0.0383	-0.52	1.212	-0.00478	-0.07	-0.4118	-0.7901	1160786	CBDivE_000758	C1CCc2c(C1)sc3ncnc(Nc4ccccc4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F19	compound treatment	1.101	0.00467	0.06	1.199	-0.0178	-0.24	-0.1269	-0.5067	1912806	CBDivE_000759	Fc1ccccc1/C=N/c2cccc3c(\N=C\c4ccccc4F)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	F20	compound treatment	1.125	0.0287	0.39	1.177	-0.0398	-0.54	-0.1101	-0.1653	1912807	CBDivE_000760	[O-][N+](=O)c1ccccc1/C=N\NC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G01	compound treatment	1.087	-0.00933	-0.13	1.19	-0.0268	-0.37	-0.3473	-0.8989	1912808	CBDivE_000761	Cc1ccc(CCN(N)c2ccccc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G02	compound treatment	1.117	0.0207	0.28	1.26	0.0432	0.59	0.6139	0.9416	1912809	CBDivE_000762	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C\c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G03	compound treatment	1.05	-0.0463	-0.63	1.197	-0.0198	-0.27	-0.6327	-0.9294	1912810	CBDivE_000763	CC[n+]1c(ccc2cc(C)ccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G04	compound treatment	1.149	0.0527	0.71	1.306	0.0892	1.22	1.3627	0.9672	1912811	CBDivE_000764	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3cccc(c3)[N+](=O)[O-])C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G05	compound treatment	1.097	6.69E-4	0.01	1.207	-0.00978	-0.13	-0.088	-0.6578	1912812	CBDivE_000765	Cc1cc[n+](CCO)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G06	compound treatment	1.078	-0.0183	-0.25	1.235	0.0182	0.25	8.0E-4	0.0022	1912813	CBDivE_000766	Oc1ccccc1/C=N/c2nccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G07	compound treatment	1.101	0.00467	0.06	1.241	0.0242	0.33	0.278	0.8271	1912814	CBDivE_000767	Cc1ccc2nc(Oc3ccccc3)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G08	compound treatment	1.108	0.0117	0.16	1.22	0.00322	0.04	0.1423	0.8709	1912815	CBDivE_000768	CN(C)c1ccc(/C=C/2\C(=NN(C2=O)c3ccc(cc3)[N+](=O)[O-])C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G09	compound treatment	1.094	-0.00233	-0.03	1.236	0.0192	0.26	0.163	0.6178	1912816	CBDivE_000769	CCN1/C(=C/c2ccc3ccccc3[n+]2CC)/C=Cc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G10	compound treatment	1.04	-0.0563	-0.76	1.217	2.16E-4	0.0	-0.5353	-0.7044	1912817	CBDivE_000770	CC/1=NN(C(=O)\C1=C/c2cccc(c2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G11	compound treatment	1.081	-0.0153	-0.21	1.207	-0.00978	-0.13	-0.2406	-0.9775	1912818	CBDivE_000771	CC[n+]1c(/C=C/Nc2ccccc2)oc3ccc(cc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G12	compound treatment	1.157	0.0607	0.82	1.278	0.0612	0.83	1.169	1.0	1912819	CBDivE_000772	COc1ccc(/C=C/2\C(=NN(C2=O)c3ccc(cc3)[N+](=O)[O-])C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G13	compound treatment	1.129	0.0327	0.44	1.136	-0.0808	-1.1	-0.4673	-0.3939	1912820	CBDivE_000773	Cc1oc2ccccc2[n+]1CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G14	compound treatment	1.064	-0.0323	-0.44	1.242	0.0252	0.34	-0.0653	-0.1175	1383134	CBDivE_000774	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3ccncc3)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G15	compound treatment	1.061	-0.0353	-0.48	1.231	0.0142	0.19	-0.2	-0.3886	1912821	CBDivE_000775	OC(=O)CC[n+]1c(/C=C/Nc2ccccc2)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G16	compound treatment	1.141	0.0447	0.6	1.245	0.0282	0.38	0.6982	0.9765	1912822	CBDivE_000776	COc1ccc(C2CC(=NN2c3cccc(c3)C(F)(F)F)c4ccc(Cl)cc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G17	compound treatment	1.124	0.0277	0.37	1.185	-0.0318	-0.43	-0.0425	-0.0744	1912823	CBDivE_000777	OS(=O)(=O)CCCSc1nc2ccccc2o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G18	compound treatment	1.087	-0.00933	-0.13	1.24	0.0232	0.32	0.1348	0.3958	1912824	CBDivE_000778	Fc1c(F)c(F)c(/C=C/2\S\C(=N/c3ccccc3)\NC2=O)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G19	compound treatment	1.109	0.0127	0.17	1.188	-0.0288	-0.39	-0.1567	-0.366	1912825	CBDivE_000779	CC[n+]1c(/C=C/Nc2ccccc2)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	G20	compound treatment	1.139	0.0427	0.58	1.228	0.0112	0.15	0.5152	0.865	1120036	CBDivE_000780	Brc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc4ccccc4c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H01	compound treatment	1.056	-0.0403	-0.54	1.198	-0.0188	-0.26	-0.5659	-0.9409	1912826	CBDivE_000781	CN1CCC2C(C1)c3cc(C)ccc3N2C(=O)c4cc(cc(c4)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H02	compound treatment	1.088	-0.00833	-0.11	1.22	0.00322	0.04	-0.0485	-0.4017	1912827	CBDivE_000782	CCN(CC)c1ccc(/C=N\NC(=O)c2cccc(Br)c2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H03	compound treatment	1.053	-0.0433	-0.58	1.136	-0.0808	-1.1	-1.1923	-0.9561	1912828	CBDivE_000783	[O-][N+](=O)c1cccc(OC(=O)C2CC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H04	compound treatment	1.131	0.0347	0.47	1.22	0.00322	0.04	0.3617	0.77	1912829	CBDivE_000784	Brc1cccc(c1)C(=O)N/N=C\c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H05	compound treatment	1.088	-0.00833	-0.11	1.187	-0.0298	-0.41	-0.3667	-0.8701	1912830	CBDivE_000785	[O-][N+](=O)c1ccc(NC(=O)C2CC2c3ccccc3)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H06	compound treatment	1.104	0.00767	0.1	1.213	-0.00378	-0.05	0.0367	0.3171	1912831	CBDivE_000786	COc1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H07	compound treatment	1.033	-0.0633	-0.85	1.188	-0.0288	-0.39	-0.8817	-0.9377	1597228	CBDivE_000787	O=C(Nc1cccc2ccccc12)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H08	compound treatment	1.101	0.00467	0.06	1.212	-0.00478	-0.07	-0.0016	-0.0176	1912832	CBDivE_000788	COc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H09	compound treatment	1.132	0.0357	0.48	1.1	-0.117	-1.59	-0.7858	-0.4724	1346276	CBDivE_000789	O=C(Oc1ccc(cc1)c2ccccc2)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H10	compound treatment	1.116	0.0197	0.27	1.259	0.0422	0.58	0.5947	0.9382	1912833	CBDivE_000790	COc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H11	compound treatment	1.044	-0.0523	-0.71	1.179	-0.0378	-0.52	-0.8635	-0.988	1504196	CBDivE_000791	COc1ccc(NC(=O)C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H12	compound treatment	1.111	0.0147	0.2	1.219	0.00222	0.03	0.1613	0.8057	1912834	CBDivE_000792	COc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H13	compound treatment	1.101	0.00467	0.06	1.206	-0.0108	-0.15	-0.0595	-0.3716	1912835	CBDivE_000793	[O-][N+](=O)c1ccc(CS(=O)(=O)Nc2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H14	compound treatment	1.038	-0.0583	-0.79	1.195	-0.0218	-0.3	-0.7665	-0.9113	1912836	CBDivE_000794	COc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)COc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H15	compound treatment	1.108	0.0117	0.16	1.193	-0.0238	-0.32	-0.118	-0.3274	1912837	CBDivE_000795	[O-][N+](=O)c1ccc(CS(=O)(=O)Nc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H16	compound treatment	1.08	-0.0163	-0.22	1.23	0.0132	0.18	-0.0284	-0.0996	1787870	CBDivE_000796	COc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3cc4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H17	compound treatment	1.087	-0.00933	-0.13	1.224	0.00722	0.1	-0.0194	-0.1217	1148898	CBDivE_000797	CC(C)(C)NS(=O)(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H18	compound treatment	1.081	-0.0153	-0.21	1.215	-0.00178	-0.02	-0.1635	-0.7849	1140549	CBDivE_000798	Fc1ccc(CN(C(=O)c2cccc3ccccc23)c4ccc(I)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H19	compound treatment	1.091	-0.00533	-0.07	1.199	-0.0178	-0.24	-0.2223	-0.879	1912838	CBDivE_000799	FC(F)(F)c1cccc(c1)S(=O)(=O)Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	H20	compound treatment	1.145	0.0487	0.66	1.197	-0.0198	-0.27	0.2735	0.3853	1783982	CBDivE_000800	[O-][N+](=O)c1ccc(cc1)C(=O)N(Cc2ccc(F)cc2)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I01	compound treatment	1.088	-0.00833	-0.11	1.236	0.0192	0.26	0.1058	0.3711	1912839	CBDivE_000801	CC[n+]1c(/C=C/N(C)c2ccccc2)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I02	compound treatment	1.096	-3.31E-4	0.0	1.281	0.0642	0.88	0.616	0.7035	1597138	CBDivE_000802	Clc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I03	compound treatment	1.026	-0.0703	-0.95	1.237	0.0202	0.28	-0.476	-0.4817	1912840	CBDivE_000803	CC[n+]1c(/C=C/C=C/C=C/N(C(=O)O)c2ccccc2)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I04	compound treatment	1.109	0.0127	0.17	1.223	0.00622	0.08	0.1808	0.9476	1206510	CBDivE_000804	Brc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I05	compound treatment	1.038	-0.0583	-0.79	1.22	0.00322	0.04	-0.5254	-0.6667	1912841	CBDivE_000805	Cc1oc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I06	compound treatment	1.125	0.0287	0.39	1.239	0.0222	0.3	0.4877	0.9927	1475780	CBDivE_000806	CCOc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I07	compound treatment	1.092	-0.00433	-0.06	1.177	-0.0398	-0.54	-0.4249	-0.7788	1912842	CBDivE_000807	C[N+]1=C(/C=C/Nc2ccccc2Cl)C(C)(C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I08	compound treatment	1.078	-0.0183	-0.25	1.268	0.0512	0.7	0.319	0.4305	1407192	CBDivE_000808	Clc1cccc(c1)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I09	compound treatment	1.083	-0.0133	-0.18	1.195	-0.0218	-0.3	-0.3372	-0.9711	1912843	CBDivE_000809	CN(/C=C/C1=[N+](C)c2ccccc2C1(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I10	compound treatment	1.118	0.0217	0.29	1.156	-0.0608	-0.83	-0.3794	-0.4317	1571678	CBDivE_000810	COc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I11	compound treatment	1.045	-0.0513	-0.69	1.208	-0.00878	-0.12	-0.5744	-0.8173	1912844	CBDivE_000811	CC1=[N+](C)c2c(ccc3cccnc23)C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I12	compound treatment	1.099	0.00267	0.04	1.17	-0.0468	-0.64	-0.4257	-0.6661	1009923	CBDivE_000812	O=C(N1CC(=O)NC1=S)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I13	compound treatment	1.038	-0.0583	-0.79	1.225	0.00822	0.11	-0.4772	-0.6004	1571500	CBDivE_000813	CC(=O)Oc1cn(C(=O)C)c2ccc(I)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I14	compound treatment	1.098	0.00167	0.02	1.189	-0.0278	-0.38	-0.252	-0.6639	1592628	CBDivE_000814	CCOc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc4ccccc4c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I15	compound treatment	1.101	0.00467	0.06	1.177	-0.0398	-0.54	-0.3391	-0.6208	1912845	CBDivE_000815	Cc1nc2cc(ccc2s1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I16	compound treatment	1.085	-0.0113	-0.15	1.237	0.0202	0.28	0.0868	0.2755	1346455	CBDivE_000816	COc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc4ccccc4c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I17	compound treatment	1.083	-0.0133	-0.18	1.206	-0.0108	-0.15	-0.2312	-0.995	1434333	CBDivE_000817	Sc1nc2ccc(NC(=S)Nc3ccccc3)cc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I18	compound treatment	1.108	0.0117	0.16	1.235	0.0182	0.25	0.287	0.9758	1458210	CBDivE_000818	Clc1cccc(c1)N2C(=O)CC(SCC(=O)Nc3ccc4ccccc4c3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I19	compound treatment	1.072	-0.0243	-0.33	1.234	0.0172	0.23	-0.0661	-0.1638	1912846	CBDivE_000819	Cc1sc2ccccc2[n+]1CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	I20	compound treatment	1.16	0.0637	0.86	1.234	0.0172	0.23	0.7734	0.8685	1912847	CBDivE_000820	COc1ccc(cc1)C2CC(=NN2c3cccc(F)c3)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J01	compound treatment	1.085	-0.0113	-0.15	1.231	0.0142	0.19	0.029	0.1174	1912848	CBDivE_000821	[O-][N+](=O)c1ccc(CS(=O)(=O)Nc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J02	compound treatment	1.118	0.0217	0.29	1.241	0.0242	0.33	0.4402	0.9982	1912849	CBDivE_000822	[O-][N+](=O)c1cccc(c1)C(=O)N(Cc2ccc(F)cc2)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J03	compound treatment	1.068	-0.0283	-0.38	1.175	-0.0418	-0.57	-0.6732	-0.9811	1482832	CBDivE_000823	CC(N(C(=O)c1ccccc1)c2ccc(Cl)c(Cl)c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J04	compound treatment	1.063	-0.0333	-0.45	1.23	0.0132	0.18	-0.1905	-0.3933	1775234	CBDivE_000824	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N(Cc2ccc(F)cc2)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J05	compound treatment	1.039	-0.0573	-0.77	1.167	-0.0498	-0.68	-1.0269	-0.9979	1912850	CBDivE_000825	CN(C)NC(=O)NS(=O)(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J06	compound treatment	1.105	0.00867	0.12	1.196	-0.0208	-0.28	-0.1177	-0.3839	1912851	CBDivE_000826	[O-][N+](=O)c1ccccc1C(=O)N(Cc2ccc(F)cc2)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J07	compound treatment	1.099	0.00267	0.04	1.222	0.00522	0.07	0.0757	0.9502	1912852	CBDivE_000827	CN(C)CCOC(=O)NS(=O)(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J08	compound treatment	1.08	-0.0163	-0.22	1.225	0.00822	0.11	-0.0766	-0.3098	1912853	CBDivE_000828	Fc1ccc(CN(C(=O)COc2ccccc2)c3ccc(I)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J09	compound treatment	1.077	-0.0193	-0.26	1.196	-0.0208	-0.28	-0.3848	-0.9991	1180440	CBDivE_000829	Nc1nc(nc(n1)c2ccco2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J10	compound treatment	1.105	0.00867	0.12	1.183	-0.0338	-0.46	-0.2431	-0.5114	1429145	CBDivE_000830	Fc1ccc(CN(C(=O)c2cc3ccccc3oc2=O)c4ccc(I)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J11	compound treatment	1.049	-0.0473	-0.64	1.235	0.0182	0.25	-0.2759	-0.4026	1228543	CBDivE_000831	COc1ccccc1c2nc(N)nc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J12	compound treatment	1.061	-0.0353	-0.48	1.135	-0.0818	-1.12	-1.1256	-0.9281	1775235	CBDivE_000832	Cc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J13	compound treatment	1.085	-0.0113	-0.15	1.186	-0.0308	-0.42	-0.4049	-0.9064	1912854	CBDivE_000833	CN(C)c1nc(N)nc(CNS(=O)(=O)c2ccc(C)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J14	compound treatment	1.063	-0.0333	-0.45	1.171	-0.0458	-0.62	-0.7594	-0.987	1912855	CBDivE_000834	Cc1ccc(cc1)N(Cc2ccc(F)cc2)C(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J15	compound treatment	1.022	-0.0743	-1.0	1.216	-7.84E-4	-0.01	-0.7166	-0.7146	1912856	CBDivE_000835	Clc1ccccc1S(=O)(=O)NC(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J16	compound treatment	1.1	0.00367	0.05	1.214	-0.00278	-0.04	0.0081	0.1306	1912857	CBDivE_000836	[O-][N+](=O)c1ccc(cc1)C(=O)Oc2ccc3ccccc3c2CNC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J17	compound treatment	1.091	-0.00533	-0.07	1.188	-0.0288	-0.39	-0.3284	-0.823	1912858	CBDivE_000837	FC(F)(F)CCSc1ccccc1Nc2nc(Cl)nc(Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J18	compound treatment	1.11	0.0137	0.18	1.232	0.0152	0.21	0.2771	0.9983	1912859	CBDivE_000838	Clc1ccc(C(=O)Oc2c(Br)cc(Br)cc2CNC(=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J19	compound treatment	1.094	-0.00233	-0.03	1.187	-0.0298	-0.41	-0.3094	-0.7596	1912860	CBDivE_000839	FC(F)(F)Sc1ccccc1Nc2nc(Cl)nc(Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	J20	compound treatment	1.089	-0.00733	-0.1	1.209	-0.00778	-0.11	-0.145	-0.9994	1912861	CBDivE_000840	Brc1cc(Br)c(OC(=O)c2cccc3ccccc23)c(CNC(=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K01	compound treatment	1.055	-0.0413	-0.56	1.217	2.16E-4	0.0	-0.3922	-0.7034	3002716	CBDivE_000841	Cc1sc2ccccc2[n+]1CCO.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K02	compound treatment	1.168	0.0717	0.97	1.213	-0.00378	-0.05	0.6472	0.6684	1541773	CBDivE_000842	COc1ccc2nc(sc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K03	compound treatment	1.066	-0.0303	-0.41	1.17	-0.0468	-0.64	-0.7405	-0.977	3105543	CBDivE_000843	CC[n+]1c(C)sc2c3CCCCc3ccc12.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K04	compound treatment	1.087	-0.00933	-0.13	1.205	-0.0118	-0.16	-0.2026	-0.9927	1394173	CBDivE_000844	Clc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K05	compound treatment	1.07	-0.0263	-0.36	1.318	0.101	1.38	0.7248	0.5085	3105544	CBDivE_000845	COc1ccc2sc(C)[n+](CCC(=O)O)c2c1.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K06	compound treatment	1.108	0.0117	0.16	1.245	0.0282	0.38	0.3834	0.9222	1429691	CBDivE_000846	CCOc1ccc(cc1)N2C(=O)CC(SCC(=O)Nc3ccc(Cl)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K07	compound treatment	1.114	0.0177	0.24	1.224	0.00722	0.1	0.2381	0.9234	1912865	CBDivE_000847	CC[n+]1c(C)sc2cc3OCOc3cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K08	compound treatment	1.06	-0.0363	-0.49	1.222	0.00522	0.07	-0.2963	-0.5982	1367982	CBDivE_000848	Cc1ccc(N2C(=O)CC(SCC(=O)Nc3ccc(Cl)cc3)C2=O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K09	compound treatment	1.114	0.0177	0.24	1.288	0.0712	0.97	0.8552	0.8553	3002762	CBDivE_000849	CC[n+]1c(C)sc2ccc3ccccc3c12.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K10	compound treatment	1.121	0.0247	0.33	1.197	-0.0198	-0.27	0.0446	0.104	1129792	CBDivE_000850	Clc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3cccc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K11	compound treatment	1.11	0.0137	0.18	1.221	0.00422	0.06	0.171	0.8855	1912867	CBDivE_000851	COc1ccc2sc(C)[n+](CC(O)CS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K12	compound treatment	1.118	0.0217	0.29	1.21	-0.00678	-0.09	0.1413	0.4608	1655779	CBDivE_000852	Clc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K13	compound treatment	1.106	0.00967	0.13	1.221	0.00422	0.06	0.1329	0.9322	3105545	CBDivE_000853	COc1ccc2sc(C)[n+](CCO)c2c1.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K14	compound treatment	1.082	-0.0143	-0.19	1.226	0.00922	0.13	-0.0478	-0.2075	1912869	CBDivE_000854	Cc1cccc(c1)N2C(=O)CC(SCC(=O)O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K15	compound treatment	1.136	0.0397	0.54	1.22	0.00322	0.04	0.4094	0.7625	1912870	CBDivE_000855	Cc1sc2ccc3ccccc3c2[n+]1CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K16	compound treatment	1.07	-0.0263	-0.36	1.222	0.00522	0.07	-0.2009	-0.5545	1704141	CBDivE_000856	OC(=O)CSC1CC(=O)N(C1=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K17	compound treatment	1.066	-0.0303	-0.41	1.176	-0.0408	-0.56	-0.6826	-0.9886	1912871	CBDivE_000857	Cc1sc2c(ccc3ccccc23)[n+]1CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K18	compound treatment	1.092	-0.00433	-0.06	1.236	0.0192	0.26	0.144	0.5363	1912872	CBDivE_000858	Brc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)S(=O)(=O)c4ccccc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K19	compound treatment	1.068	-0.0283	-0.38	1.201	-0.0158	-0.22	-0.4225	-0.9631	3105546	CBDivE_000859	CC[n+]1c(C)sc2ccc(OC)cc12.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	K20	compound treatment	1.087	-0.00933	-0.13	1.254	0.0372	0.51	0.2698	0.5161	1912874	CBDivE_000860	COc1ccc(cc1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L01	compound treatment	1.081	-0.0153	-0.21	1.277	0.0602	0.82	0.4344	0.513	1912875	CBDivE_000861	FC(F)(F)C(F)(F)C(F)(F)Sc1ccccc1Nc2nc(Cl)nc(Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L02	compound treatment	1.136	0.0397	0.54	1.262	0.0452	0.62	0.8144	0.9975	1912876	CBDivE_000862	CCC(=O)Oc1c(CNC(=O)c2ccccc2)cc(Br)cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L03	compound treatment	1.096	-3.31E-4	0.0	1.237	0.0202	0.28	0.1918	0.6956	1032258	CBDivE_000863	CC(=O)NC(CO)C(O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L04	compound treatment	1.149	0.0527	0.71	1.252	0.0352	0.48	0.842	0.9818	1603706	CBDivE_000864	OC(=O)c1cc(Br)cc(CNC(=O)c2ccccc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L05	compound treatment	1.117	0.0207	0.28	1.185	-0.0318	-0.43	-0.1093	-0.2121	1912877	CBDivE_000865	Cc1c(N=Nc2ccc(cc2S(=O)(=O)O)[N+](=O)[O-])co[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L06	compound treatment	1.137	0.0407	0.55	1.217	2.16E-4	0.0	0.39	0.7109	1912878	CBDivE_000866	OC(CN1C(SCC1=O)c2ccccc2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L07	compound treatment	1.084	-0.0123	-0.17	1.231	0.0142	0.19	0.0194	0.0761	1912879	CBDivE_000867	CC(=O)NCC(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L08	compound treatment	1.144	0.0477	0.64	1.162	-0.0548	-0.75	-0.0735	-0.0746	1912880	CBDivE_000868	C(NC1=NCCN1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L09	compound treatment	1.054	-0.0423	-0.57	1.224	0.00722	0.1	-0.3342	-0.5768	1171666	CBDivE_000869	COc1ccc(cc1)C(=O)NCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L10	compound treatment	1.052	-0.0443	-0.6	1.195	-0.0218	-0.3	-0.6329	-0.9478	1912881	CBDivE_000870	O=C1CS/C(=N\N=C2C3CC4CC(C3)CC2C4)/N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L11	compound treatment	1.092	-0.00433	-0.06	1.249	0.0322	0.44	0.2693	0.6077	1912882	CBDivE_000871	Cc1ccc(NC(=O)C2CC2c3ccccc3)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L12	compound treatment	1.075	-0.0213	-0.29	1.241	0.0242	0.33	0.03	0.0685	1912883	CBDivE_000872	Cc1cccc(C)c1NC(=O)CSCCN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L13	compound treatment	1.087	-0.00933	-0.13	1.255	0.0382	0.52	0.2795	0.5213	1912884	CBDivE_000873	CC1(C)OC(=O)C(=C/C=C/c2ccc(Br)o2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L14	compound treatment	1.039	-0.0573	-0.77	1.226	0.00922	0.13	-0.458	-0.5845	1236667	CBDivE_000874	OC(=O)CSC1(CC2CC3C1)CC(C2)(C3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L15	compound treatment	1.101	0.00467	0.06	1.21	-0.00678	-0.09	-0.0209	-0.1866	1912885	CBDivE_000875	CC1(C)OC(=O)C(=C/C=C/c2ccc(o2)[N+](=O)[O-])C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L16	compound treatment	1.064	-0.0323	-0.44	1.205	-0.0118	-0.16	-0.422	-0.908	1912886	CBDivE_000876	CC1SC(N(CC(O)c2ccc(cc2)[N+](=O)[O-])C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L17	compound treatment	1.133	0.0367	0.49	1.243	0.0262	0.36	0.6026	0.9873	1912887	CBDivE_000877	CC1(C)OC(=O)C(=C/C=C/C=C/c2ccco2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L18	compound treatment	1.112	0.0157	0.21	1.233	0.0162	0.22	0.3058	0.9997	1912888	CBDivE_000878	OC(=O)CSCNC(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L19	compound treatment	1.102	0.00567	0.08	1.189	-0.0278	-0.38	-0.2138	-0.5532	1912889	CBDivE_000879	Cc1ccc(/C=C/C=C2C(=O)NC(=O)NC2=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	L20	compound treatment	1.116	0.0197	0.27	1.203	-0.0138	-0.19	0.0547	0.1683	1912890	CBDivE_000880	NCCSCC(=O)NC1C2CC3CC(C2)CC1C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M01	compound treatment	1.072	-0.0243	-0.33	1.252	0.0352	0.48	0.1075	0.1847	1912891	CBDivE_000881	OS(=O)(=O)CCCSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M02	compound treatment	1.141	0.0447	0.6	1.249	0.0322	0.44	0.7367	0.9879	1912892	CBDivE_000882	Cc1cccc(c1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M03	compound treatment	1.085	-0.0113	-0.15	1.217	2.16E-4	0.0	-0.106	-0.6934	1912891	CBDivE_000883	OS(=O)(=O)CCCSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M04	compound treatment	1.085	-0.0113	-0.15	1.254	0.0372	0.51	0.2508	0.4731	1912893	CBDivE_000884	Cc1cccc(c1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M05	compound treatment	1.104	0.00767	0.1	1.206	-0.0108	-0.15	-0.0308	-0.1715	1912894	CBDivE_000885	CCC(=O)/C=C/1\Sc2ccc(OC)cc2N1CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M06	compound treatment	1.092	-0.00433	-0.06	1.23	0.0132	0.18	0.0861	0.4545	1912895	CBDivE_000886	Brc1ccc(cc1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M07	compound treatment	1.089	-0.00733	-0.1	1.249	0.0322	0.44	0.2407	0.5345	1912896	CBDivE_000887	CC[n+]1c(/C=C(/C)\SC)sc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M08	compound treatment	1.134	0.0377	0.51	1.238	0.0212	0.29	0.5639	0.9643	1912897	CBDivE_000888	Clc1cccc(c1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M09	compound treatment	1.062	-0.0343	-0.46	1.245	0.0282	0.38	-0.0554	-0.0921	1912898	CBDivE_000889	CC[n+]1c(/C=C/C=C/N(C(=O)C)c2ccccc2)sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M10	compound treatment	1.096	-3.31E-4	0.0	1.191	-0.0258	-0.35	-0.2518	-0.716	1482524	CBDivE_000890	OC(=O)CSC1CC(=O)N(C1=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M11	compound treatment	1.11	0.0137	0.18	1.229	0.0122	0.17	0.2482	0.9987	1912899	CBDivE_000891	COc1ccc(cc1)C2=NN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M12	compound treatment	1.144	0.0477	0.64	1.182	-0.0348	-0.47	0.1193	0.1493	1912900	CBDivE_000892	COc1ccc(cc1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M13	compound treatment	1.103	0.00667	0.09	1.231	0.0142	0.19	0.2007	0.9391	1912901	CBDivE_000893	Cc1nn(c(c1C(=O)O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M14	compound treatment	1.126	0.0297	0.4	1.255	0.0382	0.52	0.6515	0.9915	1211865	CBDivE_000894	COc1ccc(cc1)N2C(=O)CC(SCC(=O)O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M15	compound treatment	1.103	0.00667	0.09	1.262	0.0452	0.62	0.4996	0.8018	1117923	CBDivE_000895	COc1ccc2n(Cc3ccccc3)c4CCCCc4c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M16	compound treatment	1.114	0.0177	0.24	1.257	0.0402	0.55	0.5563	0.9304	1912902	CBDivE_000896	Clc1ccc(cc1)C(C2C(=O)N(N=C2c3ccc(Cl)cc3)c4ccc(Cl)cc4)N5CCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M17	compound treatment	1.109	0.0127	0.17	1.248	0.0312	0.43	0.4218	0.9197	1334937	CBDivE_000897	CC(C)(O)C1C(N2CCOCC2)C(C)(C)S1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M18	compound treatment	1.117	0.0207	0.28	1.237	0.0202	0.28	0.3921	1.0	1232796	CBDivE_000898	OC(=O)CSC1CC(=O)N(C1=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M19	compound treatment	1.088	-0.00833	-0.11	1.26	0.0432	0.59	0.3372	0.5621	1441823	CBDivE_000899	CC(CS(=O)(=O)c1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	M20	compound treatment	1.111	0.0147	0.2	1.254	0.0372	0.51	0.4988	0.9157	1912903	CBDivE_000900	Clc1ccc(cc1)N2C(=O)CC(N3CCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N01	compound treatment	1.091	-0.00533	-0.07	1.185	-0.0318	-0.43	-0.3573	-0.8133	1912904	CBDivE_000901	CC1(C)OC(=O)C(=Cc2ccc(o2)N3CCOCC3)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N02	compound treatment	1.121	0.0247	0.33	1.189	-0.0278	-0.38	-0.0326	-0.0646	1198875	CBDivE_000902	CCOC(=O)c1c(C)nc(N)nc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N03	compound treatment	1.052	-0.0443	-0.6	1.16	-0.0568	-0.77	-0.9704	-0.9919	1912905	CBDivE_000903	CC1(C)OC(=O)C(C/C=C/c2ccco2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N04	compound treatment	1.069	-0.0273	-0.37	1.174	-0.0428	-0.58	-0.6733	-0.9755	1912906	CBDivE_000904	CN(C)c1ccc(/C=C/2\NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N05	compound treatment	1.058	-0.0383	-0.52	1.232	0.0152	0.21	-0.2189	-0.3929	1100851	CBDivE_000905	CC1(C)OC(=O)C(Cc2ccco2)C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N06	compound treatment	1.059	-0.0373	-0.5	1.207	-0.00978	-0.13	-0.4505	-0.8646	1912907	CBDivE_000906	Oc1ccc2ccccc2c1/C=N/Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N07	compound treatment	1.008	-0.0883	-1.19	1.151	-0.0658	-0.9	-1.4769	-0.9902	1265642	CBDivE_000907	Brc1ccc(cc1)C2OCC(CC(=O)NCc3ccccc3)N2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N08	compound treatment	1.084	-0.0123	-0.17	1.183	-0.0338	-0.46	-0.4434	-0.9052	1912908	CBDivE_000908	CC1(C)C(CCC1(C)C(=O)O)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N09	compound treatment	1.048	-0.0483	-0.65	1.206	-0.0108	-0.15	-0.565	-0.8454	1912909	CBDivE_000909	O=C(CC1COC(=O)N1Cc2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N10	compound treatment	1.088	-0.00833	-0.11	1.23	0.0132	0.18	0.048	0.2258	1225441	CBDivE_000910	Cc1ccc(NC(=O)C2CCC(C)(C(=O)O)C2(C)C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N11	compound treatment	1.082	-0.0143	-0.19	1.237	0.0202	0.28	0.0582	0.1729	1912910	CBDivE_000911	O=C(CC1COC(N1Cc2ccccc2)c3ccccc3)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N12	compound treatment	1.052	-0.0443	-0.6	1.198	-0.0188	-0.26	-0.604	-0.9284	1912911	CBDivE_000912	O=C(CCCCC(=O)N1CCc2ccccc12)N3CCc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N13	compound treatment	1.07	-0.0263	-0.36	1.178	-0.0388	-0.53	-0.6252	-0.9813	1912912	CBDivE_000913	O=C(CC1COC(=O)C(=O)N1Cc2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N14	compound treatment	1.106	0.00967	0.13	1.238	0.0212	0.29	0.2968	0.9353	1572783	CBDivE_000914	CC1(C)C(CCC1(C)C(=O)O)C(=O)N2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N15	compound treatment	1.004	-0.0923	-1.25	1.232	0.0152	0.21	-0.7341	-0.5813	1408221	CBDivE_000915	O=C(CC1COS(=O)N1Cc2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N16	compound treatment	1.109	0.0127	0.17	1.185	-0.0318	-0.43	-0.1856	-0.3984	1912913	CBDivE_000916	CCC(=O)NNC(=O)C1CC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N17	compound treatment	1.07	-0.0263	-0.36	1.212	-0.00478	-0.07	-0.2973	-0.8232	1912914	CBDivE_000917	CCCC1OC(c2ccccc2)(c3ccccc3)c4ccccc4N1C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N18	compound treatment	1.052	-0.0443	-0.6	1.253	0.0362	0.49	-0.0737	-0.095	1912915	CBDivE_000918	CC(=O)N/C(=C/c1ccccc1)/C(=O)Nc2ccc(N=Nc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N19	compound treatment	1.117	0.0207	0.28	1.222	0.00522	0.07	0.2475	0.8599	1912916	CBDivE_000919	CC(=O)N1C(OC(c2ccccc2)(c3ccccc3)c4ccccc14)/C=C/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	N20	compound treatment	1.092	-0.00433	-0.06	1.181	-0.0358	-0.49	-0.3864	-0.7862	1912917	CBDivE_000920	CCC(Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O01	compound treatment	1.058	-0.0383	-0.52	1.218	0.00122	0.02	-0.3539	-0.6841	1352991	CBDivE_000921	O=S1(=O)CC(N2CCOCC2)c3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O02	compound treatment	1.07	-0.0263	-0.36	1.285	0.0682	0.93	0.4066	0.4083	1912918	CBDivE_000922	Brc1ccc(cc1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O03	compound treatment	1.077	-0.0193	-0.26	1.228	0.0112	0.15	-0.0763	-0.2522	1912919	CBDivE_000923	C1C(N(N=C1/C=C/c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O04	compound treatment	1.125	0.0287	0.39	1.231	0.0142	0.19	0.4106	0.949	1912920	CBDivE_000924	Clc1ccc(cc1)N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O05	compound treatment	1.062	-0.0343	-0.46	1.244	0.0272	0.37	-0.0651	-0.1096	1912921	CBDivE_000925	CC(C)C(C)(OC(=O)C)/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O06	compound treatment	1.13	0.0337	0.45	1.238	0.0212	0.29	0.5257	0.9763	1912922	CBDivE_000926	O=C1CC(N2CCOCC2)C(=O)N1c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O07	compound treatment	1.084	-0.0123	-0.17	1.263	0.0462	0.63	0.328	0.5032	1912923	CBDivE_000927	Cc1nn(c(Cl)c1CO)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O08	compound treatment	1.119	0.0227	0.31	1.25	0.0332	0.45	0.5365	0.9817	1322468	CBDivE_000928	CCOc1ccc(cc1)N2C(=O)CC(SCC(=O)O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O09	compound treatment	1.074	-0.0223	-0.3	1.267	0.0502	0.68	0.2712	0.3625	1912924	CBDivE_000929	Cc1cc(C)n(n1)c2ccc(Oc3ccccc3)c(c2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O10	compound treatment	1.132	0.0357	0.48	1.268	0.0512	0.7	0.8341	0.9835	1912925	CBDivE_000930	Cc1cccc(c1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5cccc(C)c5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O11	compound treatment	1.032	-0.0643	-0.87	1.209	-0.00778	-0.11	-0.6887	-0.7877	1912926	CBDivE_000931	Nc1cc(nn1c2ccccc2)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O12	compound treatment	1.101	0.00467	0.06	1.3	0.0832	1.13	0.8469	0.7452	1912927	CBDivE_000932	Clc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5ccc(Cl)cc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O13	compound treatment	1.023	-0.0733	-0.99	1.207	-0.00978	-0.13	-0.7939	-0.7953	1912928	CBDivE_000933	CC(C)C1N(N=CC1(C)C)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O14	compound treatment	1.113	0.0167	0.22	1.225	0.00822	0.11	0.2382	0.9482	1912929	CBDivE_000934	Clc1cccc(c1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5cccc(Cl)c5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O15	compound treatment	1.154	0.0577	0.78	1.198	-0.0188	-0.26	0.369	0.4505	1912930	CBDivE_000935	Cc1nn(CCC#N)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O16	compound treatment	1.105	0.00867	0.12	1.228	0.0112	0.15	0.1908	0.9912	1912931	CBDivE_000936	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5ccc(OC)cc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O17	compound treatment	1.16	0.0637	0.86	1.24	0.0232	0.32	0.8312	0.908	1912932	CBDivE_000937	CCOC(=O)C1CNN=C1C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O18	compound treatment	1.071	-0.0253	-0.34	1.256	0.0392	0.53	0.1365	0.2151	1912933	CBDivE_000938	Brc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5ccc(Br)cc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O19	compound treatment	1.104	0.00767	0.1	1.241	0.0242	0.33	0.3067	0.8862	1500807	CBDivE_000939	COc1ccc(cc1)C2=NN(CCc3ccccn3)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	O20	compound treatment	1.148	0.0517	0.7	1.238	0.0212	0.29	0.6975	0.9242	1912934	CBDivE_000940	COc1ccc(cc1)C2N[C@@H](CS2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P01	compound treatment	1.061	-0.0353	-0.48	1.16	-0.0568	-0.77	-0.8846	-0.9728	1912935	CBDivE_000941	Br/C(=C\c1ccccc1)/C2Nc3ccccc3C(O2)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P02	compound treatment	1.116	0.0197	0.27	1.244	0.0272	0.37	0.4501	0.9865	1912936	CBDivE_000942	CC(=O)N/C(=C\c1ccccc1)/C(=O)Nc2ccc(C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P03	compound treatment	0.99	-0.106	-1.43	1.224	0.00722	0.1	-0.9448	-0.6571	1912937	CBDivE_000943	[O-][N+](=O)c1ccccc1C2=Nc3ccccc3C(O2)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P04	compound treatment	1.109	0.0127	0.17	1.162	-0.0548	-0.75	-0.4074	-0.5316	1912938	CBDivE_000944	[O-][N+](=O)c1ccc(/C=N/NC(=O)C2CC2c3ccccc3)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P05	compound treatment	1.03	-0.0663	-0.89	1.14	-0.0768	-1.05	-1.3731	-0.9969	1912939	CBDivE_000945	[O-][N+](=O)c1cccc(c1)C2=Nc3ccccc3C(O2)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P06	compound treatment	1.064	-0.0323	-0.44	1.18	-0.0368	-0.5	-0.6631	-0.9976	1912940	CBDivE_000946	COc1ccc(/C=N/NC(=O)C2CC2c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P07	compound treatment	1.006	-0.0903	-1.22	1.113	-0.104	-1.42	-1.8624	-0.9972	1912941	CBDivE_000947	C1Oc2ccc(cc2O1)C3Nc4ccccc4C(O3)(c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P08	compound treatment	1.176	0.0797	1.07	1.224	0.00722	0.1	0.8296	0.7686	1912942	CBDivE_000948	O=C(NNC(=O)c1ccc(cc1)c2ccccc2)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P09	compound treatment	1.071	-0.0253	-0.34	1.256	0.0392	0.53	0.1365	0.2151	1720925	CBDivE_000949	CCC1(CC)OC(Nc2ccccc21)c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P10	compound treatment	1.065	-0.0313	-0.42	1.17	-0.0468	-0.64	-0.75	-0.98	1912943	CBDivE_000950	[O-][N+](=O)c1ccc(/C=N/NC(=O)C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P11	compound treatment	1.012	-0.0843	-1.14	1.154	-0.0628	-0.86	-1.4099	-0.9902	1302719	CBDivE_000951	COC(=O)c1ccccc1NCNc2ccccc2C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P12	compound treatment	1.128	0.0317	0.43	1.192	-0.0248	-0.34	0.0631	0.1159	1912944	CBDivE_000952	O=C(N/N=C(\C=C\c1ccccc1)/c2ccccc2)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P13	compound treatment	0.997	-0.0993	-1.34	1.214	-0.00278	-0.04	-0.9744	-0.7269	1912945	CBDivE_000953	N1C(OC(c2ccccc2)(c3ccccc3)c4ccccc14)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P14	compound treatment	1.128	0.0317	0.43	1.139	-0.0778	-1.06	-0.4479	-0.3917	1912946	CBDivE_000954	COc1ccc(cc1OC)/C(=N/NC(=O)C2CC2c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P15	compound treatment	1.096	-3.31E-4	0.0	1.196	-0.0208	-0.28	-0.2036	-0.7182	1912947	CBDivE_000955	CCC1(CC)OC(Nc2ccccc21)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P16	compound treatment	1.13	0.0337	0.45	1.208	-0.00878	-0.12	0.2365	0.5034	1912948	CBDivE_000956	[O-][N+](=O)c1cccc(/C=N/NC(=O)C2CC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P17	compound treatment	1.137	0.0407	0.55	1.272	0.0552	0.75	0.9204	0.9879	1912949	CBDivE_000957	CC1(C)OC(Nc2ccccc21)c3ccc(o3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P18	compound treatment	1.023	-0.0733	-0.99	1.223	0.00622	0.08	-0.6396	-0.6442	1912950	CBDivE_000958	COc1ccc(cc1)/C(=N/NC(=O)C2CC2c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P19	compound treatment	1.049	-0.0473	-0.64	1.162	-0.0548	-0.75	-0.9798	-0.9969	1912951	CBDivE_000959	[O-][N+](=O)c1ccc(s1)C2Nc3ccccc3C(O2)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.3	P20	compound treatment	1.08	-0.0163	-0.22	1.25	0.0332	0.45	0.1645	0.3266	1912952	CBDivE_000960	C/C(=N\NC(=O)C1CC1c2ccccc2)/c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A01	compound treatment	1.267	0.0119	0.16	1.431	-0.0283	-0.39	-0.1593	-0.3814	1918577	CBDivE_009281	O=S(=O)(c1ccccc1)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A02	compound treatment	1.281	0.0259	0.35	1.45	-0.00929	-0.13	0.1574	0.4237	1918578	CBDivE_009282	CCN(CC)CC(=O)Nc1cc(C)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A03	compound treatment	1.286	0.0309	0.42	1.553	0.0937	1.28	1.1983	0.8915	1442693	CBDivE_009283	CC(C)(C)Nc1nc(Cl)nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A04	compound treatment	1.303	0.0479	0.65	1.426	-0.0333	-0.45	0.1359	0.1721	1918579	CBDivE_009284	COc1ccc2c(=O)c(coc2c1)c3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A05	compound treatment	1.323	0.0679	0.92	1.521	0.0617	0.84	1.2427	0.9991	1918580	CBDivE_009285	CC(=O)C/C(=N/NC(=O)c1ccc(Br)cc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A06	compound treatment	1.263	0.00789	0.11	1.406	-0.0533	-0.73	-0.4386	-0.5972	1417663	CBDivE_009286	CC1(C)CC(=O)c2c(NCc3ccccc3)c4ccccc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A07	compound treatment	1.327	0.0719	0.97	1.563	0.104	1.41	1.6858	0.9831	1100932	CBDivE_009287	C1Cn2cc(nc2S1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A08	compound treatment	1.305	0.0499	0.67	1.543	0.0837	1.14	1.2831	0.9683	1918581	CBDivE_009288	[O-][N+](=O)c1ccccc1NC(=O)CCCCCCC(=O)Nc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A09	compound treatment	1.329	0.0739	1.0	1.437	-0.0223	-0.3	0.4899	0.4701	1918582	CBDivE_009289	NNC(=O)N/N=C/c1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A10	compound treatment	1.298	0.0429	0.58	1.433	-0.0263	-0.36	0.1557	0.2287	1641277	CBDivE_009290	Cn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A11	compound treatment	1.293	0.0379	0.51	1.561	0.102	1.39	1.3422	0.908	1918583	CBDivE_009291	O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc3c4CCCc4nc5CCCCc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A12	compound treatment	1.28	0.0249	0.34	1.498	0.0387	0.53	0.6107	0.9761	1918584	CBDivE_009292	Cc1ccc(o1)C(=O)/C=C/c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A13	compound treatment	1.327	0.0719	0.97	1.491	0.0317	0.43	0.9916	0.9338	1918585	CBDivE_009293	C/C(=N\NC(=O)c1cccc(C)c1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A14	compound treatment	1.266	0.0109	0.15	1.465	0.00571	0.08	0.159	0.9559	1918586	CBDivE_009294	CC(=O)CC(C)(C)S(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A15	compound treatment	1.27	0.0149	0.2	1.513	0.0537	0.73	0.66	0.869	1918587	CBDivE_009295	CCN(CC)CC(=O)Nc1c2CCCc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A16	compound treatment	1.229	-0.0261	-0.35	1.46	7.12E-4	0.01	-0.2422	-0.6874	1547574	CBDivE_009296	CCC(=O)NN1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A17	compound treatment	1.377	0.122	1.64	1.551	0.0917	1.25	2.0471	0.9909	1252291	CBDivE_009297	Clc1ccc(cc1)C(=O)Nc2ncc(s2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A18	compound treatment	1.281	0.0259	0.35	1.42	-0.0393	-0.54	-0.1319	-0.2062	1918588	CBDivE_009298	CC(NC(=O)c1ccc(cc1)c2ccccc2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A19	compound treatment	1.298	0.0429	0.58	1.503	0.0437	0.6	0.8306	0.9999	1918589	CBDivE_009299	C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	A20	compound treatment	1.203	-0.0521	-0.7	1.454	-0.00529	-0.07	-0.5481	-0.7756	1918590	CBDivE_009300	CC(=O)N1c2nonc2N(C(=O)C)c3cc4nccnc4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B01	compound treatment	1.273	0.0179	0.24	1.388	-0.0713	-0.97	-0.5167	-0.5159	1918591	CBDivE_009301	Clc1ccc(NC(=O)c2cc(Cl)ccc2NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B02	compound treatment	1.325	0.0699	0.94	1.5	0.0407	0.56	1.0593	0.9681	1918592	CBDivE_009302	CC(C)(C)N(Cc1ccccc1)C(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B03	compound treatment	1.265	0.00989	0.13	1.433	-0.0263	-0.36	-0.1591	-0.416	1377509	CBDivE_009303	Cc1ccc(cc1)S(=O)(=O)Cc2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B04	compound treatment	1.23	-0.0251	-0.34	1.47	0.0107	0.15	-0.1362	-0.3693	1328491	CBDivE_009304	CC1(C)CC(O)c2c(NCc3ccccc3)c4ccccc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B05	compound treatment	1.231	-0.0241	-0.33	1.522	0.0627	0.86	0.3747	0.4095	1918593	CBDivE_009305	Cc1ccccc1NC(=O)C2CC(=O)OC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B06	compound treatment	1.199	-0.0561	-0.76	1.426	-0.0333	-0.45	-0.8562	-0.9701	1918594	CBDivE_009306	CCCCCn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B07	compound treatment	1.289	0.0339	0.46	1.488	0.0287	0.39	0.6001	0.997	1918595	CBDivE_009307	Cc1cc(C)c(NC(=O)C2CCCN2CCO)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B08	compound treatment	1.344	0.0889	1.2	1.414	-0.0453	-0.62	0.4113	0.3049	1222089	CBDivE_009308	Clc1ccc(Cn2c3CCCc3c(=N)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B09	compound treatment	1.211	-0.0441	-0.6	1.495	0.0357	0.49	-0.0764	-0.0994	1632793	CBDivE_009309	Cc1sc2ncnc(Nc3ccccc3)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B10	compound treatment	1.343	0.0879	1.19	1.468	0.00871	0.12	0.9224	0.7741	1918596	CBDivE_009310	COc1cccc(/C=N/c2ccc(Cl)cc2C(=O)c3ccccc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B11	compound treatment	1.25	-0.00511	-0.07	1.428	-0.0313	-0.43	-0.3504	-0.8108	1918597	CBDivE_009311	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B12	compound treatment	1.254	-0.00111	-0.01	1.42	-0.0393	-0.54	-0.3894	-0.7266	1552012	CBDivE_009312	CC1CCN(CC(O)COc2ccc(cc2)C3(CC4CC5CC(C4)C3)C5)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B13	compound treatment	1.281	0.0259	0.35	1.381	-0.0783	-1.07	-0.5079	-0.4522	1918598	CBDivE_009313	COc1cccc(/C=N\Nc2ccccn2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B14	compound treatment	1.22	-0.0351	-0.47	1.485	0.0257	0.35	-0.087	-0.1476	1568261	CBDivE_009314	Nc1ccccc1c2nc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B15	compound treatment	1.276	0.0209	0.28	1.419	-0.0403	-0.55	-0.1892	-0.3064	1918599	CBDivE_009315	Cc1nn(C)c(N/N=C/c2ccccc2O)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B16	compound treatment	1.237	-0.0181	-0.24	1.46	7.12E-4	0.01	-0.1659	-0.6785	1136498	CBDivE_009316	O=S(=O)(NC1CCCCC1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B17	compound treatment	1.252	-0.00311	-0.04	1.478	0.0187	0.26	0.1508	0.583	1918600	CBDivE_009317	COc1cc(/C=N/NC(=O)C2C3CCCCC23)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B18	compound treatment	1.22	-0.0351	-0.47	1.478	0.0187	0.26	-0.1545	-0.2872	1918601	CBDivE_009318	C1CN(CCO1)c2nonc2[n+]3nc4nonc4[n-]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B19	compound treatment	1.236	-0.0191	-0.26	1.408	-0.0513	-0.7	-0.6768	-0.908	1918602	CBDivE_009319	CC(=O)c1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	B20	compound treatment	1.188	-0.0671	-0.91	1.44	-0.0193	-0.26	-0.8262	-0.8763	1600040	CBDivE_009320	Fc1ccc(cc1)C(=O)Nc2ccc3-c4ccc(NC(=O)c5ccc(F)cc5)cc4S(=O)(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C01	compound treatment	1.249	-0.00611	-0.08	1.437	-0.0223	-0.3	-0.2732	-0.8675	1918603	CBDivE_009321	Clc1ccc2ncnc3-c4ccccc4C(=O)c1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C02	compound treatment	1.269	0.0139	0.19	1.479	0.0197	0.27	0.3226	0.9844	1918604	CBDivE_009322	Cc1ccc(o1)C(=O)/C=C/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C03	compound treatment	1.387	0.132	1.78	1.478	0.0187	0.26	1.4386	0.8003	1918605	CBDivE_009323	O=C(Cc1ccccc1)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C04	compound treatment	1.245	-0.0101	-0.14	1.446	-0.0133	-0.18	-0.2246	-0.9902	1918606	CBDivE_009324	O=Cc1c[nH]c2c1ccc3c4[nH]cc(C=O)c4ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C05	compound treatment	1.287	0.0319	0.43	1.531	0.0717	0.98	0.9957	0.932	1138595	CBDivE_009325	COc1ccc(NC(=O)Oc2cc(cc(c2)C(C)(C)C)C(C)(C)C)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C06	compound treatment	1.246	-0.00911	-0.12	1.508	0.0487	0.66	0.3828	0.5667	1918607	CBDivE_009326	COc1ccc(NC(=O)Oc2c(Br)cc(cc2C(C)(C)C)C(C)(C)C)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C07	compound treatment	1.322	0.0669	0.9	1.457	-0.00229	-0.03	0.616	0.6822	1653393	CBDivE_009327	Cc1nc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C08	compound treatment	1.235	-0.0201	-0.27	1.461	0.00171	0.02	-0.1753	-0.6439	1918608	CBDivE_009328	CC(=O)CC(C)(C)S(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C09	compound treatment	1.297	0.0419	0.57	1.512	0.0527	0.72	0.9079	0.9929	1918609	CBDivE_009329	O=C(N/N=C/1\C(=O)Nc2ccccc12)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C10	compound treatment	1.321	0.0659	0.89	1.515	0.0557	0.76	1.1657	0.9969	1918610	CBDivE_009330	Nc1nc(N)nc(n1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C11	compound treatment	1.334	0.0789	1.06	1.424	-0.0353	-0.48	0.4123	0.353	1918611	CBDivE_009331	C/C(=N/NC(=S)N)/CS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C12	compound treatment	1.261	0.00589	0.08	1.447	-0.0123	-0.17	-0.0623	-0.3359	1918612	CBDivE_009332	Clc1cccc(c1)N2CCc3c2nc4ccccc4c3NC(=O)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C13	compound treatment	1.328	0.0729	0.98	1.5	0.0407	0.56	1.0879	0.9634	1918613	CBDivE_009333	Oc1ccccc1/C=N/NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C14	compound treatment	1.304	0.0489	0.66	1.483	0.0237	0.32	0.695	0.9462	1573123	CBDivE_009334	Clc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C15	compound treatment	1.353	0.0979	1.32	1.495	0.0357	0.49	1.2782	0.9081	1918614	CBDivE_009335	Cc1cc(C)c2nc3N(Cc4ccccc4)CCc3c(N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C16	compound treatment	1.24	-0.0151	-0.2	1.485	0.0257	0.35	0.1038	0.2559	1918615	CBDivE_009336	COc1ccc(cc1)N(C)NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C17	compound treatment	1.298	0.0429	0.58	1.509	0.0497	0.68	0.8885	0.9969	1152191	CBDivE_009337	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C18	compound treatment	1.244	-0.0111	-0.15	1.482	0.0227	0.31	0.113	0.3285	1918616	CBDivE_009338	C/C(=N\NC(=O)c1cc2ccccc2cc1O)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C19	compound treatment	1.253	-0.00211	-0.03	1.513	0.0537	0.73	0.4978	0.6791	1918617	CBDivE_009339	Oc1ccc(Br)cc1/C=N/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	C20	compound treatment	1.232	-0.0231	-0.31	1.454	-0.00529	-0.07	-0.2714	-0.8483	1918618	CBDivE_009340	Brc1ccc(/C=N/N2C(=O)c3ccccc3C2=O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D01	compound treatment	1.241	-0.0141	-0.19	1.402	-0.0573	-0.78	-0.687	-0.8544	1570017	CBDivE_009341	CCC(C)(C)c1ccc(OCC(=O)O)c(c1)C(C)(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D02	compound treatment	1.252	-0.00311	-0.04	1.394	-0.0653	-0.89	-0.6592	-0.7396	1918619	CBDivE_009342	CCOC(=O)c1ccc(/N=C/c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D03	compound treatment	1.108	-0.147	-1.98	1.428	-0.0313	-0.43	-1.705	-0.8399	1918620	CBDivE_009343	CCCCNc1c2C=CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D04	compound treatment	1.225	-0.0301	-0.41	1.425	-0.0343	-0.47	-0.6178	-0.9975	1918621	CBDivE_009344	CCCCNc1c2C(O)CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D05	compound treatment	1.187	-0.0681	-0.92	1.445	-0.0143	-0.19	-0.7875	-0.8384	1918622	CBDivE_009345	Cc1ccccc1N=Nc2ccc(NC(=O)c3ccc(Cl)cc3)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D06	compound treatment	1.308	0.0529	0.71	1.469	0.00971	0.13	0.5982	0.8243	1386759	CBDivE_009346	Clc1ccc(Cn2c3CCCc3c(=N)c4ccccc24)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D07	compound treatment	1.243	-0.0121	-0.16	1.469	0.00971	0.13	-0.0219	-0.104	1918623	CBDivE_009347	COc1ncc(Cc2ccc(C)cc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D08	compound treatment	1.22	-0.0351	-0.47	1.458	-0.00129	-0.02	-0.3473	-0.7328	1918624	CBDivE_009348	CCc1c(C)c(=N)c2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D09	compound treatment	1.232	-0.0231	-0.31	1.417	-0.0423	-0.58	-0.6282	-0.9583	1918625	CBDivE_009349	Cc1cc(C)n(CC(=O)Nc2ccc(cc2)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D10	compound treatment	1.221	-0.0341	-0.46	1.437	-0.0223	-0.3	-0.5403	-0.9797	1918626	CBDivE_009350	Cc1cccc(c1)C(=O)N/N=C/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D11	compound treatment	1.23	-0.0251	-0.34	1.508	0.0487	0.66	0.2302	0.3087	1251821	CBDivE_009351	COc1ccc(NC(=O)c2nccnc2C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D12	compound treatment	1.285	0.0299	0.4	1.483	0.0237	0.32	0.5138	0.994	1918627	CBDivE_009352	CC(C)CC1(CC(C)C)C(=N)N(C)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D13	compound treatment	1.32	0.0649	0.88	1.453	-0.00629	-0.09	0.5584	0.6348	1776964	CBDivE_009353	[O-][N+](=O)c1ccccc1S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D14	compound treatment	1.23	-0.0251	-0.34	1.404	-0.0553	-0.75	-0.7726	-0.9348	1918628	CBDivE_009354	CN1CCCc2c(N)c3cc(Cl)ccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D15	compound treatment	1.228	-0.0271	-0.37	1.486	0.0267	0.36	-0.001	-0.002	1918629	CBDivE_009355	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2[nH]ncc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D16	compound treatment	1.252	-0.00311	-0.04	1.387	-0.0723	-0.99	-0.7267	-0.7365	1146511	CBDivE_009356	Oc1cccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D17	compound treatment	1.216	-0.0391	-0.53	1.414	-0.0453	-0.62	-0.8098	-0.9969	1918630	CBDivE_009357	Brc1ccc(/C=N/NC(=O)c2cccc(I)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D18	compound treatment	1.207	-0.0481	-0.65	1.428	-0.0313	-0.43	-0.7606	-0.9793	1280846	CBDivE_009358	O=C1c2ccccc2-c3nnc-4c(CCc5ccccc54)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D19	compound treatment	1.3	0.0449	0.61	1.493	0.0337	0.46	0.7533	0.9908	1918631	CBDivE_009359	Cc1ccc(cc1)S(=O)(=O)NC2OC(=O)C(=C2Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	D20	compound treatment	1.241	-0.0141	-0.19	1.478	0.0187	0.26	0.0458	0.144	1918632	CBDivE_009360	[O-][N+](=O)c1ccc(/C=N/N2C(=O)c3ccccc3C2=O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E01	compound treatment	1.312	0.0569	0.77	1.45	-0.00929	-0.13	0.4531	0.5825	1918633	CBDivE_009361	COc1ccc(cc1Br)c2nc3cc(/N=C/c4ccc(O)cc4O)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E02	compound treatment	1.267	0.0119	0.16	1.467	0.00771	0.11	0.1878	0.979	1918634	CBDivE_009362	[O-][n+]1ccc(N/N=C/c2ccc(F)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E03	compound treatment	1.267	0.0119	0.16	1.453	-0.00629	-0.09	0.0528	0.2902	1918635	CBDivE_009363	[O-][N+](=O)C(=C1NCCN1)/C(=C(/Cl)\N2CCOCC2)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E04	compound treatment	1.246	-0.00911	-0.12	1.521	0.0617	0.84	0.5081	0.5975	1918636	CBDivE_009364	OCCOC(=O)c1cc(Cl)c(cc1Cl)C(=O)OCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E05	compound treatment	1.298	0.0429	0.58	1.489	0.0297	0.41	0.6956	0.9848	1576944	CBDivE_009365	O=C(CCCN1C(=O)c2ccccc2C1=O)Nc3c4CCCc4nc5CCCCc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E06	compound treatment	1.195	-0.0601	-0.81	1.481	0.0217	0.3	-0.3641	-0.4217	1918637	CBDivE_009366	COc1ccc(cc1)n2c(C)c([N+](=O)[O-])c3ccc(O)c(CN4CCCCC4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E07	compound treatment	1.285	0.0299	0.4	1.556	0.0967	1.32	1.2177	0.883	1174933	CBDivE_009367	O=C(CCN1C(=O)c2ccccc2C1=O)Nc3c4CCCc4nc5CCCCc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E08	compound treatment	1.278	0.0229	0.31	1.498	0.0387	0.53	0.5916	0.9674	1918638	CBDivE_009368	O=C(Cc1c[nH]c2ccccc12)N/N=C/c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E09	compound treatment	1.378	0.123	1.66	1.456	-0.00329	-0.04	1.1406	0.6877	1918639	CBDivE_009369	CN(C)c1cc(/N=C/2\CCCN2Cc3ccccc3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E10	compound treatment	1.28	0.0249	0.34	1.481	0.0217	0.3	0.4468	0.998	1918640	CBDivE_009370	Nc1cc(c2ccccc2c1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E11	compound treatment	1.301	0.0459	0.62	1.495	0.0357	0.49	0.7821	0.9929	1918641	CBDivE_009371	Clc1ccc(cc1Cl)c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E12	compound treatment	1.229	-0.0261	-0.35	1.466	0.00671	0.09	-0.1844	-0.5066	1918642	CBDivE_009372	CC(=O)CC(C)(C)S(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E13	compound treatment	1.272	0.0169	0.23	1.457	-0.00229	-0.03	0.1391	0.6046	1918643	CBDivE_009373	CSc1ncc(F)c(=O)n1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E14	compound treatment	1.232	-0.0231	-0.31	1.449	-0.0103	-0.14	-0.3197	-0.935	1303935	CBDivE_009374	CN1CCc2c1nc3ccccc3c2NC(=O)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E15	compound treatment	1.344	0.0889	1.2	1.453	-0.00629	-0.09	0.7873	0.6549	1918644	CBDivE_009375	CC(C/N=C/c1ccc(Cl)cc1Cl)/N=C/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E16	compound treatment	1.262	0.00689	0.09	1.43	-0.0293	-0.4	-0.2167	-0.5284	1020752	CBDivE_009376	COc1ccc(cc1)c2cc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E17	compound treatment	1.345	0.0899	1.21	1.503	0.0437	0.6	1.279	0.9465	1701299	CBDivE_009377	CC(=O)Nc1cc2OCCOc2cc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E18	compound treatment	1.258	0.00289	0.04	1.468	0.00871	0.12	0.1116	0.8924	1918645	CBDivE_009378	CCCCCC1C(O)CCC1CC(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E19	compound treatment	1.338	0.0829	1.12	1.523	0.0637	0.87	1.4051	0.9922	1302516	CBDivE_009379	O=C(NN1C(=O)CCC1=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	E20	compound treatment	1.311	0.0559	0.75	1.495	0.0357	0.49	0.8775	0.9776	1300936	CBDivE_009380	Cc1ccc2nc3N(Cc4ccccc4)CCc3c(N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F01	compound treatment	1.202	-0.0531	-0.72	1.385	-0.0743	-1.01	-1.223	-0.9856	3017585	CBDivE_009381	CN1CCc2c1nc3CCCc3c2N.OC(=O)c1cncc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F02	compound treatment	1.206	-0.0491	-0.66	1.415	-0.0443	-0.6	-0.8955	-0.9989	1918646	CBDivE_009382	[O-][N+](=O)c1ccc(/C=N/c2cccc3ccccc23)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F03	compound treatment	1.195	-0.0601	-0.81	1.42	-0.0393	-0.54	-0.9522	-0.9798	1918647	CBDivE_009383	Cc1c(C)c2cc(ccc2n1Cc3ccccc3)C(=O)Nc4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F04	compound treatment	1.232	-0.0231	-0.31	1.387	-0.0723	-0.99	-0.9175	-0.8874	1325559	CBDivE_009384	Clc1cc(Cl)cc(c1)C(=O)N2CCN(CC2)C(=O)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F05	compound treatment	1.261	0.00589	0.08	1.495	0.0357	0.49	0.4005	0.8118	1918648	CBDivE_009385	O=C(C1CC(=O)OC1c2ccccc2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F06	compound treatment	1.225	-0.0301	-0.41	1.432	-0.0273	-0.37	-0.5504	-0.999	1583570	CBDivE_009386	CCCCN1CCc2c1nc3ccc(Br)cc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F07	compound treatment	1.257	0.00189	0.03	1.41	-0.0493	-0.67	-0.4572	-0.6798	1918649	CBDivE_009387	Cc1c(oc2cc(O)ccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F08	compound treatment	1.275	0.0199	0.27	1.487	0.0277	0.38	0.4569	0.9859	1918650	CBDivE_009388	O=S(=O)(NCCCc1ccccc1)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F09	compound treatment	1.182	-0.0731	-0.99	1.457	-0.00229	-0.03	-0.7195	-0.7291	1918651	CBDivE_009389	C/C(=N\NC(=O)c1cccc(Br)c1)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F10	compound treatment	1.236	-0.0191	-0.26	1.476	0.0167	0.23	-0.0212	-0.0615	1918652	CBDivE_009390	Cc1cccnc1/N=C/c2cccc(CC=C)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F11	compound treatment	1.207	-0.0481	-0.65	1.501	0.0417	0.57	-0.0567	-0.0657	1918653	CBDivE_009391	CCN(CC)c1ccc(/C=N\NC(=O)c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F12	compound treatment	1.127	-0.128	-1.73	1.427	-0.0323	-0.44	-1.5334	-0.8598	1348944	CBDivE_009392	CC1(C)Cc2nc3ccccc3c(N)c2C=C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F13	compound treatment	1.218	-0.0371	-0.5	1.487	0.0277	0.38	-0.0868	-0.1384	1918654	CBDivE_009393	CC(C)(C)N1C(=O)N(C(=O)C1=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F14	compound treatment	1.227	-0.0281	-0.38	1.45	-0.00929	-0.13	-0.3577	-0.8947	1918655	CBDivE_009394	O/N=C\1/NC(Nc2ccccc12)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F15	compound treatment	1.25	-0.00511	-0.07	1.481	0.0217	0.3	0.1606	0.5283	1918656	CBDivE_009395	[O-][N+](=O)c1cn[nH]c1C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F16	compound treatment	1.207	-0.0481	-0.65	1.457	-0.00229	-0.03	-0.481	-0.7402	1918657	CBDivE_009396	CN(C)/C=C/C=C/C=C/C(=O)c1ccc(C)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F17	compound treatment	1.196	-0.0591	-0.8	1.491	0.0317	0.43	-0.2581	-0.2845	1554243	CBDivE_009397	Nc1c2CCN(C3CCCCC3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F18	compound treatment	1.257	0.00189	0.03	1.477	0.0177	0.24	0.1888	0.7774	1918658	CBDivE_009398	COc1ccc(cc1Br)c2nc3cc(/N=C/c4ccc(OC(=O)c5ccc(Cl)cc5)c(OC)c4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F19	compound treatment	1.189	-0.0661	-0.89	1.508	0.0487	0.66	-0.1609	-0.1447	1918659	CBDivE_009399	CC(=O)CCS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	F20	compound treatment	1.183	-0.0721	-0.97	1.404	-0.0553	-0.75	-1.221	-0.9921	1258069	CBDivE_009400	CCC(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G01	compound treatment	1.216	-0.0391	-0.53	1.424	-0.0353	-0.48	-0.7133	-0.9989	1775737	CBDivE_009401	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ncc(s2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G02	compound treatment	1.203	-0.0521	-0.7	1.434	-0.0253	-0.34	-0.7409	-0.9463	3106757	CBDivE_009402	Nc1c2CCCCc2nc3ccccc13.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G03	compound treatment	1.367	0.112	1.51	1.508	0.0487	0.66	1.5371	0.932	1918660	CBDivE_009403	CC(=O)O/N=C(\CCc1ccccc1)/C2(CCCCC2)OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G04	compound treatment	1.279	0.0239	0.32	1.439	-0.0203	-0.28	0.0323	0.076	1143344	CBDivE_009404	CCOC(=O)Cn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G05	compound treatment	1.27	0.0149	0.2	1.453	-0.00629	-0.09	0.0814	0.3727	1147463	CBDivE_009405	CCc1cc2c(=O)c(coc2cc1OC(=O)c3ccc(OC)cc3)c4nc(C)cs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G06	compound treatment	1.285	0.0299	0.4	1.427	-0.0323	-0.44	-0.0262	-0.0439	1918661	CBDivE_009406	CC(=O)CCS(=O)(=O)c1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G07	compound treatment	1.3	0.0449	0.61	1.497	0.0377	0.51	0.7919	0.9967	1582297	CBDivE_009407	O=S(=O)(Nc1nc2ccccc2s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G08	compound treatment	1.257	0.00189	0.03	1.489	0.0297	0.41	0.3045	0.7501	1303688	CBDivE_009408	Oc1c(Br)cc(Br)cc1C(=O)Nc2cc(Cl)ccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G09	compound treatment	1.271	0.0159	0.21	1.52	0.0607	0.83	0.737	0.8618	1918662	CBDivE_009409	Cc1[nH]c2ccc(cc2c1c3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G10	compound treatment	1.248	-0.00711	-0.1	1.509	0.0497	0.68	0.4115	0.6011	1918663	CBDivE_009410	CCc1nc2ccccc2c(NC(=O)CNC(C)C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G11	compound treatment	1.352	0.0969	1.31	1.496	0.0367	0.5	1.2783	0.9132	1110623	CBDivE_009411	COc1ccc(NC(=O)C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G12	compound treatment	1.199	-0.0561	-0.76	1.49	0.0307	0.42	-0.2391	-0.2764	1918664	CBDivE_009412	Cc1nc(cs1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G13	compound treatment	1.291	0.0359	0.48	1.437	-0.0223	-0.3	0.1275	0.223	1918665	CBDivE_009413	Oc1c(Br)cc(/C=N/c2ccc3[nH]c(=O)[nH]c3c2)c(O)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G14	compound treatment	1.249	-0.00611	-0.08	1.469	0.00971	0.13	0.0354	0.2267	1531300	CBDivE_009414	CC1(C)CC(=O)c2c(N)c3cc(Br)ccc3nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G15	compound treatment	1.266	0.0109	0.15	1.572	0.113	1.54	1.1907	0.7712	1918666	CBDivE_009415	Fc1ccccc1OC(=O)CCCC(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G16	compound treatment	1.249	-0.00611	-0.08	1.512	0.0527	0.72	0.45	0.6219	1918667	CBDivE_009416	C/C(=N\OCO\N=C(\C)/c1ccc(Br)cc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G17	compound treatment	1.323	0.0679	0.92	1.531	0.0717	0.98	1.3391	0.9995	1918668	CBDivE_009417	Cc1ccc(cc1)S(=O)(=O)Nc2cc(c3ncnc4-c5ccccc5C(=O)c2c43)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G18	compound treatment	1.251	-0.00411	-0.06	1.454	-0.00529	-0.07	-0.0902	-0.9916	1386116	CBDivE_009418	CCCn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G19	compound treatment	1.342	0.0869	1.17	1.481	0.0217	0.3	1.0382	0.8587	1918669	CBDivE_009419	O1c2ccccc2C(c3ccccc13)n4nnc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	G20	compound treatment	1.271	0.0159	0.21	1.441	-0.0183	-0.25	-0.0248	-0.0753	1918670	CBDivE_009420	c1c(nn(c1n2c(nc3ccccc23)c4ccccc4)c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H01	compound treatment	1.214	-0.0411	-0.55	1.333	-0.126	-1.72	-1.6099	-0.8898	1405925	CBDivE_009421	CC1CC(C)(C)N(N1C(=S)Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H02	compound treatment	1.22	-0.0351	-0.47	1.451	-0.00829	-0.11	-0.4148	-0.8519	1918671	CBDivE_009422	FC(F)(F)c1c(Nc2ccc(I)cc2)c3ccccc3nc1C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H03	compound treatment	1.262	0.00689	0.09	1.399	-0.0603	-0.82	-0.5156	-0.6232	1918672	CBDivE_009423	Oc1ccc(Br)cc1/C=N/NC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H04	compound treatment	1.267	0.0119	0.16	1.403	-0.0563	-0.77	-0.4293	-0.5475	1918673	CBDivE_009424	CC1=CC(C)(C)NC(=S)N1c2ccc(Br)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H05	compound treatment	1.183	-0.0721	-0.97	1.435	-0.0243	-0.33	-0.9221	-0.8973	1918674	CBDivE_009425	CN1CCc2c1nc3ccccc3c2NC(=O)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H06	compound treatment	1.246	-0.00911	-0.12	1.427	-0.0323	-0.44	-0.3982	-0.8712	1918675	CBDivE_009426	CCCCCCn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H07	compound treatment	1.231	-0.0241	-0.33	1.448	-0.0113	-0.15	-0.3388	-0.9416	1437437	CBDivE_009427	COc1ccc2c(C)c(oc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H08	compound treatment	1.227	-0.0281	-0.38	1.434	-0.0253	-0.34	-0.512	-0.9989	1918676	CBDivE_009428	Ic1ccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H09	compound treatment	1.19	-0.0651	-0.88	1.428	-0.0313	-0.43	-0.9228	-0.945	1918677	CBDivE_009429	CC(=O)NC(CC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H10	compound treatment	1.266	0.0109	0.15	1.484	0.0247	0.34	0.3422	0.9308	1918678	CBDivE_009430	CN(Cc1ccccc1)C(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H11	compound treatment	1.357	0.102	1.37	1.412	-0.0473	-0.64	0.516	0.3398	1918679	CBDivE_009431	OC(=O)c1nccnc1C(=O)Nc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H12	compound treatment	1.266	0.0109	0.15	1.441	-0.0183	-0.25	-0.0725	-0.2503	1918680	CBDivE_009432	CN(C)c1cc(/N=C/2\CCCN2C)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H13	compound treatment	1.279	0.0239	0.32	1.537	0.0777	1.06	0.9772	0.8823	1918681	CBDivE_009433	OC(=O)c1cn(nc1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H14	compound treatment	1.251	-0.00411	-0.06	1.504	0.0447	0.61	0.3919	0.6402	1918682	CBDivE_009434	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Oc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H15	compound treatment	1.229	-0.0261	-0.35	1.424	-0.0353	-0.48	-0.5893	-0.9882	1918683	CBDivE_009435	C/C(=N\NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H16	compound treatment	1.187	-0.0681	-0.92	1.484	0.0247	0.34	-0.4114	-0.4204	1918684	CBDivE_009436	CN(C)/C=C/C=C/1\CC/C(=C\C=C\N(C)C)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H17	compound treatment	1.214	-0.0411	-0.55	1.489	0.0297	0.41	-0.1057	-0.1538	1918685	CBDivE_009437	FC(F)(F)C(Oc1nc(NCC=C)nc(n1)N2CCOCC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H18	compound treatment	1.3	0.0449	0.61	1.378	-0.0813	-1.11	-0.3556	-0.2815	1413204	CBDivE_009438	CCOc1ccc(cc1)C(=O)COC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H19	compound treatment	1.249	-0.00611	-0.08	1.486	0.0267	0.36	0.1993	0.5336	1020823	CBDivE_009439	O=C1NC(=O)C(C(=O)N1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	H20	compound treatment	1.224	-0.0311	-0.42	1.429	-0.0303	-0.41	-0.5888	-1.0	1413988	CBDivE_009440	CN(C(=O)CN1C(=O)c2ccccc2C1=O)C3(CCCCC3)C(=O)Nc4c(C)cccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I01	compound treatment	1.262	0.00689	0.09	1.431	-0.0283	-0.39	-0.207	-0.5218	1918686	CBDivE_009441	O=C(CCCCC(=O)NNC(=O)C1CC21CCC2)NNC(=O)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I02	compound treatment	1.219	-0.0361	-0.49	1.442	-0.0173	-0.24	-0.5112	-0.9445	1918687	CBDivE_009442	OC(CC=C)(CC=C)C1=CC(CC=C)NC(CC=C)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I03	compound treatment	1.299	0.0439	0.59	1.52	0.0607	0.83	1.0041	0.9865	1918688	CBDivE_009443	COc1cc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I04	compound treatment	1.199	-0.0561	-0.76	1.447	-0.0123	-0.17	-0.6537	-0.8432	1178633	CBDivE_009444	O=C1c2ccccc2-c3ncnc4ccc(NC5CCCCC5)c1c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I05	compound treatment	1.285	0.0299	0.4	1.502	0.0427	0.58	0.697	0.9839	1918689	CBDivE_009445	Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I06	compound treatment	1.216	-0.0391	-0.53	1.468	0.00871	0.12	-0.2891	-0.5345	1388347	CBDivE_009446	CC1(C)CC(=O)c2c(N)c3ccccc3nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I07	compound treatment	1.291	0.0359	0.48	1.491	0.0317	0.43	0.6481	0.9984	1918690	CBDivE_009447	Nc1nc(N)nc(n1)c2ccc(cc2)c3nc(N)nc(N)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I08	compound treatment	1.271	0.0159	0.21	1.51	0.0507	0.69	0.6406	0.8848	1918691	CBDivE_009448	Clc1ccc(/C=N/NC(=S)NC2c3ccccc3Oc4ccccc24)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I09	compound treatment	1.273	0.0179	0.24	1.481	0.0217	0.3	0.38	0.9949	1525075	CBDivE_009449	O=C(CC(CN1C(=O)c2ccccc2C1=O)c3ccccc3)Nc4c5CCCc5nc6CCCCc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I10	compound treatment	1.279	0.0239	0.32	1.503	0.0437	0.6	0.6494	0.9583	1918692	CBDivE_009450	CC(=O)CCS(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I11	compound treatment	1.369	0.114	1.54	1.519	0.0597	0.81	1.6622	0.9559	1088101	CBDivE_009451	CC(=O)Oc1c(I)cc(I)cc1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I12	compound treatment	1.191	-0.0641	-0.86	1.525	0.0657	0.9	0.0221	0.0177	1918693	CBDivE_009452	CC(=O)CC(C)(C)S(=O)(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I13	compound treatment	1.325	0.0699	0.94	1.486	0.0267	0.36	0.9243	0.9144	1228982	CBDivE_009453	Nc1c2CCN(Cc3ccccc3)c2nc4ccc(Br)cc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I14	compound treatment	1.289	0.0339	0.46	1.462	0.00271	0.04	0.3494	0.7618	1918694	CBDivE_009454	C/C(=N\OCO\N=C(\C)/c1ccc(Cl)cc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I15	compound treatment	1.325	0.0699	0.94	1.517	0.0577	0.79	1.2232	0.996	1918695	CBDivE_009455	CSc1ccc(OC(=O)NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I16	compound treatment	1.292	0.0369	0.5	1.461	0.00171	0.02	0.3684	0.7395	1918696	CBDivE_009456	C[C@H](NC(=O)c1ccccc1)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I17	compound treatment	1.33	0.0749	1.01	1.512	0.0527	0.72	1.2227	0.9861	1918697	CBDivE_009457	Oc1cc(c2ncnc3-c4ccccc4C(=O)c1c32)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I18	compound treatment	1.244	-0.0111	-0.15	1.546	0.0867	1.18	0.7301	0.6126	1776764	CBDivE_009458	CC(C)OC(=O)c1ccccc1C(=O)c2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I19	compound treatment	1.327	0.0719	0.97	1.442	-0.0173	-0.24	0.5191	0.5201	1619688	CBDivE_009459	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2sc3ccccc3c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	I20	compound treatment	1.268	0.0129	0.17	1.491	0.0317	0.43	0.4287	0.9199	1918698	CBDivE_009460	Brc1ccc(cc1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J01	compound treatment	1.204	-0.0511	-0.69	1.428	-0.0313	-0.43	-0.7892	-0.9734	1918699	CBDivE_009461	COc1ccc(/N=C/C=N/c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J02	compound treatment	1.222	-0.0331	-0.45	1.46	7.12E-4	0.01	-0.309	-0.6916	1918700	CBDivE_009462	Nc1cc(n[nH]1)c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J03	compound treatment	1.168	-0.0871	-1.18	1.384	-0.0753	-1.03	-1.5569	-0.9977	1605977	CBDivE_009463	CC(C)(C)c1cc(OC(=O)NC(=O)c2ccccc2)cc(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J04	compound treatment	1.218	-0.0371	-0.5	1.467	0.00771	0.11	-0.2796	-0.5466	1918701	CBDivE_009464	Nc1nc(N)nc(n1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J05	compound treatment	1.227	-0.0281	-0.38	1.48	0.0207	0.28	-0.0684	-0.1447	1552467	CBDivE_009465	Oc1c(Br)cc(Cl)cc1C(=O)Nc2ccc(Cl)c(c2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J06	compound treatment	1.224	-0.0311	-0.42	1.41	-0.0493	-0.67	-0.772	-0.9743	1918702	CBDivE_009466	CCCCCC(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J07	compound treatment	1.257	0.00189	0.03	1.438	-0.0213	-0.29	-0.1872	-0.6425	1914371	CBDivE_009467	Cc1cc(CSC(=N)N)c(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J08	compound treatment	1.266	0.0109	0.15	1.454	-0.00529	-0.07	0.0529	0.3232	1224904	CBDivE_009468	CN1CCN(CC1)C(=O)N2c3ccccc3C=Cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J09	compound treatment	1.218	-0.0371	-0.5	1.464	0.00471	0.06	-0.3086	-0.6113	1918703	CBDivE_009469	CC(=O)OC(C/C(=N/O)/c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J10	compound treatment	1.215	-0.0401	-0.54	1.468	0.00871	0.12	-0.2986	-0.539	1269647	CBDivE_009470	CN1C2CCC1CC(C2)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J11	compound treatment	1.248	-0.00711	-0.1	1.446	-0.0133	-0.18	-0.196	-0.9558	1918704	CBDivE_009471	COc1ccc(Cc2n[nH]c(=O)c3c(=O)[nH]c(C)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J12	compound treatment	1.241	-0.0141	-0.19	1.468	0.00871	0.12	-0.0506	-0.2255	1670129	CBDivE_009472	CCCC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J13	compound treatment	1.283	0.0279	0.38	1.423	-0.0363	-0.49	-0.0839	-0.1349	1918705	CBDivE_009473	N(/N=C\c1ccccc1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J14	compound treatment	1.225	-0.0301	-0.41	1.378	-0.0813	-1.11	-1.071	-0.9072	1918706	CBDivE_009474	O=C1N(C2c3ccccc3Oc4ccccc24)c5ccccc5C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J15	compound treatment	1.219	-0.0361	-0.49	1.485	0.0257	0.35	-0.0965	-0.1608	1918707	CBDivE_009475	Cn1cc([N+](=O)[O-])c(n1)C(=O)n2cccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J16	compound treatment	1.171	-0.0841	-1.13	1.462	0.00271	0.04	-0.7762	-0.6837	1918708	CBDivE_009476	CCO/C(=C\N(C)C)/C=C/1\CC/C(=C\C(=C\N(C)C)\OCC)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J17	compound treatment	1.206	-0.0491	-0.66	1.492	0.0327	0.45	-0.1531	-0.1916	1303898	CBDivE_009477	CC1=NN(C(=O)C1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J18	compound treatment	1.162	-0.0931	-1.26	1.427	-0.0323	-0.44	-1.1995	-0.9012	1918709	CBDivE_009478	Oc1cc(Cl)c(Cl)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J19	compound treatment	1.22	-0.0351	-0.47	1.532	0.0727	0.99	0.3662	0.3333	1049760	CBDivE_009479	[O-][N+](=O)c1ccc2[nH]c3CCCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	J20	compound treatment	1.253	-0.00211	-0.03	1.497	0.0377	0.51	0.3435	0.667	1553864	CBDivE_009480	Cc1cccc(C)c1NC(=O)C(NC(=O)CN2C(=O)c3ccccc3C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K01	compound treatment	1.299	0.0439	0.59	1.44	-0.0193	-0.26	0.2327	0.3592	1122354	CBDivE_009481	Brc1ccc(cc1)C(=O)Nc2cc3OCCOc3cc2C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K02	compound treatment	1.264	0.00889	0.12	1.453	-0.00629	-0.09	0.0242	0.1639	1283463	CBDivE_009482	Clc1ccccc1C(=O)c2cc3OCCOc3cc2NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K03	compound treatment	1.267	0.0119	0.16	1.501	0.0417	0.57	0.5156	0.8725	1918710	CBDivE_009483	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3ccc(OC)cc23)C1c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K04	compound treatment	1.23	-0.0251	-0.34	1.425	-0.0343	-0.47	-0.5702	-0.9875	1510122	CBDivE_009484	CN1CCc2c1nc3ccccc3c2NC(=O)CCc4cc(c(O)c(c4)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K05	compound treatment	1.307	0.0519	0.7	1.473	0.0137	0.19	0.6272	0.8656	1918711	CBDivE_009485	Nc1c(cc2[nH]nc3-c4ccccc4C(=O)c1c32)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K06	compound treatment	1.237	-0.0181	-0.24	1.466	0.00671	0.09	-0.108	-0.4141	1918712	CBDivE_009486	CCCCN1C(=N)C(CC)(CC)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K07	compound treatment	1.291	0.0359	0.48	1.471	0.0117	0.16	0.4553	0.893	1431749	CBDivE_009487	COc1ccc(cc1N)S(=O)(=O)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K08	compound treatment	1.26	0.00489	0.07	1.487	0.0277	0.38	0.3139	0.8182	1918713	CBDivE_009488	CC(=O)CCS(=O)(=O)c1ccc(C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K09	compound treatment	1.259	0.00389	0.05	1.464	0.00471	0.06	0.0825	0.995	1918714	CBDivE_009489	CCCCNc1c2C(=O)CC(C)(C)Cc2nc3c(C)cc(C)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K10	compound treatment	1.278	0.0229	0.31	1.485	0.0257	0.35	0.4663	0.998	1918715	CBDivE_009490	Cc1cccc(NC(=O)Oc2c(C)cc(Br)cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K11	compound treatment	1.316	0.0609	0.82	1.454	-0.00529	-0.07	0.5299	0.6426	1918716	CBDivE_009491	CCCCNc1c2C(=O)CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K12	compound treatment	1.235	-0.0201	-0.27	1.428	-0.0313	-0.43	-0.4935	-0.9761	1381975	CBDivE_009492	CC(C)(C)C1CCC(CC1)OC(=O)CCCC(=O)Oc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K13	compound treatment	1.286	0.0309	0.42	1.502	0.0427	0.58	0.7065	0.9865	1918717	CBDivE_009493	Clc1ccc(/C=N/NC(=O)C(NC(=O)c2ccccc2)c3n[nH]c(=O)c4ccccc34)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K14	compound treatment	1.214	-0.0411	-0.55	1.478	0.0187	0.26	-0.2117	-0.3468	1918718	CBDivE_009494	C/C(=N\OCO\N=C(\C)/c1cccc(c1)[N+](=O)[O-])/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K15	compound treatment	1.332	0.0769	1.04	1.505	0.0457	0.62	1.1743	0.9703	1918719	CBDivE_009495	O=C(Cc1ccccc1)Nc2c3CCCc3nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K16	compound treatment	1.28	0.0249	0.34	1.5	0.0407	0.56	0.63	0.971	1918720	CBDivE_009496	Brc1ccc(cc1)C/2/C(=N\Nc3ccccc3)/c4ccccc4\C2=N\Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K17	compound treatment	1.284	0.0289	0.39	1.456	-0.00329	-0.04	0.2439	0.6217	1918721	CBDivE_009497	CN1CCN(CCC(=O)N/N=C/c2ccncc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K18	compound treatment	1.259	0.00389	0.05	1.45	-0.00929	-0.13	-0.0525	-0.3826	1918722	CBDivE_009498	COc1ccc(NC(=O)Oc2c(Br)cc(C)cc2Br)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K19	compound treatment	1.317	0.0619	0.83	1.564	0.105	1.43	1.6001	0.9673	1918723	CBDivE_009499	O=C1CC2=CC=CC=3=CC=CC1=C32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	K20	compound treatment	1.283	0.0279	0.38	1.538	0.0787	1.07	1.025	0.9012	1918724	CBDivE_009500	C/C(=N\NC(=O)c1cccc(C)c1)/c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L01	compound treatment	1.213	-0.0421	-0.57	1.424	-0.0353	-0.48	-0.742	-0.9966	1918725	CBDivE_009501	CCOC(=O)CN1C(=O)c2ccc(cc2C1=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L02	compound treatment	1.214	-0.0411	-0.55	1.364	-0.0953	-1.3	-1.311	-0.9279	1918726	CBDivE_009502	Cc1c(C)c2cc(ccc2n1Cc3ccccc3)C(=O)Nc4ccc(OCc5ccccc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L03	compound treatment	1.242	-0.0131	-0.18	1.414	-0.0453	-0.62	-0.5617	-0.8745	1918727	CBDivE_009503	CCOC(=O)C1=C(OC2(O)c3ccccc3C(=O)C12O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L04	compound treatment	1.206	-0.0491	-0.66	1.397	-0.0623	-0.85	-1.0691	-0.9924	1477444	CBDivE_009504	COc1ccc2nc(c3ccco3)c(nc2c1)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L05	compound treatment	1.137	-0.118	-1.59	1.48	0.0207	0.28	-0.927	-0.5728	1918728	CBDivE_009505	Fc1cccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L06	compound treatment	1.254	-0.00111	-0.01	1.405	-0.0543	-0.74	-0.5341	-0.7213	1918729	CBDivE_009506	Cc1cc(C2N(C=Cc3ccccc23)C(=O)c4ccccc4)c(C)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L07	compound treatment	1.204	-0.0511	-0.69	1.466	0.00671	0.09	-0.4228	-0.6079	1918730	CBDivE_009507	CC1(C(C(c2ccccc2)C3(C)c4ccccc41)[N+](=O)[O-])c5ccccc53
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L08	compound treatment	1.196	-0.0591	-0.8	1.468	0.00871	0.12	-0.4799	-0.5952	1918731	CBDivE_009508	CCCCC1(CCCC)C(=N)N(C)C(=O)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L09	compound treatment	1.245	-0.0101	-0.14	1.484	0.0247	0.34	0.1418	0.3902	1918732	CBDivE_009509	[O-][N+](=O)c1cccc(/C=N/C(=N\NC(=O)c2ccccc2)/c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L10	compound treatment	1.232	-0.0231	-0.31	1.421	-0.0383	-0.52	-0.5896	-0.9696	1918733	CBDivE_009510	CCC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L11	compound treatment	1.227	-0.0281	-0.38	1.412	-0.0473	-0.64	-0.7241	-0.968	1918734	CBDivE_009511	Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L12	compound treatment	1.224	-0.0311	-0.42	1.411	-0.0483	-0.66	-0.7624	-0.9763	1918735	CBDivE_009512	CN(C)c1cc(/N=C/2\CCCCN2C)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L13	compound treatment	1.274	0.0189	0.25	1.429	-0.0303	-0.41	-0.1119	-0.2305	1918736	CBDivE_009513	Oc1ccc(/C=N\Nc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L14	compound treatment	1.249	-0.00611	-0.08	1.421	-0.0383	-0.52	-0.4275	-0.8087	1918737	CBDivE_009514	CC(=O)CS(=O)(=O)c1ccc(cc1)c2ccc(cc2)S(=O)(=O)CC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L15	compound treatment	1.262	0.00689	0.09	1.389	-0.0703	-0.96	-0.612	-0.6355	1918738	CBDivE_009515	O=C1N(Cn2cnc3ccccc23)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L16	compound treatment	1.215	-0.0401	-0.54	1.459	-2.88E-4	0.0	-0.3854	-0.7122	1197960	CBDivE_009516	COC(=O)c1cccc(OC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L17	compound treatment	1.258	0.00289	0.04	1.502	0.0427	0.58	0.4394	0.7528	1918739	CBDivE_009517	FC(F)Oc1ccccc1NC(=O)NC(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L18	compound treatment	1.209	-0.0461	-0.62	1.413	-0.0463	-0.63	-0.8862	-1.0	1918740	CBDivE_009518	Fc1ccc(cc1)C(=O)Oc2ccc(/C=N/c3ccc4oc(nc4c3)c5ccc6ccccc6c5)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L19	compound treatment	1.255	-1.1E-4	0.0	1.538	0.0787	1.07	0.7579	0.7061	1918741	CBDivE_009519	Cn1cc(C=O)c2cc(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	L20	compound treatment	1.194	-0.0611	-0.82	1.493	0.0337	0.46	-0.2579	-0.2732	1135769	CBDivE_009520	CN(C(C(=O)Nc1c(C)cccc1C)c2ccc(Cl)cc2)C(=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M01	compound treatment	1.291	0.0359	0.48	1.521	0.0617	0.84	0.9374	0.9655	1117765	CBDivE_009521	CC(=O)Nc1ccc(NCN2C(=O)CCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M02	compound treatment	1.188	-0.0671	-0.91	1.457	-0.00229	-0.03	-0.6622	-0.731	1918742	CBDivE_009522	Clc1ccc(OCC(=O)Nc2ccc(Cc3ccc(NC(=O)COc4ccc(Cl)cc4Cl)cc3)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M03	compound treatment	1.278	0.0229	0.31	1.476	0.0167	0.23	0.3795	0.9888	1724539	CBDivE_009523	OC(C(=O)N1CCOCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M04	compound treatment	1.224	-0.0311	-0.42	1.464	0.00471	0.06	-0.2513	-0.592	1918743	CBDivE_009524	CC1CC(O)(C#CC=C)C(C)C(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M05	compound treatment	1.369	0.114	1.54	1.46	7.12E-4	0.01	1.0933	0.7116	1269343	CBDivE_009525	CC(CC(=O)c1ccccc1)CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M06	compound treatment	1.227	-0.0281	-0.38	1.491	0.0317	0.43	0.0376	0.0654	1141389	CBDivE_009526	Brc1ccccc1C(=O)c2cc3OCCOc3cc2NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M07	compound treatment	1.315	0.0599	0.81	1.477	0.0177	0.24	0.7421	0.88	3017085	CBDivE_009527	CN(C)c1cc(N)c2ccccc2n1.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M08	compound treatment	1.244	-0.0111	-0.15	1.428	-0.0313	-0.43	-0.4077	-0.9015	3106821	CBDivE_009528	CN(C)c1cc(N)c2ccccc2n1.OC(=O)c1cncc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M09	compound treatment	1.308	0.0529	0.71	1.503	0.0437	0.6	0.926	0.996	1918744	CBDivE_009529	OC(=O)c1ccc2C(=O)NC(=O)c3ccc(c4ccc5C(=O)NC(=O)c6ccc(C(=O)O)c4c65)c1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M10	compound treatment	1.249	-0.00611	-0.08	1.485	0.0257	0.35	0.1896	0.5265	1918745	CBDivE_009530	Cc1ccc2nc3CC(C)(C)CC(=O)c3c(N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M11	compound treatment	1.293	0.0379	0.51	1.45	-0.00929	-0.13	0.2719	0.5163	1918746	CBDivE_009531	CC(=O)CS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M12	compound treatment	1.248	-0.00711	-0.1	1.438	-0.0213	-0.29	-0.2731	-0.8932	1918747	CBDivE_009532	Cc1cccc(NC(=O)C2CC(=O)OC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M13	compound treatment	1.271	0.0159	0.21	1.514	0.0547	0.75	0.6791	0.8749	1918748	CBDivE_009533	C1C2CC3CC1CC(C2)(C3)c4nc5ccccc5s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M14	compound treatment	1.26	0.00489	0.07	1.444	-0.0153	-0.21	-0.1008	-0.4608	1918749	CBDivE_009534	CC(C)(C)Cc1ccc(OCCCC(=O)Nc2ccc(Cl)c(N)c2)c(CC(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M15	compound treatment	1.325	0.0699	0.94	1.452	-0.00729	-0.1	0.5964	0.6291	1918750	CBDivE_009535	Brc1ccc(cc1)C(=O)N/N=C/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M16	compound treatment	1.221	-0.0341	-0.46	1.47	0.0107	0.15	-0.2221	-0.46	1159078	CBDivE_009536	COc1cccc(C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M17	compound treatment	1.357	0.102	1.37	1.506	0.0467	0.64	1.4224	0.9389	1359955	CBDivE_009537	CCOC(=O)c1cnc2c3nsnc3ccc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M18	compound treatment	1.259	0.00389	0.05	1.494	0.0347	0.47	0.3718	0.7807	1404128	CBDivE_009538	CN1CCN(CC1)C(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M19	compound treatment	1.34	0.0849	1.15	1.555	0.0957	1.31	1.7327	0.9979	1544631	CBDivE_009539	CCCC(CCC)C(=O)Nc1c2CCCc2nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	M20	compound treatment	1.257	0.00189	0.03	1.516	0.0567	0.77	0.5649	0.73	1314691	CBDivE_009540	CN1CCc2c1nc3ccc(Br)cc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N01	compound treatment	1.21	-0.0451	-0.61	1.381	-0.0783	-1.07	-1.1852	-0.9645	1013083	CBDivE_009541	Clc1nc(nc(n1)N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N02	compound treatment	1.18	-0.0751	-1.01	1.398	-0.0613	-0.84	-1.3075	-0.9954	1918751	CBDivE_009542	CCOc1ccc(cc1)C(=O)COC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N03	compound treatment	1.238	-0.0171	-0.23	1.398	-0.0613	-0.84	-0.7542	-0.8698	1918752	CBDivE_009543	CC(C)(c1ccc(Oc2ccc(NC(=O)c3ccccc3)cc2)cc1)c4ccc(Oc5ccc(NC(=O)c6ccccc6)cc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N04	compound treatment	1.206	-0.0491	-0.66	1.34	-0.119	-1.63	-1.6187	-0.9216	1918753	CBDivE_009544	CCOc1ccc(cc1)C(=O)COC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N05	compound treatment	1.279	0.0239	0.32	1.436	-0.0233	-0.32	0.0033	0.0074	1918754	CBDivE_009545	CC(=O)c1ccc(NC(=O)COc2ccccc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N06	compound treatment	1.259	0.00389	0.05	1.412	-0.0473	-0.64	-0.4189	-0.6474	1419299	CBDivE_009546	CN1CCCc2c(N)c3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N07	compound treatment	1.183	-0.0721	-0.97	1.453	-0.00629	-0.09	-0.7485	-0.7665	1918755	CBDivE_009547	COc1c(Cl)cc(Cl)cc1/C=N/n2c(C)nc3sc4CCCCc4c3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N08	compound treatment	1.186	-0.0691	-0.93	1.373	-0.0863	-1.18	-1.4913	-0.9934	1779127	CBDivE_009548	CCC1CCCCN1C(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N09	compound treatment	1.226	-0.0291	-0.39	1.409	-0.0503	-0.69	-0.7626	-0.965	1918756	CBDivE_009549	Cc1ccc(O)c(/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N10	compound treatment	1.223	-0.0321	-0.43	1.461	0.00171	0.02	-0.2898	-0.668	1918757	CBDivE_009550	Cc1cccc2c(N)c3CCN(Cc4ccccc4)c3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N11	compound treatment	1.229	-0.0261	-0.35	1.408	-0.0513	-0.7	-0.7436	-0.9496	1918758	CBDivE_009551	Oc1c(CC=C)cccc1/C=N/NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N12	compound treatment	1.189	-0.0661	-0.89	1.406	-0.0533	-0.73	-1.1445	-0.9948	1639363	CBDivE_009552	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Cl)cc2C(=O)Nc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N13	compound treatment	1.25	-0.00511	-0.07	1.427	-0.0323	-0.44	-0.3601	-0.808	1918759	CBDivE_009553	Cc1ccc(O)c(/C=N\Nc2ccccn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N14	compound treatment	1.219	-0.0361	-0.49	1.414	-0.0453	-0.62	-0.7812	-0.9931	1918760	CBDivE_009554	CC(=O)CCS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N15	compound treatment	1.212	-0.0431	-0.58	1.415	-0.0443	-0.6	-0.8383	-0.9998	1918761	CBDivE_009555	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N16	compound treatment	1.238	-0.0171	-0.23	1.414	-0.0453	-0.62	-0.5999	-0.9099	3017140	CBDivE_009556	OC(=O)c1cccs1.O=C(Nc1ccccn1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N17	compound treatment	1.161	-0.0941	-1.27	1.431	-0.0283	-0.39	-1.1705	-0.8821	1918763	CBDivE_009557	O=C(Nc1ccc2ccccc2c1)Nc3cccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N18	compound treatment	1.288	0.0329	0.44	1.437	-0.0223	-0.3	0.0988	0.1838	1918764	CBDivE_009558	Clc1ccc(OC(NC(=O)c2ccccc2)C(Br)(Br)Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N19	compound treatment	1.215	-0.0401	-0.54	1.512	0.0527	0.72	0.1256	0.1397	1918765	CBDivE_009559	CCOc1ccc(/C=C\C(=O)c2ccc(OCC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	N20	compound treatment	1.22	-0.0351	-0.47	1.417	-0.0423	-0.58	-0.7427	-0.9952	1170832	CBDivE_009560	Cc1cccc(C)c1NC(=O)C2(CCCCC2)NC(=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O01	compound treatment	1.294	0.0389	0.52	1.481	0.0217	0.3	0.5803	0.9633	1074688	CBDivE_009561	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O02	compound treatment	1.223	-0.0321	-0.43	1.484	0.0247	0.34	-0.068	-0.1239	1918766	CBDivE_009562	Clc1cccc(Cl)c1/C=N/NC(=O)CNc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O03	compound treatment	1.252	-0.00311	-0.04	1.509	0.0497	0.68	0.4497	0.6621	1918767	CBDivE_009563	CC12CCOCC2C1C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O04	compound treatment	1.295	0.0399	0.54	1.477	0.0177	0.24	0.5513	0.9346	1578017	CBDivE_009564	Clc1ccc(NC(=O)c2ccccc2C(=O)OCC#C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O05	compound treatment	1.279	0.0239	0.32	1.465	0.00571	0.08	0.283	0.8534	1918768	CBDivE_009565	Clc1ccc(C(=O)n2nnc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O06	compound treatment	1.236	-0.0191	-0.26	1.439	-0.0203	-0.28	-0.3779	-0.9994	1918769	CBDivE_009566	CN(C)/C(=N\c1cc(nc2ccccc12)N(C)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O07	compound treatment	1.304	0.0489	0.66	1.455	-0.00429	-0.06	0.425	0.6419	1657423	CBDivE_009567	CCCCn1c2CCCc2c(=N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O08	compound treatment	1.249	-0.00611	-0.08	1.494	0.0347	0.47	0.2764	0.5753	1918770	CBDivE_009568	FC(F)(F)COC(=O)NC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O09	compound treatment	1.302	0.0469	0.63	1.484	0.0247	0.34	0.6856	0.9565	1591704	CBDivE_009569	CC(=O)Nc1cc2OCCOc2cc1C(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O10	compound treatment	1.201	-0.0541	-0.73	1.431	-0.0283	-0.39	-0.7889	-0.9556	1918771	CBDivE_009570	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O11	compound treatment	1.356	0.101	1.36	1.532	0.0727	0.99	1.6635	0.9879	1918772	CBDivE_009571	CN1CCN(CC(=O)N/N=C\c2ccccn2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O12	compound treatment	1.295	0.0399	0.54	1.459	-2.88E-4	0.0	0.3777	0.7019	1522935	CBDivE_009572	O=C(Nc1ccccc1c2ccccc2NC(=O)C3CC3c4ccccc4)C5CC5c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O13	compound treatment	1.257	0.00189	0.03	1.494	0.0347	0.47	0.3527	0.7441	1918773	CBDivE_009573	Oc1ccc(/C=N/c2ccc(cc2)c3ccc(/N=C\c4ccc(O)c(O)c4)cc3)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O14	compound treatment	1.209	-0.0461	-0.62	1.434	-0.0253	-0.34	-0.6837	-0.9613	1918774	CBDivE_009574	CC1=NN(C(C1)c2ccccc2)C(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O15	compound treatment	1.32	0.0649	0.88	1.494	0.0347	0.47	0.9537	0.9583	1918775	CBDivE_009575	Cc1ccc(/N=C/c2cc(Cl)cc(Cl)c2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O16	compound treatment	1.272	0.0169	0.23	1.487	0.0277	0.38	0.4283	0.9707	1918776	CBDivE_009576	[O-][N+](=O)c1cc(Cl)ccc1OC(=O)CCCCC(=O)Oc2ccc(Cl)cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O17	compound treatment	1.372	0.117	1.58	1.551	0.0917	1.25	1.9994	0.9934	1918777	CBDivE_009577	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O18	compound treatment	1.221	-0.0341	-0.46	1.483	0.0237	0.32	-0.0967	-0.172	1918778	CBDivE_009578	C/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])/c2ccc3CCc4cccc2c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O19	compound treatment	1.334	0.0789	1.06	1.468	0.00871	0.12	0.8366	0.7812	1918779	CBDivE_009579	COc1ccc2[C@@H]3[C@H]4CCCC[C@]4(O)CCN3C(=O)c2c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	O20	compound treatment	1.19	-0.0651	-0.88	1.508	0.0487	0.66	-0.1514	-0.1375	1575494	CBDivE_009580	Cc1cccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P01	compound treatment	1.262	0.00689	0.09	1.457	-0.00229	-0.03	0.0437	0.4453	1918780	CBDivE_009581	Brc1ccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P02	compound treatment	1.234	-0.0211	-0.28	1.426	-0.0333	-0.45	-0.5224	-0.9748	1918781	CBDivE_009582	CCC1C(=NN(C1=O)c2ccc(cc2)S(=O)(=O)O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P03	compound treatment	1.284	0.0289	0.39	1.332	-0.127	-1.74	-0.9518	-0.535	1169569	CBDivE_009583	Cc1cc(ccc1NC(=O)c2ccccc2C(=O)O)c3ccc(NC(=O)c4ccccc4C(=O)O)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P04	compound treatment	1.17	-0.0851	-1.15	1.413	-0.0463	-0.63	-1.2582	-0.9603	1122733	CBDivE_009584	CC1(C)CC(=O)c2c(NCc3ccc(Cl)cc3)c4ccccc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P05	compound treatment	1.223	-0.0321	-0.43	1.396	-0.0633	-0.86	-0.9166	-0.9492	1918782	CBDivE_009585	CN1CCc2c1nc3ccccc3c2/N=C(\N4CCCCC4)/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P06	compound treatment	1.202	-0.0531	-0.72	1.403	-0.0563	-0.77	-1.0494	-0.9994	1918783	CBDivE_009586	Cc1ccc(C)c2c(N)c3CCN(Cc4ccccc4)c3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P07	compound treatment	1.216	-0.0391	-0.53	1.417	-0.0423	-0.58	-0.7808	-0.999	1918784	CBDivE_009587	Brc1ccc(o1)C2OCC(CC(=O)NCc3ccccc3)N2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P08	compound treatment	1.251	-0.00411	-0.06	1.355	-0.104	-1.42	-1.0448	-0.7341	1918785	CBDivE_009588	CC(=O)c1ccc(/N=C/c2ccc(s2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P09	compound treatment	1.156	-0.0991	-1.34	1.305	-0.154	-2.1	-2.4332	-0.9761	1918786	CBDivE_009589	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P10	compound treatment	0.736	-0.519	-7.0	0.902	-0.557	-7.6	-10.3256	-0.9992	1617072	CBDivE_009590	CCOC(=O)c1nn(c2ccc(C)cc2)c(=N)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P11	compound treatment	1.234	-0.0211	-0.28	1.419	-0.0403	-0.55	-0.5898	-0.9532	1918787	CBDivE_009591	O=C1C2C3CCC(O3)C2C(=O)N1c4cccc5cccnc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P12	compound treatment	1.198	-0.0571	-0.77	1.353	-0.106	-1.45	-1.5697	-0.9563	1614253	CBDivE_009592	O=S(=O)(N1CCCCC1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P13	compound treatment	1.254	-0.00111	-0.01	1.417	-0.0423	-0.58	-0.4183	-0.7252	1514143	CBDivE_009593	Cc1cc(C)n(CN2C(=O)c3ccccc3C2=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P14	compound treatment	1.207	-0.0481	-0.65	1.436	-0.0233	-0.32	-0.6835	-0.9459	1731684	CBDivE_009594	CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P15	compound treatment	1.284	0.0289	0.39	1.426	-0.0333	-0.45	-0.0454	-0.0759	1918788	CBDivE_009595	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P16	compound treatment	1.212	-0.0431	-0.58	1.395	-0.0643	-0.88	-1.0311	-0.9801	1918789	CBDivE_009596	Oc1ccc(O)c(c1)[S+]2CCC(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P17	compound treatment	1.187	-0.0681	-0.92	1.385	-0.0743	-1.01	-1.366	-0.9988	1918790	CBDivE_009597	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2OC(F)(F)C(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P18	compound treatment	1.152	-0.103	-1.39	1.43	-0.0293	-0.4	-1.266	-0.8748	1918791	CBDivE_009598	COc1ccc2ccccc2c1/C=N\n3c(C)cc(C)c(C(=O)N)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P19	compound treatment	1.263	0.00789	0.11	1.411	-0.0483	-0.66	-0.3903	-0.5852	1918792	CBDivE_009599	COC1OC2COC(OC2CC1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.30	P20	compound treatment	1.224	-0.0311	-0.42	1.395	-0.0643	-0.88	-0.9167	-0.9431	1650816	CBDivE_009600	Cc1cccc(C)c1NC(=O)C(NC(=O)CN2C(=O)c3ccccc3C2=O)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A01	compound treatment	1.238	-0.0106	-0.14	1.465	0.00346	0.05	-0.0678	-0.4502	1918793	CBDivE_009601	CCCN1C(=N)C(CC)(CC)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A02	compound treatment	1.28	0.0314	0.42	1.49	0.0285	0.39	0.5739	0.999	1624511	CBDivE_009602	O=C(Oc1cccc2ccccc12)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A03	compound treatment	1.295	0.0464	0.63	1.486	0.0245	0.33	0.6784	0.9566	1918794	CBDivE_009603	COc1cccc(/C=N/c2ccc(\N=C\c3cccc(OC)c3O)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A04	compound treatment	1.291	0.0424	0.57	1.462	4.58E-4	0.01	0.4089	0.7148	1918795	CBDivE_009604	COc1ccc2C3=CC(=O)/C(=C\C=C\N(C)C)/CC3CCc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A05	compound treatment	1.304	0.0554	0.75	1.53	0.0685	0.93	1.1886	0.9939	1918796	CBDivE_009605	Cc1ccc(cc1)C(=O)COC(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A06	compound treatment	1.29	0.0414	0.56	1.408	-0.0535	-0.73	-0.1214	-0.132	1918797	CBDivE_009606	CC(=C)C1CC=C(C)/C(=N/NC(=O)c2ccccc2I)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A07	compound treatment	1.381	0.132	1.79	1.565	0.103	1.41	2.2606	0.9932	1233215	CBDivE_009607	CCOC(=O)c1c(NC(=O)c2nccnc2C(=O)O)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A08	compound treatment	1.325	0.0764	1.03	1.563	0.101	1.38	1.7071	0.9895	1262409	CBDivE_009608	CC1(C)CC(C)(O)N(CC(=O)O)C(=S)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A09	compound treatment	1.325	0.0764	1.03	1.445	-0.0165	-0.23	0.5693	0.5396	1918798	CBDivE_009609	Cc1n[nH]c(Nc2ccc(cc2)c3ccccc3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A10	compound treatment	1.315	0.0664	0.9	1.431	-0.0305	-0.42	0.3389	0.3431	1918799	CBDivE_009610	CCc1cc2c(=O)c(coc2cc1OC(C)C(=O)NC(CC(C)C)C(=O)NCC(=O)N)c3nc(C)cs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A11	compound treatment	1.291	0.0424	0.57	1.545	0.0835	1.14	1.2092	0.9493	1918800	CBDivE_009611	CCOC(=O)CNC1CC(=O)N(C1=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A12	compound treatment	1.274	0.0254	0.34	1.518	0.0565	0.77	0.7867	0.9335	1918801	CBDivE_009612	Nc1ncnc(NCc2ccccc2)c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A13	compound treatment	1.336	0.0874	1.18	1.484	0.0225	0.31	1.0503	0.8622	1918802	CBDivE_009613	NS(=O)(=O)c1cc([N+](=O)[O-])c(O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A14	compound treatment	1.225	-0.0236	-0.32	1.5	0.0385	0.52	0.1457	0.2374	1918803	CBDivE_009614	O(c1ccccc1)c2ccc(C#Cc3ccc(cc3)c4nc5ccccc5nc4c6cccc(C#Cc7ccc(Oc8ccccc8)cc7)c6)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A15	compound treatment	1.268	0.0194	0.26	1.501	0.0395	0.54	0.5655	0.9452	1584409	CBDivE_009615	CC(C)OC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A16	compound treatment	1.234	-0.0146	-0.2	1.46	-0.00154	-0.02	-0.1542	-0.7782	1021963	CBDivE_009616	CC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A17	compound treatment	1.387	0.138	1.87	1.542	0.0805	1.1	2.096	0.9679	1918804	CBDivE_009617	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=O)c4ccc(cc4)[N+](=O)[O-])cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A18	compound treatment	1.283	0.0344	0.46	1.435	-0.0265	-0.36	0.0722	0.1227	1918805	CBDivE_009618	CN(C)C(c1nnnn1C(/C=C\c2ccc(Cl)cc2Cl)C(C)(C)C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A19	compound treatment	1.289	0.0404	0.54	1.511	0.0495	0.67	0.8623	0.9944	1918806	CBDivE_009619	[O-][N+](=O)c1ccc2C(=O)N(C3C=NC(=O)NC3=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	A20	compound treatment	1.203	-0.0456	-0.62	1.464	0.00246	0.03	-0.4113	-0.6676	1918807	CBDivE_009620	CSC1=Nc2ccccc2[S+]([O-])N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B01	compound treatment	1.259	0.0104	0.14	1.4	-0.0615	-0.84	-0.4942	-0.5809	1918808	CBDivE_009621	O=C(CCCN1C(=O)/C(=C/2\SC(=S)N(CCCC(=O)N3CCC(C3)c4ccccc4)C2=O)/SC1=S)N5CCC(C5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B02	compound treatment	1.29	0.0414	0.56	1.507	0.0455	0.62	0.8332	0.9986	1918809	CBDivE_009622	COc1ccc(/C=N/NC(=N)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B03	compound treatment	1.259	0.0104	0.14	1.449	-0.0125	-0.17	-0.0217	-0.0983	1918810	CBDivE_009623	[O-][N+](=O)c1ccc2nc3c(cc2c1)n(CCCN4C(=O)c5ccccc5C4=O)c6ccccc63
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B04	compound treatment	1.257	0.0084	0.11	1.488	0.0265	0.36	0.3352	0.8865	1019666	CBDivE_009624	S=C(NCc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B05	compound treatment	1.265	0.0164	0.22	1.507	0.0455	0.62	0.5947	0.9036	1918811	CBDivE_009625	CCC(C)(Nc1ccc(C)cc1)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B06	compound treatment	1.208	-0.0406	-0.55	1.424	-0.0375	-0.51	-0.7493	-0.9994	1918812	CBDivE_009626	COc1cccc(/C=N/Nc2ccc(cc2)S(=O)(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B07	compound treatment	1.282	0.0334	0.45	1.49	0.0285	0.39	0.593	0.9972	1918813	CBDivE_009627	COc1ccccc1NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B08	compound treatment	1.354	0.105	1.42	1.419	-0.0425	-0.58	0.5952	0.3876	1918814	CBDivE_009628	CN(C)c1ccc(/C=N/Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B09	compound treatment	1.218	-0.0306	-0.41	1.499	0.0375	0.51	0.0693	0.1055	1918815	CBDivE_009629	CC1(C)C(N(O)C(=O)Nc2cccc3ccccc23)N(C(=O)N1CC(=O)NN)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B10	compound treatment	1.335	0.0864	1.17	1.464	0.00246	0.03	0.8479	0.7271	1918816	CBDivE_009630	COc1ccc(/C=N/Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B11	compound treatment	1.242	-0.0066	-0.09	1.401	-0.0605	-0.83	-0.6468	-0.7789	1918817	CBDivE_009631	COc1ccc2ccccc2c1C3NC(=S)NC(=C3C(=O)Nc4ccccc4)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B12	compound treatment	1.24	-0.0086	-0.12	1.444	-0.0175	-0.24	-0.2512	-0.9448	1918818	CBDivE_009632	C/C(=N\Nc1ccc(cc1)S(=O)(=O)O)/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B13	compound treatment	1.289	0.0404	0.54	1.347	-0.115	-1.56	-0.7191	-0.4347	1383209	CBDivE_009633	CC(C)(c1ccc(Oc2cccc(N)c2)cc1)c3ccc(Oc4cccc(N)c4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B14	compound treatment	1.202	-0.0466	-0.63	1.477	0.0155	0.21	-0.2955	-0.4456	1918819	CBDivE_009634	Oc1ccccc1/C=N/Nc2ccc(cc2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B15	compound treatment	1.267	0.0184	0.25	1.418	-0.0435	-0.59	-0.2443	-0.3797	1918820	CBDivE_009635	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCC(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B16	compound treatment	1.213	-0.0356	-0.48	1.427	-0.0345	-0.47	-0.6727	-1.0	1492542	CBDivE_009636	CCN1C(=c2sc(=C3SC(=S)N(C)C3=O)n(c4ccccc4)c2=O)C=Cc5cc(C)ccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B17	compound treatment	1.266	0.0174	0.23	1.458	-0.00354	-0.05	0.1318	0.5501	1918821	CBDivE_009637	O=C(N/N=C/c1cccnc1)C2CC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B18	compound treatment	1.209	-0.0396	-0.53	1.474	0.0125	0.17	-0.2577	-0.4596	1918822	CBDivE_009638	[O-][N+](=O)c1ccc(N/N=C/c2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B19	compound treatment	1.221	-0.0276	-0.37	1.393	-0.0685	-0.93	-0.9242	-0.9186	1918823	CBDivE_009639	OS(=O)(=O)CCCSc1sc2ccc(Cl)cc2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	B20	compound treatment	1.184	-0.0646	-0.87	1.442	-0.0195	-0.27	-0.8047	-0.883	1918824	CBDivE_009640	COc1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C01	compound treatment	1.228	-0.0206	-0.28	1.508	0.0465	0.63	0.2514	0.3635	1918825	CBDivE_009641	[O-][N+](=O)c1ccccc1NC(NC(=O)c2ccccc2)C(Br)(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C02	compound treatment	1.195	-0.0536	-0.72	1.482	0.0205	0.28	-0.3141	-0.4052	1628162	CBDivE_009642	CCN(CC)CCOc1ccccc1OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C03	compound treatment	1.401	0.152	2.06	1.494	0.0325	0.44	1.7667	0.8401	1670790	CBDivE_009643	CCCC(=O)Nc1c2CCN(c2nc3ccccc13)c4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C04	compound treatment	1.266	0.0174	0.23	1.432	-0.0295	-0.4	-0.1189	-0.255	1918826	CBDivE_009644	Fc1ccc(cc1)C2N(C(=O)CS2(=O)=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C05	compound treatment	1.261	0.0124	0.17	1.565	0.103	1.41	1.1159	0.7854	1145704	CBDivE_009645	Cc1ccc(cc1)C(=O)COC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C06	compound treatment	1.268	0.0194	0.26	1.507	0.0455	0.62	0.6234	0.9264	1918827	CBDivE_009646	COc1ccc(NC(=O)Nc2ccc(SC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C07	compound treatment	1.286	0.0374	0.5	1.494	0.0325	0.44	0.6697	0.9979	1918828	CBDivE_009647	CCOC(=O)c1c(/N=C/c2ccccc2[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C08	compound treatment	1.252	0.0034	0.05	1.48	0.0185	0.25	0.2104	0.8224	1150121	CBDivE_009648	CC1C=CCC2C1C(=O)N(CNc3ccccc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C09	compound treatment	1.283	0.0344	0.46	1.542	0.0805	1.1	1.1039	0.9267	1918829	CBDivE_009649	OC(=O)/C=C/c1cccc(NS(=O)(=O)\C=C\c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C10	compound treatment	1.283	0.0344	0.46	1.522	0.0605	0.82	0.9111	0.963	1918830	CBDivE_009650	COc1ccc(cc1C2NC(=O)c3c4CCCCc4sc3N2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C11	compound treatment	1.31	0.0614	0.83	1.445	-0.0165	-0.23	0.4262	0.4965	1775248	CBDivE_009651	OC(=O)c1ccc(cc1)N2C(=O)c3ccc(Oc4ccc(cc4)[N+](=O)[O-])cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C12	compound treatment	1.277	0.0284	0.38	1.458	-0.00354	-0.05	0.2367	0.6131	1918831	CBDivE_009652	OC(=O)c1cc(n[nH]1)c2c(O)c(F)c(F)c(F)c2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C13	compound treatment	1.332	0.0834	1.13	1.525	0.0635	0.87	1.4074	0.9916	1265717	CBDivE_009653	O=C(Nc1ccccc1)Nc2cc3ccccc3cc2NC(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C14	compound treatment	1.301	0.0524	0.71	1.506	0.0445	0.61	0.9285	0.9971	1918832	CBDivE_009654	O=C(Nc1ccc(/C=C/c2ccccc2)cc1)c3ccc(cc3)C(=O)Nc4ccc(/C=C/c5ccccc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C15	compound treatment	1.341	0.0924	1.25	1.503	0.0415	0.57	1.2812	0.936	1355929	CBDivE_009655	NCC1(CC2CC3CC(O)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C16	compound treatment	1.248	-6.02E-4	-0.01	1.491	0.0295	0.4	0.2783	0.6927	1918833	CBDivE_009656	COc1ccc(cc1)C(=O)NC(Sc2ccc(Cl)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C17	compound treatment	1.237	-0.0116	-0.16	1.509	0.0475	0.65	0.3469	0.5211	1918834	CBDivE_009657	O=C(NNC(=O)c1cccc(C(=O)NNC(=O)c2ccccc2)c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C18	compound treatment	1.242	-0.0066	-0.09	1.491	0.0295	0.4	0.2211	0.5373	1918835	CBDivE_009658	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C19	compound treatment	1.272	0.0234	0.32	1.504	0.0425	0.58	0.6326	0.9593	1918836	CBDivE_009659	FC(F)(F)c1cccc(NC(=O)c2cccc(n2)C(=O)Nc3cccc(c3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	C20	compound treatment	1.226	-0.0226	-0.3	1.439	-0.0225	-0.31	-0.433	-1.0	1918837	CBDivE_009660	S=C(N/N=C\c1ccco1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D01	compound treatment	1.219	-0.0296	-0.4	1.438	-0.0235	-0.32	-0.5094	-0.9941	1122570	CBDivE_009661	CN(C)CCC(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D02	compound treatment	1.241	-0.0076	-0.1	1.417	-0.0445	-0.61	-0.502	-0.815	1918838	CBDivE_009662	COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D03	compound treatment	1.113	-0.136	-1.83	1.477	0.0155	0.21	-1.1445	-0.6215	1530676	CBDivE_009663	CCCCc1c(CCC)c(=N)c2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D04	compound treatment	1.228	-0.0206	-0.28	1.422	-0.0395	-0.54	-0.5778	-0.9525	1918839	CBDivE_009664	COc1ccc(/C=N/c2cc(ccc2O)S(=O)(=O)c3ccc(O)c(\N=C\c4ccc(OC)c(O)c4)c3)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D05	compound treatment	1.203	-0.0456	-0.62	1.46	-0.00154	-0.02	-0.4499	-0.7309	1918840	CBDivE_009665	Clc1cccc(c1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D06	compound treatment	1.305	0.0564	0.76	1.489	0.0275	0.37	0.8028	0.9467	1918841	CBDivE_009666	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D07	compound treatment	1.272	0.0234	0.32	1.475	0.0135	0.18	0.353	0.9667	1918842	CBDivE_009667	[O-][N+](=O)c1cccc(NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D08	compound treatment	1.21	-0.0386	-0.52	1.452	-0.00954	-0.13	-0.4602	-0.8574	1918843	CBDivE_009668	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3cccc4c(=O)[nH][nH]c(=O)c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D09	compound treatment	1.237	-0.0116	-0.16	1.414	-0.0475	-0.65	-0.5691	-0.8533	1918844	CBDivE_009669	[O-][N+](=O)c1ccccc1C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D10	compound treatment	1.195	-0.0536	-0.72	1.445	-0.0165	-0.23	-0.6708	-0.8856	1918845	CBDivE_009670	Oc1ccccc1C(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D11	compound treatment	1.202	-0.0466	-0.63	1.489	0.0275	0.37	-0.1798	-0.2457	1780347	CBDivE_009671	CCOC(=O)C1=C(C)NC(=O)NC1c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D12	compound treatment	1.286	0.0374	0.5	1.475	0.0135	0.18	0.4865	0.9062	1918846	CBDivE_009672	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3ccc(cc3)c4ccc(\N=C\c5cc6OCOc6cc5[N+](=O)[O-])cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D13	compound treatment	1.332	0.0834	1.13	1.463	0.00146	0.02	0.8096	0.7195	1918847	CBDivE_009673	CC1=Nc2c(ccc3cccnc23)C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D14	compound treatment	1.223	-0.0256	-0.35	1.404	-0.0575	-0.78	-0.7991	-0.9321	1918848	CBDivE_009674	OCc1cccc(/N=C/c2cc3OCOc3cc2[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D15	compound treatment	1.212	-0.0366	-0.49	1.486	0.0245	0.33	-0.1133	-0.1902	1918849	CBDivE_009675	C/C(=N\NC(=O)CNS(=O)(=O)c1ccccc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D16	compound treatment	1.272	0.0234	0.32	1.378	-0.0835	-1.14	-0.5823	-0.4926	1918850	CBDivE_009676	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3ccc(\N=C\c4cc5OCOc5cc4[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D17	compound treatment	1.219	-0.0296	-0.4	1.448	-0.0135	-0.18	-0.413	-0.9386	1918851	CBDivE_009677	C(C/N=C/c1ccc2OCOc2c1)/N=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D18	compound treatment	1.207	-0.0416	-0.56	1.403	-0.0585	-0.8	-0.9613	-0.9851	1918852	CBDivE_009678	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3cccc4c(\N=C\c5cc6OCOc6cc5[N+](=O)[O-])cccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D19	compound treatment	1.291	0.0424	0.57	1.479	0.0175	0.24	0.5728	0.9245	1918853	CBDivE_009679	[O-][N+](=Nc1nonc1c2ccccc2)c3nonc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	D20	compound treatment	1.222	-0.0266	-0.36	1.458	-0.00354	-0.05	-0.2879	-0.7951	1918854	CBDivE_009680	FC(F)C(F)(F)COC(=O)CCC(=O)n1nnc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E01	compound treatment	1.305	0.0564	0.76	1.475	0.0135	0.18	0.6678	0.8532	1676271	CBDivE_009681	OC(=O)c1ccc(OCCn2ccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E02	compound treatment	1.253	0.0044	0.06	1.46	-0.00154	-0.02	0.0271	0.4302	1918855	CBDivE_009682	C/C(=N\Oc1no[n+]([O-])c1C)/C(=N/Oc2no[n+]([O-])c2C)/N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E03	compound treatment	1.279	0.0304	0.41	1.48	0.0185	0.25	0.468	0.9725	1918856	CBDivE_009683	Brc1ccc(/C=N/c2cccc3ccccc23)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E04	compound treatment	1.272	0.0234	0.32	1.523	0.0615	0.84	0.8158	0.911	1918857	CBDivE_009684	S=c1sc2ccccc2n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E05	compound treatment	1.298	0.0494	0.67	1.539	0.0775	1.06	1.2181	0.9753	1124994	CBDivE_009685	CCOc1ccc(cc1)C(=O)COC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E06	compound treatment	1.222	-0.0266	-0.36	1.472	0.0105	0.14	-0.1529	-0.396	1918858	CBDivE_009686	Ic1ccc(NCC(=O)N/N=C/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E07	compound treatment	1.287	0.0384	0.52	1.57	0.108	1.48	1.4121	0.9011	1918859	CBDivE_009687	OC(=O)/C=C/C(=O)NC(CC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E08	compound treatment	1.302	0.0534	0.72	1.521	0.0595	0.81	1.0827	0.9983	1918860	CBDivE_009688	CC(=O)c1ccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E09	compound treatment	1.399	0.15	2.03	1.459	-0.00254	-0.03	1.4102	0.6949	1271985	CBDivE_009689	NC(=O)CCC1S(=O)(=O)CC(CS1(=O)=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E10	compound treatment	1.29	0.0414	0.56	1.473	0.0115	0.16	0.5054	0.8715	1918861	CBDivE_009690	ClC(Cl)(Cl)C(NC(=O)c1ccco1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E11	compound treatment	1.342	0.0934	1.26	1.529	0.0675	0.92	1.5414	0.988	1918862	CBDivE_009691	COc1cc(/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E12	compound treatment	1.242	-0.0066	-0.09	1.46	-0.00154	-0.02	-0.0778	-0.8507	1778486	CBDivE_009692	OC(=O)c1[nH]c(=O)[nH]c(=O)c1CN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E13	compound treatment	1.28	0.0314	0.42	1.468	0.00646	0.09	0.3618	0.8362	1497460	CBDivE_009693	O=C(Nc1ccccc1Nc2cc(nn2c3ccccc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E14	compound treatment	1.231	-0.0176	-0.24	1.451	-0.0105	-0.14	-0.2696	-0.9711	1918863	CBDivE_009694	[O-][N+](=O)c1ccc2nc(nc(c3ccccc3)c2c1)c4ccc(cc4)c5nc(c6ccccc6)c7cc(ccc7n5)[N+](=[O-])[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E15	compound treatment	1.343	0.0944	1.27	1.48	0.0185	0.25	1.0785	0.8308	1918864	CBDivE_009695	O=S(=O)(/N=C(/NC(=S)Nc1ccccc1)\c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E16	compound treatment	1.253	0.0044	0.06	1.436	-0.0255	-0.35	-0.2043	-0.5783	1918865	CBDivE_009696	Cc1ccc(cc1)S(=O)(=O)c2ccc(Oc3ccc(N)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E17	compound treatment	1.3	0.0514	0.69	1.466	0.00446	0.06	0.5333	0.7662	1368841	CBDivE_009697	CCN(CC)CC1CCc2c(C1=O)c3ccccc3n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E18	compound treatment	1.246	-0.0026	-0.04	1.474	0.0125	0.17	0.0953	0.5494	1918866	CBDivE_009698	[O-][N+](=O)c1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E19	compound treatment	1.306	0.0574	0.77	1.534	0.0725	0.99	1.2462	0.9927	1918867	CBDivE_009699	N/C(=N/c1ccccc1)/SC2CC(=O)N(C2=O)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	E20	compound treatment	1.289	0.0404	0.54	1.468	0.00646	0.09	0.4476	0.8108	1918868	CBDivE_009700	CN(C)C1(CCCCC1)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F01	compound treatment	1.215	-0.0336	-0.45	1.41	-0.0515	-0.7	-0.8175	-0.9775	1918869	CBDivE_009701	Cc1ccc(/C=N/NC(=O)c2sc3ccccc3c2Cl)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F02	compound treatment	1.198	-0.0506	-0.68	1.407	-0.0545	-0.74	-1.0086	-0.9991	1918870	CBDivE_009702	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)COc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F03	compound treatment	1.186	-0.0626	-0.84	1.452	-0.00954	-0.13	-0.6892	-0.8065	1918871	CBDivE_009703	[O-][N+](=O)c1cccc(c1)N(Cc2ccccc2)C(=O)CCCCCN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F04	compound treatment	1.218	-0.0306	-0.41	1.378	-0.0835	-1.14	-1.0975	-0.9057	1341505	CBDivE_009704	CC(=O)Nc1cccc(NS(=O)(=O)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F05	compound treatment	1.268	0.0194	0.26	1.514	0.0525	0.72	0.6909	0.907	1405138	CBDivE_009705	CCC12CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C2C(=C(CCC(C)CNC(=O)C)O1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F06	compound treatment	1.209	-0.0396	-0.53	1.449	-0.0125	-0.17	-0.4987	-0.889	1918872	CBDivE_009706	CCO/C(=C/c1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O)/CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F07	compound treatment	1.267	0.0184	0.25	1.415	-0.0465	-0.63	-0.2733	-0.401	1918873	CBDivE_009707	COc1ccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F08	compound treatment	1.263	0.0144	0.19	1.502	0.0405	0.55	0.5275	0.9018	1918874	CBDivE_009708	CC(C)(C)NS(=O)(=O)NCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F09	compound treatment	1.165	-0.0836	-1.13	1.467	0.00546	0.07	-0.7449	-0.659	1918875	CBDivE_009709	CC(C)(C)NC(NC(=O)c1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F10	compound treatment	1.241	-0.0076	-0.1	1.472	0.0105	0.14	0.0283	0.1612	1918876	CBDivE_009710	[O-][N+](=O)c1ccc(Nc2ccc(Cc3ccc(Nc4ccc([N+](=O)[O-])c5nonc45)cc3)cc2)c6nonc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F11	compound treatment	1.225	-0.0236	-0.32	1.503	0.0415	0.57	0.1746	0.2691	1918877	CBDivE_009711	COc1ccc(/C=N/CCc2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F12	compound treatment	1.144	-0.105	-1.41	1.417	-0.0445	-0.61	-1.4273	-0.9291	1918878	CBDivE_009712	COc1cc(/C=N/Cc2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F13	compound treatment	1.218	-0.0306	-0.41	1.471	0.00946	0.13	-0.2007	-0.4641	1918879	CBDivE_009713	ClC(Cl)(Cl)C(NC1CCS(=O)(=O)C1)NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F14	compound treatment	1.2	-0.0486	-0.66	1.434	-0.0275	-0.38	-0.7292	-0.965	1918880	CBDivE_009714	O=C1NC(=O)/C(=C/NCc2ccccc2)/C(=O)N1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F15	compound treatment	1.263	0.0144	0.19	1.483	0.0215	0.29	0.3443	0.9802	1918881	CBDivE_009715	[O-][N+](=O)c1ccccc1/C=N/NC(=O)CNS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F16	compound treatment	1.217	-0.0316	-0.43	1.412	-0.0495	-0.68	-0.7792	-0.9754	1918882	CBDivE_009716	CCOC(=O)c1ccc(NC=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F17	compound treatment	1.193	-0.0556	-0.75	1.465	0.00346	0.05	-0.4971	-0.6614	1151368	CBDivE_009717	CCN(CC)CCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC(C)C)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F18	compound treatment	1.263	0.0144	0.19	1.45	-0.0115	-0.16	0.0261	0.1042	1918883	CBDivE_009718	OC(C(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F19	compound treatment	1.197	-0.0516	-0.7	1.498	0.0365	0.5	-0.1407	-0.1645	1918884	CBDivE_009719	Cn1nnc(n1)C(C)(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	F20	compound treatment	1.205	-0.0436	-0.59	1.401	-0.0605	-0.83	-0.9997	-0.9862	1319936	CBDivE_009720	Nc1nc(CCN2C(=O)c3ccccc3C2=O)n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G01	compound treatment	1.237	-0.0116	-0.16	1.483	0.0215	0.29	0.0962	0.29	1918885	CBDivE_009721	Cc1ccc(OCC(=O)N/N=C/c2c[nH]nc2c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G02	compound treatment	1.191	-0.0576	-0.78	1.444	-0.0175	-0.24	-0.7186	-0.8838	1645004	CBDivE_009722	CC(C)OC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G03	compound treatment	1.286	0.0374	0.5	1.51	0.0485	0.66	0.824	0.9911	1918886	CBDivE_009723	CCc1ccc(s1)c2nc(N)sc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G04	compound treatment	1.276	0.0274	0.37	1.485	0.0235	0.32	0.4875	0.9974	1918887	CBDivE_009724	Oc1c(cccc1[N+](=O)[O-])C2NC(=O)c3c4CCCCc4sc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G05	compound treatment	1.259	0.0104	0.14	1.487	0.0255	0.35	0.3447	0.9205	1548695	CBDivE_009725	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(F)c(F)c3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G06	compound treatment	1.237	-0.0116	-0.16	1.451	-0.0105	-0.14	-0.2123	-0.9991	1219321	CBDivE_009726	CCc1c(NC(=O)C)n(c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G07	compound treatment	1.266	0.0174	0.23	1.49	0.0285	0.39	0.4404	0.971	1918888	CBDivE_009727	Cc1ccc(/C=N/NC(=O)c2cccc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G08	compound treatment	1.252	0.0034	0.05	1.491	0.0295	0.4	0.3165	0.7827	1918889	CBDivE_009728	Cc1ccc(cc1)S(=O)(=O)CCSc2cccc(c2)C(=O)Nc3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G09	compound treatment	1.277	0.0284	0.38	1.514	0.0525	0.72	0.7767	0.9572	1214426	CBDivE_009729	OC(COC1C2CC3CC(C2)CC1C3)CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G10	compound treatment	1.294	0.0454	0.61	1.542	0.0805	1.1	1.2089	0.9621	1918890	CBDivE_009730	NC(=O)CC(N1C(=O)/C(=C/C=C/c2ccc(cc2)[N+](=O)[O-])/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G11	compound treatment	1.327	0.0784	1.06	1.492	0.0305	0.42	1.0416	0.9166	1918891	CBDivE_009731	COc1cc(/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4)ccc1OC(=O)c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G12	compound treatment	1.172	-0.0766	-1.03	1.474	0.0125	0.17	-0.6106	-0.583	1713725	CBDivE_009732	O=C1NC(Nc2sc3CCCCc3c12)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G13	compound treatment	1.318	0.0694	0.94	1.431	-0.0305	-0.42	0.3675	0.3587	1918892	CBDivE_009733	O=C(N/N=C/1\C(=O)Nc2ccccc12)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G14	compound treatment	1.24	-0.0086	-0.12	1.484	0.0225	0.31	0.1345	0.4107	1484240	CBDivE_009734	CCC(C)(N(C)C(=O)CN1C(=O)c2ccccc2C1=O)C(=O)Nc3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G15	compound treatment	1.301	0.0524	0.71	1.576	0.114	1.56	1.6035	0.9358	1918893	CBDivE_009735	COc1ccc2CCC3C(N(N=C3c2c1)C(=O)C)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G16	compound treatment	1.24	-0.0086	-0.12	1.513	0.0515	0.7	0.4141	0.5823	1918894	CBDivE_009736	CCN(CC)CCNC(=O)Nc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G17	compound treatment	1.304	0.0554	0.75	1.503	0.0415	0.57	0.9282	0.9905	1918895	CBDivE_009737	COc1ccc2C3=NN(C(C3CCc2c1)c4cccc(c4)[N+](=O)[O-])C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G18	compound treatment	1.274	0.0254	0.34	1.449	-0.0125	-0.17	0.1213	0.3169	1918896	CBDivE_009738	CC(COc1ccc(cn1)C(F)(F)F)Oc2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G19	compound treatment	1.342	0.0934	1.26	1.504	0.0425	0.58	1.3003	0.9378	1918897	CBDivE_009739	Oc1ccc(N=Nc2ccc(cc2)[N+](=O)[O-])cc1/C=N/NC(=O)Cc3ccc(Br)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	G20	compound treatment	1.19	-0.0586	-0.79	1.431	-0.0305	-0.42	-0.8535	-0.9552	1918898	CBDivE_009740	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C3(CCCC3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H01	compound treatment	1.206	-0.0426	-0.57	1.359	-0.103	-1.4	-1.3951	-0.9228	1918899	CBDivE_009741	C/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H02	compound treatment	1.215	-0.0336	-0.45	1.461	-5.42E-4	-0.01	-0.3258	-0.7185	1918900	CBDivE_009742	O=c1[nH]nc(SCc2ccccc2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H03	compound treatment	1.262	0.0134	0.18	1.424	-0.0375	-0.51	-0.2342	-0.4314	1419816	CBDivE_009743	O=C1NC(Nc2sc3CCCCc3c12)c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H04	compound treatment	1.269	0.0204	0.28	1.423	-0.0385	-0.53	-0.1771	-0.2984	1388172	CBDivE_009744	NC(=O)CCS(=O)(=O)CCN1CCN(CCS(=O)(=O)CCC(=O)N)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H05	compound treatment	1.193	-0.0556	-0.75	1.43	-0.0315	-0.43	-0.8345	-0.9652	1500722	CBDivE_009745	CC(=O)Nc1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H06	compound treatment	1.24	-0.0086	-0.12	1.425	-0.0365	-0.5	-0.4344	-0.8491	1918901	CBDivE_009746	CC(C)CCOc1ccc(CSCCCNC(=N)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H07	compound treatment	1.201	-0.0476	-0.64	1.415	-0.0465	-0.63	-0.9029	-1.0	1918902	CBDivE_009747	COc1ccc(NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H08	compound treatment	1.208	-0.0406	-0.55	1.404	-0.0575	-0.78	-0.9422	-0.9846	1251568	CBDivE_009748	Cc1cccc(C)c1NC(=O)C2(CCCC2)NC(=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H09	compound treatment	1.198	-0.0506	-0.68	1.417	-0.0445	-0.61	-0.9122	-0.9983	1918903	CBDivE_009749	CCN(CC)C(NC(=O)c1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H10	compound treatment	1.233	-0.0156	-0.21	1.467	0.00546	0.07	-0.0962	-0.4309	1177686	CBDivE_009750	CN(C(=O)CN1C(=O)c2ccccc2C1=O)C3(CCCC3)C(=O)Nc4c(C)cccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H11	compound treatment	1.337	0.0884	1.19	1.372	-0.0895	-1.22	-0.0201	-0.0118	1918904	CBDivE_009751	COc1ccc(CC/N=C/c2c3ccccc3cc4ccccc24)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H12	compound treatment	1.23	-0.0186	-0.25	1.468	0.00646	0.09	-0.1152	-0.4331	1125428	CBDivE_009752	CN(C(C(=O)Nc1c(C)cccc1C)c2ccccc2)C(=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H13	compound treatment	1.317	0.0684	0.92	1.535	0.0735	1.0	1.3608	0.9992	1918905	CBDivE_009753	CCCCCCC(=O)NC(Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H14	compound treatment	1.264	0.0154	0.21	1.453	-0.00854	-0.12	0.0645	0.2709	1353622	CBDivE_009754	Cc1cccc(C)c1NC(=O)C(NC(=O)CN2C(=O)c3ccccc3C2=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H15	compound treatment	1.197	-0.0516	-0.7	1.425	-0.0365	-0.5	-0.8446	-0.9866	1367759	CBDivE_009755	COc1ccc(OCC(=O)c2c(C)[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H16	compound treatment	1.152	-0.0966	-1.3	1.468	0.00646	0.09	-0.8592	-0.6578	1684499	CBDivE_009756	Cc1cccc(C)c1NC(=O)C(NC(=O)CN2C(=O)c3ccccc3C2=O)c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H17	compound treatment	1.22	-0.0286	-0.39	1.472	0.0105	0.14	-0.172	-0.4181	1330828	CBDivE_009757	CCOC(=O)c1c(CN(C)C)n(C)c2cc(Br)c(OC(=O)C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H18	compound treatment	1.26	0.0114	0.15	1.381	-0.0805	-1.1	-0.6679	-0.6022	1294611	CBDivE_009758	Cc1cccc(C)c1NC(=O)C2(CCCC2)NC(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H19	compound treatment	1.243	-0.0056	-0.08	1.496	0.0345	0.47	0.2788	0.5859	1918906	CBDivE_009759	Fc1ccccc1/C=N/Nc2nc3nonc3nc2N\N=C\c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	H20	compound treatment	1.217	-0.0316	-0.43	1.411	-0.0505	-0.69	-0.7888	-0.9733	1918907	CBDivE_009760	CC(NC(=O)c1ccccc1C(=O)O)C(=O)NC2(CCCCC2)C(=O)Nc3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I01	compound treatment	1.242	-0.0066	-0.09	1.45	-0.0115	-0.16	-0.1743	-0.9636	1918908	CBDivE_009761	[O-][N+](=O)c1ccc(/C=N/c2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I02	compound treatment	1.203	-0.0456	-0.62	1.465	0.00346	0.05	-0.4017	-0.651	1615058	CBDivE_009762	COc1ccc2CCC3C(N(N=C3c2c1)C(=O)C)c4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I03	compound treatment	1.311	0.0624	0.84	1.53	0.0685	0.93	1.2553	0.9987	1530313	CBDivE_009763	Clc1ccc(cc1)S(=O)(=O)N=S(=O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I04	compound treatment	1.204	-0.0446	-0.6	1.469	0.00746	0.1	-0.3536	-0.5794	1918909	CBDivE_009764	Oc1ccc(cc1C2NC(=O)c3c4CCCCc4sc3N2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I05	compound treatment	1.263	0.0144	0.19	1.506	0.0445	0.61	0.566	0.8891	1918910	CBDivE_009765	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C(/C)\c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I06	compound treatment	1.233	-0.0156	-0.21	1.483	0.0215	0.29	0.0581	0.1611	1918911	CBDivE_009766	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)CNc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I07	compound treatment	1.261	0.0124	0.17	1.52	0.0585	0.8	0.6819	0.8372	1918912	CBDivE_009767	COc1ccc(cc1)C(=O)N/N=C(\N)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I08	compound treatment	1.239	-0.0096	-0.13	1.499	0.0375	0.51	0.2696	0.5116	1118494	CBDivE_009768	CC(NC(=O)CN1CCCC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I09	compound treatment	1.294	0.0454	0.61	1.496	0.0345	0.47	0.7653	0.9914	1684112	CBDivE_009769	OC(=O)c1ccccc1C(=O)Nc2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I10	compound treatment	1.277	0.0284	0.38	1.466	0.00446	0.06	0.3139	0.8092	1490696	CBDivE_009770	OC(=O)c1ccc(NCn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I11	compound treatment	1.329	0.0804	1.08	1.522	0.0605	0.82	1.3499	0.9908	1445086	CBDivE_009771	Clc1cc(Cl)c(OC(=O)c2cccc3ccccc23)c(CNC(=O)c4ccccc4)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I12	compound treatment	1.242	-0.0066	-0.09	1.545	0.0835	1.14	0.7418	0.6498	1918913	CBDivE_009772	O=C(N/N=C/c1c[nH]c2ccccc12)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I13	compound treatment	1.345	0.0964	1.3	1.496	0.0345	0.47	1.2518	0.9053	1157305	CBDivE_009773	OC(=O)c1ccccc1NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I14	compound treatment	1.277	0.0284	0.38	1.467	0.00546	0.07	0.3235	0.829	1918914	CBDivE_009774	OC(=O)CCN1C(=O)/C(=C\c2ccc(o2)c3ccccc3)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I15	compound treatment	1.307	0.0584	0.79	1.515	0.0535	0.73	1.0725	0.9992	1918915	CBDivE_009775	[O-][N+](=O)c1ccc2NC(=O)/C(=N\NC(=O)C3CC43CCC4)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I16	compound treatment	1.272	0.0234	0.32	1.472	0.0105	0.14	0.324	0.9355	1918916	CBDivE_009776	C/C(=N/NC(=O)c1ccccn1)/c2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I17	compound treatment	1.348	0.0994	1.34	1.505	0.0435	0.59	1.3672	0.9326	1621655	CBDivE_009777	CC1(C)CC(CC(C)(C)N1)NC(=O)CN2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I18	compound treatment	1.247	-0.0016	-0.02	1.535	0.0735	1.0	0.693	0.6917	1918917	CBDivE_009778	OC(=O)CC[C@H](N1C(=O)c2cccc3cccc(C1=O)c23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I19	compound treatment	1.323	0.0744	1.0	1.473	0.0115	0.16	0.8202	0.8075	1918918	CBDivE_009779	Oc1c(Br)cc(Br)cc1C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	I20	compound treatment	1.283	0.0344	0.46	1.468	0.00646	0.09	0.3904	0.8265	1918919	CBDivE_009780	Cc1cccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J01	compound treatment	1.232	-0.0166	-0.22	1.431	-0.0305	-0.42	-0.4529	-0.9577	1185438	CBDivE_009781	O=C(N1CCOCC1)c2ccc(cc2)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J02	compound treatment	1.217	-0.0316	-0.43	1.479	0.0175	0.24	-0.1331	-0.2726	1918920	CBDivE_009782	CN(C)C(C)(C)c1nnnn1C(/C=C\c2ccc(Cl)cc2Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J03	compound treatment	1.168	-0.0806	-1.09	1.418	-0.0435	-0.59	-1.1887	-0.9595	1918921	CBDivE_009783	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C3(CCCCC3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J04	compound treatment	1.226	-0.0226	-0.3	1.474	0.0125	0.17	-0.0955	-0.2736	1918922	CBDivE_009784	OC(=O)CCCNC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J05	compound treatment	1.214	-0.0346	-0.47	1.48	0.0185	0.25	-0.1521	-0.2868	1607774	CBDivE_009785	CN(C)CCCN1CC(CC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J06	compound treatment	1.194	-0.0546	-0.74	1.397	-0.0645	-0.88	-1.1432	-0.9961	1558714	CBDivE_009786	CCOc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J07	compound treatment	1.268	0.0194	0.26	1.441	-0.0205	-0.28	-0.013	-0.034	1918923	CBDivE_009787	Cc1cccc(C)c1n2nnnc2C3(CCCCC3)Nc4ccc(F)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J08	compound treatment	1.256	0.0074	0.1	1.464	0.00246	0.03	0.0943	0.8954	1422759	CBDivE_009788	O=C(OCCn1cncn1)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J09	compound treatment	1.208	-0.0406	-0.55	1.484	0.0225	0.31	-0.1708	-0.2721	1918924	CBDivE_009789	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(NC2CCS(=O)(=O)C2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J10	compound treatment	1.218	-0.0306	-0.41	1.444	-0.0175	-0.24	-0.4611	-0.9663	1173546	CBDivE_009790	OC(=O)c1cccc(c1)n2c(=O)c3cc4c(=O)n(c5cccc(c5)C(=O)O)c(=O)c4cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J11	compound treatment	1.239	-0.0096	-0.13	1.431	-0.0305	-0.42	-0.3861	-0.8852	1918925	CBDivE_009791	COc1ccc2n(CC(O)CN3CCN(C)CC3)cc(CCNC(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J12	compound treatment	1.204	-0.0446	-0.6	1.465	0.00346	0.05	-0.3921	-0.6497	1226904	CBDivE_009792	C(C#Cc1ccccc1)N2CCN(CC2)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J13	compound treatment	1.258	0.0094	0.13	1.437	-0.0245	-0.33	-0.147	-0.4107	1918926	CBDivE_009793	Cc1ccccc1C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J14	compound treatment	1.208	-0.0406	-0.55	1.36	-0.102	-1.38	-1.3664	-0.9176	1918927	CBDivE_009794	CC(=NNS(=O)(=O)c1ccc(cc1)N2CCCC2=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J15	compound treatment	1.211	-0.0376	-0.51	1.504	0.0425	0.58	0.0507	0.0659	1918928	CBDivE_009795	COc1ccc(OCC(=O)c2c(C)n(C)c3ccc(OC)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J16	compound treatment	1.169	-0.0796	-1.07	1.449	-0.0125	-0.17	-0.8803	-0.8095	1129980	CBDivE_009796	CC(=O)Nc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J17	compound treatment	1.209	-0.0396	-0.53	1.473	0.0115	0.16	-0.2673	-0.4802	1918929	CBDivE_009797	O=C(NN=C1CCCC1)C(=O)NN=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J18	compound treatment	1.157	-0.0916	-1.24	1.398	-0.0635	-0.87	-1.4865	-0.9849	1918930	CBDivE_009798	COc1ccccc1/C=N/NC(=O)COc2ccc(Cl)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J19	compound treatment	1.2	-0.0486	-0.66	1.504	0.0425	0.58	-0.0542	-0.062	1918931	CBDivE_009799	[O-][N+](=O)c1cccc(Oc2ccc(cc2)c3ccc(Oc4cccc(c4)[N+](=O)[O-])cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	J20	compound treatment	1.254	0.0054	0.07	1.454	-0.00754	-0.1	-0.0212	-0.1685	1918932	CBDivE_009800	CCOc1ccc(/C=N/NC(=O)c2ccn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K01	compound treatment	1.306	0.0574	0.77	1.497	0.0355	0.48	0.8894	0.9743	1607283	CBDivE_009801	C1CN(CCN1)c2nc(nc(n2)N3CCOCC3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K02	compound treatment	1.254	0.0054	0.07	1.449	-0.0125	-0.17	-0.0694	-0.3736	1918933	CBDivE_009802	CCN(CC)c1ccc(/C=N/c2ccc(C)cc2C)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K03	compound treatment	1.251	0.0024	0.03	1.513	0.0515	0.7	0.5191	0.7389	1918934	CBDivE_009803	Clc1ccc(/N=C\2/C(=O)Nc3ccccc23)c(c1)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K04	compound treatment	1.221	-0.0276	-0.37	1.464	0.00246	0.03	-0.2396	-0.6409	1337597	CBDivE_009804	O=C(CCN1CCCCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K05	compound treatment	1.317	0.0684	0.92	1.49	0.0285	0.39	0.9269	0.9259	1918935	CBDivE_009805	Cc1nc(Cc2ccccc2)c(C)nc1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K06	compound treatment	1.234	-0.0146	-0.2	1.51	0.0485	0.66	0.328	0.4756	1397073	CBDivE_009806	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCN5CCCC5C4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K07	compound treatment	1.239	-0.0096	-0.13	1.474	0.0125	0.17	0.0285	0.1335	1918936	CBDivE_009807	Oc1cccc(c1)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K08	compound treatment	1.233	-0.0156	-0.21	1.473	0.0115	0.16	-0.0384	-0.1463	1488054	CBDivE_009808	CCN(CC)S(=O)(=O)c1cc(ccc1Br)C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K09	compound treatment	1.257	0.0084	0.11	1.502	0.0405	0.55	0.4702	0.8349	1918937	CBDivE_009809	OC(=O)C1CCCN1Cc2c(O)ccc(C(=O)COc3ccccc3F)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K10	compound treatment	1.26	0.0114	0.15	1.503	0.0415	0.57	0.5085	0.8679	1918938	CBDivE_009810	CC(C)N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K11	compound treatment	1.29	0.0414	0.56	1.472	0.0105	0.14	0.4957	0.8601	1526595	CBDivE_009811	Fc1ccc(CN(C(=O)COc2ccc3ccccc3c2)c4ccc(I)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K12	compound treatment	1.234	-0.0146	-0.2	1.455	-0.00654	-0.09	-0.2024	-0.9358	1918939	CBDivE_009812	CCn1c(C)nc2cc(ccc12)S(=O)(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K13	compound treatment	1.24	-0.0086	-0.12	1.513	0.0515	0.7	0.4141	0.5823	1256595	CBDivE_009813	O=C(N1CCOCC1)c2ccccc2N3C(=O)c4cccc5cccc(C3=O)c45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K14	compound treatment	1.219	-0.0296	-0.4	1.493	0.0315	0.43	0.0209	0.0357	1918940	CBDivE_009814	Cc1ccc(cc1)S(=O)(=O)C(C(=O)Nc2ccccc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K15	compound treatment	1.333	0.0844	1.14	1.521	0.0595	0.81	1.3784	0.9862	1918941	CBDivE_009815	CN1CCN(CC1)C(=O)C(F)(F)C2(F)OC(F)(F)C(F)(F)C2(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K16	compound treatment	1.265	0.0164	0.22	1.506	0.0445	0.61	0.5851	0.9067	1918942	CBDivE_009816	[O-][N+](=O)c1cccc(c1)c2ccc(C=C3C(=O)NC(=O)NC3=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K17	compound treatment	1.295	0.0464	0.63	1.519	0.0575	0.78	0.9966	0.9938	1139961	CBDivE_009817	CC(C)c1ccc(C)cc1Oc2ccc(cc2)c3nc(N)nc(N)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K18	compound treatment	1.251	0.0024	0.03	1.447	-0.0145	-0.2	-0.1173	-0.584	1918943	CBDivE_009818	OC(=O)CSc1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K19	compound treatment	1.298	0.0494	0.67	1.56	0.0985	1.34	1.4206	0.9478	1918944	CBDivE_009819	Cc1ccc(OCC(=O)N/N=C/c2cc(=O)[nH]c(=O)[nH]2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	K20	compound treatment	1.285	0.0364	0.49	1.517	0.0555	0.76	0.882	0.9781	1918945	CBDivE_009820	[O-][N+](=O)c1cccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L01	compound treatment	1.228	-0.0206	-0.28	1.436	-0.0255	-0.35	-0.4428	-0.9937	1918946	CBDivE_009821	CN(C)C(c1nnnn1c2c(C)cccc2C)c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L02	compound treatment	1.209	-0.0396	-0.53	1.386	-0.0755	-1.03	-1.1062	-0.9533	1918947	CBDivE_009822	O=C(Nc1ccccc1c2ccccc2NC(=O)C3(CC4CC5CC(C4)C3)C5)C6(CC7CC8CC(C7)C6)C8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L03	compound treatment	1.247	-0.0016	-0.02	1.436	-0.0255	-0.35	-0.2616	-0.7495	1918948	CBDivE_009823	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C3(CCCCC3)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L04	compound treatment	1.193	-0.0556	-0.75	1.396	-0.0655	-0.89	-1.1624	-0.9962	1918949	CBDivE_009824	Cc1cccc(C)c1N2CCc3cnn(c23)S(=O)(=O)c4ccccc4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L05	compound treatment	1.149	-0.0996	-1.34	1.493	0.0315	0.43	-0.6468	-0.4586	1619958	CBDivE_009825	COC(=O)c1ccc(cc1)N2C(=O)c3ccc(cc3C2=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L06	compound treatment	1.244	-0.0046	-0.06	1.402	-0.0595	-0.81	-0.618	-0.759	1918950	CBDivE_009826	C=CCOC(=O)CCCC(=O)NC1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L07	compound treatment	1.188	-0.0606	-0.82	1.457	-0.00454	-0.06	-0.6219	-0.7585	1591501	CBDivE_009827	CCC(C)(NC(=O)CN1C(=O)c2ccccc2C1=O)C(=O)Nc3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L08	compound treatment	1.188	-0.0606	-0.82	1.421	-0.0405	-0.55	-0.969	-0.9819	1918951	CBDivE_009828	Cc1ccc(/C=N/CCCCCC\N=C\c2ccc(C)o2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L09	compound treatment	1.227	-0.0216	-0.29	1.445	-0.0165	-0.23	-0.3656	-0.992	1918952	CBDivE_009829	Clc1cccc(c1)C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L10	compound treatment	1.216	-0.0326	-0.44	1.389	-0.0725	-0.99	-1.0105	-0.9334	1447683	CBDivE_009830	COC(=O)c1ccc(cc1)n2c(=O)c3cc4c(=O)n(c5ccc(cc5)C(=O)OC)c(=O)c4cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L11	compound treatment	1.214	-0.0346	-0.47	1.431	-0.0305	-0.42	-0.6246	-0.9984	1918953	CBDivE_009831	O=C(NCc1ccncc1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L12	compound treatment	1.215	-0.0336	-0.45	1.418	-0.0435	-0.59	-0.7404	-0.9911	1918954	CBDivE_009832	[O-][N+](=O)c1cc([N+](=O)[O-])c2Oc3ccccc3Oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L13	compound treatment	1.289	0.0404	0.54	1.468	0.00646	0.09	0.4476	0.8108	1918955	CBDivE_009833	CCN(CC)C(NC(=O)c1ccccc1C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L14	compound treatment	1.25	0.0014	0.02	1.432	-0.0295	-0.4	-0.2715	-0.6733	1918956	CBDivE_009834	C1C2N(N=C1c3ccccc3)C(Oc4ccccc24)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L15	compound treatment	1.256	0.0074	0.1	1.374	-0.0875	-1.19	-0.7735	-0.6457	1918957	CBDivE_009835	O=C(NNC(=O)c1cccnc1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L16	compound treatment	1.214	-0.0346	-0.47	1.416	-0.0455	-0.62	-0.7692	-0.9901	1918958	CBDivE_009836	Clc1cccc(CC2SC(=N)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L17	compound treatment	1.255	0.0064	0.09	1.473	0.0115	0.16	0.1715	0.9609	1918959	CBDivE_009837	COc1ccc2CCC3C(N(N=C3c2c1)/C(=C/C(=O)C)/C)c4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L18	compound treatment	1.22	-0.0286	-0.39	1.424	-0.0375	-0.51	-0.6348	-0.9903	1918960	CBDivE_009838	CCOc1ccc(/C=N/NC(=O)c2[nH]ncc2I)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L19	compound treatment	1.26	0.0114	0.15	1.498	0.0365	0.5	0.4603	0.8845	1287387	CBDivE_009839	OCC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	L20	compound treatment	1.196	-0.0526	-0.71	1.469	0.00746	0.1	-0.4299	-0.5996	1918961	CBDivE_009840	Cc1ccc(NC(=O)NC(CC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M01	compound treatment	1.298	0.0494	0.67	1.5	0.0385	0.52	0.842	0.993	1918962	CBDivE_009841	Cc1cc(C)n(/N=C\c2ccc(cc2)[N+](=O)[O-])c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M02	compound treatment	1.193	-0.0556	-0.75	1.443	-0.0185	-0.25	-0.7092	-0.8959	1918963	CBDivE_009842	COc1ccc(NC(=O)C(=O)NC(=O)c2[nH]nc(C)c2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M03	compound treatment	1.247	-0.0016	-0.02	1.486	0.0245	0.33	0.2206	0.6599	1918964	CBDivE_009843	CN(C)c1cc(N)c2cccc(C)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M04	compound treatment	1.21	-0.0386	-0.52	1.455	-0.00654	-0.09	-0.4313	-0.8164	1740646	CBDivE_009844	Clc1c(sc2ccccc12)C(=O)Nc3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M05	compound treatment	1.347	0.0984	1.33	1.463	0.00146	0.02	0.9527	0.7176	1918965	CBDivE_009845	[O-][N+](=O)c1ccc(/C=N/NC(=O)Nc2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M06	compound treatment	1.199	-0.0496	-0.67	1.471	0.00946	0.13	-0.382	-0.5605	1918966	CBDivE_009846	CCNCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC(C)C)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M07	compound treatment	1.315	0.0664	0.9	1.488	0.0265	0.36	0.8885	0.9201	1918967	CBDivE_009847	C(N(c1ccccc1)c2ccccc2)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M08	compound treatment	1.25	0.0014	0.02	1.429	-0.0325	-0.44	-0.3004	-0.6764	1918968	CBDivE_009848	CCCCC1(CCCCC1)OC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M09	compound treatment	1.257	0.0084	0.11	1.493	0.0315	0.43	0.3834	0.8642	1918969	CBDivE_009849	CN(C)c1cc(/N=C/2\CCCN2c3ccc(Cl)c(Cl)c3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M10	compound treatment	1.243	-0.0056	-0.08	1.453	-0.00854	-0.12	-0.1358	-0.9781	1918970	CBDivE_009850	CCc1nnc(NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M11	compound treatment	1.277	0.0284	0.38	1.461	-5.42E-4	-0.01	0.2657	0.6933	1679931	CBDivE_009851	Fc1ccc(cc1)S(=O)(=NS(=O)(=O)c2ccc(Cl)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M12	compound treatment	1.239	-0.0096	-0.13	1.411	-0.0505	-0.69	-0.5789	-0.8256	1918971	CBDivE_009852	O(c1ccccc1)c2ccc(C#Cc3ccc(cc3)c4nc5ccccc5nc4c6ccc(C#Cc7ccc(Oc8ccccc8)cc7)cc6)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M13	compound treatment	1.266	0.0174	0.23	1.515	0.0535	0.73	0.6814	0.8898	1918972	CBDivE_009853	Clc1ccccc1NC(=O)CCCN2C(=O)/C(=C/3\SC(=S)N(CCCC(=O)Nc4ccccc4Cl)C3=O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M14	compound treatment	1.261	0.0124	0.17	1.471	0.00946	0.13	0.2095	0.9917	1918973	CBDivE_009854	Clc1ccc(cc1)S(=O)(=O)C(C(=O)Nc2ccccc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M15	compound treatment	1.304	0.0554	0.75	1.454	-0.00754	-0.1	0.4557	0.6041	3107029	CBDivE_009855	CN(C)c1cc(N)c2ccccc2n1.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M16	compound treatment	1.257	0.0084	0.11	1.484	0.0225	0.31	0.2967	0.9085	1918974	CBDivE_009856	Cc1ccccc1C(=O)NC(Nc2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M17	compound treatment	1.319	0.0704	0.95	1.496	0.0345	0.47	1.0038	0.9473	1918975	CBDivE_009857	Cc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M18	compound treatment	1.249	3.98E-4	0.01	1.485	0.0235	0.32	0.23	0.7189	1918976	CBDivE_009858	Clc1ccc(cc1)S(=N)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M19	compound treatment	1.297	0.0484	0.65	1.554	0.0925	1.26	1.3532	0.9531	1918977	CBDivE_009859	Fc1cccc(NC(=O)CCC(=O)OCC=C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	M20	compound treatment	1.251	0.0024	0.03	1.488	0.0265	0.36	0.278	0.7674	1918978	CBDivE_009860	Oc1cccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N01	compound treatment	1.194	-0.0546	-0.74	1.412	-0.0495	-0.68	-0.9986	-0.9991	1918979	CBDivE_009861	Cc1cccc(C)c1n2nnnc2C3(CCCC3)Nc4cccc(O)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N02	compound treatment	1.189	-0.0596	-0.8	1.4	-0.0615	-0.84	-1.162	-0.9998	1918980	CBDivE_009862	CCOC(=O)c1c(NC(=O)C)sc([N+](=O)[O-])c1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N03	compound treatment	1.251	0.0024	0.03	1.398	-0.0635	-0.87	-0.5898	-0.6802	1918981	CBDivE_009863	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C3(CCCC3)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N04	compound treatment	1.187	-0.0616	-0.83	1.331	-0.131	-1.78	-1.8464	-0.9398	1918982	CBDivE_009864	[O-][N+](=O)c1cc(ccc1N2CCCC2=O)S(=O)(=O)Nc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N05	compound treatment	1.262	0.0134	0.18	1.415	-0.0465	-0.63	-0.321	-0.4864	1918983	CBDivE_009865	COc1ccc(NC(=S)NC(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N06	compound treatment	1.247	-0.0016	-0.02	1.407	-0.0545	-0.74	-0.5412	-0.7273	1305537	CBDivE_009866	O=C(CCc1ccccc1)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N07	compound treatment	1.177	-0.0716	-0.97	1.455	-0.00654	-0.09	-0.7461	-0.7691	1918984	CBDivE_009867	CC1(C)SC(=S)N(NC(=O)Nc2ccc(Cl)cc2)C1N(O)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N08	compound treatment	1.157	-0.0916	-1.24	1.387	-0.0745	-1.02	-1.5926	-0.9953	1137147	CBDivE_009868	CCN(CC)C(=O)C1(O)N(C(=O)Nc2ccccc21)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N09	compound treatment	1.173	-0.0756	-1.02	1.409	-0.0525	-0.72	-1.2278	-0.9851	1918985	CBDivE_009869	CC(C)(C)NC(NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N10	compound treatment	1.217	-0.0316	-0.43	1.433	-0.0285	-0.39	-0.5767	-0.999	1786058	CBDivE_009870	[O-][N+](=O)c1ccc(cc1)C(=O)Oc2ccc(C(=O)c3ccccc3)c(OC(=O)c4ccc(cc4)[N+](=O)[O-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N11	compound treatment	1.209	-0.0396	-0.53	1.41	-0.0515	-0.7	-0.8748	-0.9908	1918986	CBDivE_009871	CC(=O)Nc1cc(ccc1NCc2ccccc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N12	compound treatment	1.177	-0.0716	-0.97	1.376	-0.0855	-1.17	-1.5079	-0.9956	1918987	CBDivE_009872	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)C(C)N4CCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N13	compound treatment	1.256	0.0074	0.1	1.432	-0.0295	-0.4	-0.2143	-0.5163	1918988	CBDivE_009873	CC(=NNC(=O)CNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N14	compound treatment	1.205	-0.0436	-0.59	1.405	-0.0565	-0.77	-0.9611	-0.9911	1918871	CBDivE_009874	[O-][N+](=O)c1cccc(c1)N(Cc2ccccc2)C(=O)CCCCCN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N15	compound treatment	1.171	-0.0776	-1.05	1.395	-0.0665	-0.91	-1.3819	-0.9975	1918989	CBDivE_009875	OC(=O)c1cc(/N=C/c2c3ccccc3cc4ccccc24)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N16	compound treatment	1.254	0.0054	0.07	1.393	-0.0685	-0.93	-0.6094	-0.65	1918990	CBDivE_009876	c1csc(c1)c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N17	compound treatment	1.184	-0.0646	-0.87	1.434	-0.0275	-0.38	-0.8818	-0.9292	1918991	CBDivE_009877	[O-][N+](=O)c1ccc2NC(=O)/C(=N\NC(=O)C3C4CCCCC34)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N18	compound treatment	1.274	0.0254	0.34	1.385	-0.0765	-1.04	-0.4958	-0.4513	1918992	CBDivE_009878	Oc1ccc(/C=N/NC(=O)c2ccn[nH]2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N19	compound treatment	1.215	-0.0336	-0.45	1.486	0.0245	0.33	-0.0847	-0.1505	1918993	CBDivE_009879	Oc1ccc(O)c(c1)[S+]2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	N20	compound treatment	1.203	-0.0456	-0.62	1.416	-0.0455	-0.62	-0.8741	-1.0	1918994	CBDivE_009880	OCCCNC(=O)C1CC=CCC1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O01	compound treatment	1.285	0.0364	0.49	1.504	0.0425	0.58	0.7566	0.9966	1918995	CBDivE_009881	Oc1c(Br)cc(/C=N/c2ccc3oc(nc3c2)c4cccc(Br)c4)c(O)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O02	compound treatment	1.205	-0.0436	-0.59	1.484	0.0225	0.31	-0.1994	-0.3007	1361636	CBDivE_009882	Brc1ccc(NC(=O)c2ccc(Br)c(c2)S(=O)(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O03	compound treatment	1.299	0.0504	0.68	1.534	0.0725	0.99	1.1794	0.9834	1391954	CBDivE_009883	CCC(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O04	compound treatment	1.286	0.0374	0.5	1.471	0.00946	0.13	0.4479	0.8602	1918996	CBDivE_009884	FC(F)(F)c1cccc(c1)c2ccc(/C=N/NC(=O)CNc3ccc4ccccc4c3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O05	compound treatment	1.276	0.0274	0.37	1.488	0.0265	0.36	0.5165	0.9999	1918997	CBDivE_009885	CC(=O)Nc1ccc(cc1)/C(=N/Nc2ncnc3sc4CCCCc4c23)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O06	compound treatment	1.222	-0.0266	-0.36	1.453	-0.00854	-0.12	-0.3361	-0.8909	1731071	CBDivE_009886	Cc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1NC(=O)COc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O07	compound treatment	1.268	0.0194	0.26	1.462	4.58E-4	0.01	0.1895	0.7238	1918998	CBDivE_009887	Ic1ccc(NCn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O08	compound treatment	1.277	0.0284	0.38	1.486	0.0245	0.33	0.5067	0.9976	1918999	CBDivE_009888	CC1CCC/C(=N/NC(=O)C2CC2c3ccccc3)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O09	compound treatment	1.309	0.0604	0.81	1.487	0.0255	0.35	0.8216	0.9277	1919000	CBDivE_009889	CSCCC(NC(=O)C(F)(F)C(F)(F)Cl)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O10	compound treatment	1.198	-0.0506	-0.68	1.461	-5.42E-4	-0.01	-0.4879	-0.7147	1919001	CBDivE_009890	Clc1ccc(NC(=O)OCCNS(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O11	compound treatment	1.338	0.0894	1.21	1.482	0.0205	0.28	1.0501	0.8483	1919002	CBDivE_009891	Fc1c(F)c(F)c(NS(=O)(=O)C2CCS(=O)(=O)C2)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O12	compound treatment	1.261	0.0124	0.17	1.484	0.0225	0.31	0.3348	0.9595	1919003	CBDivE_009892	S(c1ccccc1)c2ccc(C#Cc3cccc(c3)c4nc5ccccc5nc4c6cccc(C#Cc7ccc(Sc8ccccc8)cc7)c6)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O13	compound treatment	1.261	0.0124	0.17	1.5	0.0385	0.52	0.4891	0.8885	1064750	CBDivE_009893	Clc1ccccc1c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O14	compound treatment	1.213	-0.0356	-0.48	1.464	0.00246	0.03	-0.3159	-0.6562	1919004	CBDivE_009894	Cc1cc(C)cc(Nc2ccc(cc2[N+](=O)[O-])S(=O)(=O)CS(=O)(=O)c3ccc(Nc4cc(C)cc(C)c4)c(c3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O15	compound treatment	1.329	0.0804	1.08	1.489	0.0275	0.37	1.0317	0.8991	1919005	CBDivE_009895	Oc1ccc(N=Nc2ccccc2)cc1/C=N/NC(=O)Cc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O16	compound treatment	1.276	0.0274	0.37	1.482	0.0205	0.28	0.4586	0.9904	1919006	CBDivE_009896	Cc1ccc(NC2(CCCCC2)c3nnnn3C(/C=C\c4ccc(Cl)cc4Cl)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O17	compound treatment	1.302	0.0534	0.72	1.567	0.105	1.44	1.5262	0.9489	1919007	CBDivE_009897	Cc1cc(C)n(/N=C\c2ccc(Cl)cc2Cl)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O18	compound treatment	1.236	-0.0126	-0.17	1.517	0.0555	0.76	0.4145	0.5348	1919008	CBDivE_009898	COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2CN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O19	compound treatment	1.333	0.0844	1.14	1.515	0.0535	0.73	1.3206	0.9768	1919009	CBDivE_009899	CCN(CC)CCNCC(=O)N1c2ccccc2CCc3ccc(NC(=O)OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	O20	compound treatment	1.185	-0.0636	-0.86	1.486	0.0245	0.33	-0.3709	-0.4029	1919010	CBDivE_009900	Cc1cccc(C)c1n2nnnc2C(N3CCOCC3)c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P01	compound treatment	1.226	-0.0226	-0.3	1.425	-0.0365	-0.5	-0.568	-0.9722	1321136	CBDivE_009901	CN1C2CCC1CC(C2)NC(=O)N3c4ccccc4CCc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P02	compound treatment	1.191	-0.0576	-0.78	1.399	-0.0625	-0.85	-1.1525	-0.9989	1404703	CBDivE_009902	CC(C)C(CO)NC(=O)Oc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P03	compound treatment	1.248	-6.02E-4	-0.01	1.34	-0.122	-1.66	-1.1777	-0.7106	1919011	CBDivE_009903	Cc1ccc(NC(C)(C)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P04	compound treatment	1.163	-0.0856	-1.15	1.41	-0.0515	-0.7	-1.3136	-0.9717	1777144	CBDivE_009904	[O-][N+](=O)c1cccc(c1)C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P05	compound treatment	1.215	-0.0336	-0.45	1.391	-0.0705	-0.96	-1.0007	-0.9411	1919012	CBDivE_009905	FC(F)(F)c1ccc(Cl)c(NC(NC(=O)c2ccccc2)C(=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P06	compound treatment	1.174	-0.0746	-1.01	1.416	-0.0455	-0.62	-1.1508	-0.9731	1919013	CBDivE_009906	CCCCC/C=C/C(=O)Nc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P07	compound treatment	1.186	-0.0626	-0.84	1.414	-0.0475	-0.65	-1.0556	-0.9915	1919014	CBDivE_009907	COc1ccc(NC2(CCCC2)c3nnnn3c4c(C)cccc4C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P08	compound treatment	1.211	-0.0376	-0.51	1.393	-0.0685	-0.93	-1.0196	-0.9588	1919015	CBDivE_009908	CCC(C(Nc1ccccc1)c2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P09	compound treatment	1.128	-0.121	-1.63	1.352	-0.11	-1.49	-2.2067	-0.9991	1919016	CBDivE_009909	CC(C)C(=O)NC(NCc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P10	compound treatment	0.534	-0.715	-9.64	0.984	-0.478	-6.51	-11.4215	-0.9818	1919017	CBDivE_009910	CN1CCN(CC(=O)N2c3ccccc3C=Cc4ccccc24)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P11	compound treatment	1.212	-0.0366	-0.49	1.389	-0.0725	-0.99	-1.0486	-0.9485	1919018	CBDivE_009911	COc1ccc2S/C(=C/3\S/C(=N\c4ncn[nH]4)/N(CC=C)C3=O)/N(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P12	compound treatment	1.186	-0.0626	-0.84	1.317	-0.145	-1.97	-1.9909	-0.9284	1542719	CBDivE_009912	CC(=O)Nc1c2ccccc2n3c(C)nc4c5ccccc5[nH]c4c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P13	compound treatment	1.205	-0.0436	-0.59	1.413	-0.0485	-0.66	-0.884	-0.9983	1919019	CBDivE_009913	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCC(=O)N/N=C/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P14	compound treatment	1.184	-0.0646	-0.87	1.424	-0.0375	-0.51	-0.9783	-0.9678	1779039	CBDivE_009914	[O-][N+](=O)c1ccc(Oc2c(Br)cc(Br)c3cccnc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P15	compound treatment	1.269	0.0204	0.28	1.423	-0.0385	-0.53	-0.1771	-0.2984	1919020	CBDivE_009915	C/C(=N\NC(=O)C1CC1c2ccccc2)/c3cccc(N)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P16	compound treatment	1.22	-0.0286	-0.39	1.417	-0.0445	-0.61	-0.7023	-0.976	1536708	CBDivE_009916	CCOC(=O)c1c(C)oc2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P17	compound treatment	1.191	-0.0576	-0.78	1.377	-0.0845	-1.15	-1.3647	-0.9816	1919021	CBDivE_009917	COc1ccccc1NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P18	compound treatment	1.107	-0.142	-1.91	1.422	-0.0395	-0.54	-1.7321	-0.8726	1919022	CBDivE_009918	Oc1ccc(/C=N/NC(=O)CNS(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P19	compound treatment	1.25	0.0014	0.02	1.424	-0.0375	-0.51	-0.3487	-0.6806	1919023	CBDivE_009919	CC(=O)O/N=C(\NCc1ccccc1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.31	P20	compound treatment	1.217	-0.0316	-0.43	1.38	-0.0815	-1.11	-1.0877	-0.9134	1919024	CBDivE_009920	Cn1nc(c2ccccc2)c3c(cc(C(=O)C(F)(F)F)c3c1c4ccccc4)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A01	compound treatment	1.275	0.026	0.35	1.449	-0.00483	-0.07	0.2014	0.5645	1919025	CBDivE_009921	FC(F)(F)c1cccc(NC(=O)COc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A02	compound treatment	1.29	0.041	0.55	1.458	0.00417	0.06	0.4313	0.7758	1340146	CBDivE_009922	COc1cc2CCNC(c3ccc(O)cc3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A03	compound treatment	1.293	0.044	0.59	1.485	0.0312	0.43	0.7203	0.9866	1919026	CBDivE_009923	C=CCn1nc(c2ccccc2)c3cccc3c1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A04	compound treatment	1.303	0.054	0.73	1.453	-8.28E-4	-0.01	0.5071	0.6961	1140418	CBDivE_009924	OC(=O)c1nccnc1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A05	compound treatment	1.321	0.072	0.97	1.48	0.0262	0.36	0.9392	0.9076	1919027	CBDivE_009925	Cc1n[nH]c(Nc2cccc(c2)C(=O)O)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A06	compound treatment	1.27	0.021	0.28	1.43	-0.0238	-0.32	-0.0295	-0.0683	1310853	CBDivE_009926	Fc1ccc(NS(=O)(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A07	compound treatment	1.393	0.144	1.94	1.507	0.0532	0.73	1.8863	0.9097	1919028	CBDivE_009927	COC(=O)C(CCCCCCC(C(=O)OC)C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A08	compound treatment	1.32	0.071	0.96	1.539	0.0852	1.16	1.4985	0.9954	1919029	CBDivE_009928	CC(=O)OC(CC(=O)c1ccc(Cl)cc1Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A09	compound treatment	1.321	0.072	0.97	1.414	-0.0398	-0.54	0.3028	0.2721	1919030	CBDivE_009929	Cc1[nH]c2ccccc2c1c3c4ccccc4nc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A10	compound treatment	1.299	0.05	0.67	1.438	-0.0158	-0.22	0.3243	0.458	1566704	CBDivE_009930	COc1cc2c(CC(=O)Nc3ccccc3)c(O)c(C)c(NCc4ccccc4)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A11	compound treatment	1.289	0.04	0.54	1.538	0.0842	1.15	1.1932	0.9408	1475849	CBDivE_009931	Cc1cccc(C)c1NC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A12	compound treatment	1.284	0.035	0.47	1.502	0.0482	0.66	0.7983	0.9869	1919031	CBDivE_009932	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(Nc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A13	compound treatment	1.328	0.079	1.07	1.489	0.0352	0.48	1.0927	0.935	1548239	CBDivE_009933	Clc1ccc(NC(=O)CSc2nsc(SCC(=O)Nc3ccc(Cl)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A14	compound treatment	1.255	0.006	0.08	1.481	0.0272	0.37	0.3192	0.8417	1919032	CBDivE_009934	COc1cc(ccc1N=NNc2ccccc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A15	compound treatment	1.249	-3.13E-6	0.0	1.504	0.0502	0.68	0.4838	0.7071	1919033	CBDivE_009935	Oc1ccccc1/C=N\Nc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A16	compound treatment	1.219	-0.03	-0.4	1.469	0.0152	0.21	-0.1399	-0.3078	1919034	CBDivE_009936	COc1ccc(cc1)C(=O)N/N=C(/CC(C(=O)O)C2=CNC3C=CC=CC32)\c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A17	compound treatment	1.36	0.111	1.5	1.508	0.0542	0.74	1.5812	0.947	1919035	CBDivE_009937	[O-][N+](=O)c1ccc(cc1)C(=O)Oc2c(Cl)cc(Cl)c(Cl)c2CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A18	compound treatment	1.272	0.023	0.31	1.393	-0.0608	-0.83	-0.3672	-0.4146	1919036	CBDivE_009938	O=C(NCc1ccccc1)c2ccccc2C(=O)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A19	compound treatment	1.285	0.036	0.49	1.534	0.0802	1.09	1.1164	0.9333	1400280	CBDivE_009939	OC(=O)C1(CC1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	A20	compound treatment	1.197	-0.052	-0.7	1.444	-0.00983	-0.13	-0.5908	-0.8272	1035127	CBDivE_009940	O=C(NN=c1c(=O)c2ccccc2c1=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B01	compound treatment	1.259	0.01	0.13	1.384	-0.0698	-0.95	-0.5779	-0.601	1569880	CBDivE_009941	COc1cc2C(CC(=O)Nc3ccccc3)C(=O)N(N=C(C)c2cc1OC)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B02	compound treatment	1.327	0.078	1.05	1.455	0.00117	0.02	0.7553	0.7178	1919037	CBDivE_009942	Clc1ccccc1/C=N/NC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B03	compound treatment	1.251	0.002	0.03	1.407	-0.0468	-0.64	-0.4325	-0.6767	1919038	CBDivE_009943	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B04	compound treatment	1.241	-0.008	-0.11	1.457	0.00317	0.04	-0.0458	-0.3934	1919039	CBDivE_009944	CC(=O)CC(CC(=O)O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B05	compound treatment	1.229	-0.02	-0.27	1.435	-0.0188	-0.26	-0.3724	-0.9997	1919040	CBDivE_009945	CN1CCN(CC(=O)N2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B06	compound treatment	1.211	-0.038	-0.51	1.417	-0.0368	-0.5	-0.7176	-0.9999	1919041	CBDivE_009946	Brc1cccc(c1)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B07	compound treatment	1.275	0.026	0.35	1.458	0.00417	0.06	0.2882	0.8112	1517313	CBDivE_009947	CC(=O)Oc1ccccc1N2C(=O)c3ccc(N)cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B08	compound treatment	1.327	0.078	1.05	1.378	-0.0758	-1.03	0.0129	0.0087	1919042	CBDivE_009948	CC1(CCC2(C)CC1)C3C2C(=O)NNC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B09	compound treatment	1.196	-0.053	-0.72	1.446	-0.00783	-0.11	-0.5811	-0.8038	1919043	CBDivE_009949	CCOc1ccc(cc1)c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B10	compound treatment	1.328	0.079	1.07	1.464	0.0102	0.14	0.8517	0.7925	1706415	CBDivE_009950	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)N4C(=O)c5ccc(cc5C4=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B11	compound treatment	1.223	-0.026	-0.35	1.414	-0.0398	-0.54	-0.6321	-0.9776	1919044	CBDivE_009951	O=C1CCN(N1C2c3ccccc3Oc4ccccc24)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B12	compound treatment	1.243	-0.006	-0.08	1.428	-0.0258	-0.35	-0.3063	-0.8476	1631702	CBDivE_009952	Oc1ccc(Br)cc1C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B13	compound treatment	1.273	0.024	0.32	1.336	-0.118	-1.61	-0.9072	-0.5535	1919045	CBDivE_009953	O=C(CN1CCCC1)N2c3ccccc3C=Cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B14	compound treatment	1.215	-0.034	-0.46	1.462	0.00817	0.11	-0.2456	-0.5202	1535577	CBDivE_009954	S=C(NC1(CC2CC3CC(C2)C1)C3)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B15	compound treatment	1.268	0.019	0.26	1.422	-0.0318	-0.43	-0.1257	-0.2493	1919046	CBDivE_009955	CC(=O)c1cc(cc(C(=O)C)c1O)C(C)(C)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B16	compound treatment	1.223	-0.026	-0.35	1.429	-0.0248	-0.34	-0.4875	-0.9998	1919047	CBDivE_009956	FC(F)(F)COc1nc(NCc2ccccc2)nc(OCC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B17	compound treatment	1.234	-0.015	-0.2	1.433	-0.0208	-0.28	-0.3439	-0.9862	1281300	CBDivE_009957	COc1ccccc1C(=O)NC2c3ccccc3Oc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B18	compound treatment	1.219	-0.03	-0.4	1.468	0.0142	0.19	-0.1496	-0.3334	1556147	CBDivE_009958	CCc1ccc(cc1)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B19	compound treatment	1.257	0.008	0.11	1.386	-0.0678	-0.92	-0.5777	-0.6204	1919048	CBDivE_009959	COc1ccccc1Nc2nc(OCC(F)(F)F)nc(OCC(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	B20	compound treatment	1.18	-0.069	-0.93	1.442	-0.0118	-0.16	-0.7723	-0.8174	1919049	CBDivE_009960	Cc1cc(C)n(n1)c2cc(C)nc(n2)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C01	compound treatment	1.223	-0.026	-0.35	1.42	-0.0338	-0.46	-0.5742	-0.9909	1075894	CBDivE_009961	COc1ccccc1NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C02	compound treatment	1.251	0.002	0.03	1.461	0.00717	0.1	0.0882	0.8695	1774771	CBDivE_009962	COc1cc2CCNC(c3ccc(cc3)[N+](=O)[O-])c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C03	compound treatment	1.374	0.125	1.69	1.495	0.0412	0.56	1.5894	0.8943	1919050	CBDivE_009963	C/C(=N\OCO\N=C(\C)/c1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C04	compound treatment	1.246	-0.003	-0.04	1.427	-0.0268	-0.37	-0.2873	-0.7806	1919051	CBDivE_009964	COc1cc2C(CC(=O)Nc3ccccc3)C(=O)N(Cc4ccccc4)N=C(C)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C05	compound treatment	1.266	0.017	0.23	1.534	0.0802	1.09	0.9352	0.8372	1919052	CBDivE_009965	CC(C)c1ccc(cc1)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C06	compound treatment	1.264	0.015	0.2	1.478	0.0242	0.33	0.3761	0.9725	1919053	CBDivE_009966	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3cc(OC)ccc23)C1c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C07	compound treatment	1.287	0.038	0.51	1.468	0.0142	0.19	0.4991	0.9111	1255477	CBDivE_009967	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C08	compound treatment	1.233	-0.016	-0.22	1.462	0.00817	0.11	-0.0739	-0.304	1628315	CBDivE_009968	Nc1c(Cl)ncnc1N2CCN(CC2)c3ncnc(Cl)c3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C09	compound treatment	1.265	0.016	0.22	1.497	0.0432	0.59	0.5689	0.9073	1919054	CBDivE_009969	C/C(=N/Nc1nc2ccccc2s1)/N=Nc3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C10	compound treatment	1.281	0.032	0.43	1.51	0.0562	0.77	0.8469	0.9632	1919055	CBDivE_009970	CCCCNc1c(C)c(O)c(CC(=O)Nc2ccccc2)c3cc(OC)c(OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C11	compound treatment	1.329	0.08	1.08	1.465	0.0112	0.15	0.8708	0.799	1919056	CBDivE_009971	Cc1ccc(Nc2c(cc(cc2[N+](=O)[O-])C(=O)O)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C12	compound treatment	1.27	0.021	0.28	1.458	0.00417	0.06	0.2405	0.8325	1919057	CBDivE_009972	Cc1ccc(C)c(NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C13	compound treatment	1.309	0.06	0.81	1.495	0.0412	0.56	0.9693	0.984	1101412	CBDivE_009973	CC1C(NC(C(C)C1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C14	compound treatment	1.323	0.074	1.0	1.479	0.0252	0.34	0.9486	0.8986	1919058	CBDivE_009974	COC(=O)c1ccc(N=NNc2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C15	compound treatment	1.343	0.094	1.27	1.503	0.0492	0.67	1.3708	0.9556	1919059	CBDivE_009975	COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc2nc(nc(n2)c3ccco3)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C16	compound treatment	1.234	-0.015	-0.2	1.458	0.00417	0.06	-0.1029	-0.4894	1919060	CBDivE_009976	OC(=O)C(C/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2ccccc2)C3=CNC4C=CC=CC43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C17	compound treatment	1.302	0.053	0.71	1.493	0.0392	0.53	0.8833	0.9897	1919061	CBDivE_009977	[O-][N+](=O)c1cccc(c1)C(=O)Oc2c(Cl)cc(Cl)c(Cl)c2CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C18	compound treatment	1.253	0.004	0.05	1.456	0.00217	0.03	0.0591	0.9602	1179853	CBDivE_009978	Clc1ccc(NC(=O)c2ccccc2C(=O)OCC#C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C19	compound treatment	1.262	0.013	0.18	1.452	-0.00183	-0.02	0.1064	0.6006	1200330	CBDivE_009979	COc1ccc(NC(=O)CCCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	C20	compound treatment	1.24	-0.009	-0.12	1.453	-8.28E-4	-0.01	-0.0939	-0.7695	1919062	CBDivE_009980	CC(C)c1ccc(cc1)c2sccc2CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D01	compound treatment	1.217	-0.032	-0.43	1.391	-0.0628	-0.86	-0.9111	-0.9497	1919063	CBDivE_009981	CCC1=NN(C(=O)C(CC(=O)Nc2ccccc2)c3cc(OC)c(OC)cc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D02	compound treatment	1.234	-0.015	-0.2	1.373	-0.0808	-1.1	-0.9225	-0.8232	1919064	CBDivE_009982	COc1ccc(C)cc1N=Nc2ccc(O)c3[n+]([O-])cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D03	compound treatment	1.109	-0.14	-1.89	1.42	-0.0338	-0.46	-1.6617	-0.8547	1499240	CBDivE_009983	CC(C)CC(Nc1nc(Oc2ccccc2)nc(Oc3ccccc3)n1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D04	compound treatment	1.219	-0.03	-0.4	1.383	-0.0708	-0.97	-0.9692	-0.9255	1327748	CBDivE_009984	C(N1CCN(Cc2ccccc2)C1c3cccc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D05	compound treatment	1.174	-0.075	-1.01	1.437	-0.0168	-0.23	-0.8777	-0.846	1919065	CBDivE_009985	Nc1nc(N)nc(n1)c2ccc3C(=O)c4ccccc4-c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D06	compound treatment	1.299	0.05	0.67	1.491	0.0372	0.51	0.8354	0.9901	1919066	CBDivE_009986	Brc1cccc(c1)C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D07	compound treatment	1.248	-0.001	-0.01	1.465	0.0112	0.15	0.0982	0.6418	1919067	CBDivE_009987	Cc1ccc(cc1)S(=O)(=O)O/N=C\2/CCOc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D08	compound treatment	1.206	-0.043	-0.58	1.393	-0.0608	-0.83	-0.9967	-0.9847	1919068	CBDivE_009988	Clc1ccc(nn1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D09	compound treatment	1.221	-0.028	-0.38	1.387	-0.0668	-0.91	-0.9115	-0.924	1919069	CBDivE_009989	CCCCOC(=O)c1ccc2C(=O)N(C3c4ccccc4Oc5ccccc35)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D10	compound treatment	1.258	0.009	0.12	1.453	-8.28E-4	-0.01	0.0778	0.6386	1919070	CBDivE_009990	COc1ccc(C)cc1N=Nc2ccc(O)c3nc(ccc23)N(C)c4ccc5c(N=Nc6cc(C)ccc6OC)ccc(O)c5n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D11	compound treatment	1.21	-0.039	-0.53	1.496	0.0422	0.58	0.0346	0.0444	1919071	CBDivE_009991	C/C=C/C=C/C=C/C(=O)\C=C\C=C\N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D12	compound treatment	1.28	0.031	0.42	1.447	-0.00683	-0.09	0.2299	0.5365	1919072	CBDivE_009992	Oc1cccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D13	compound treatment	1.308	0.059	0.8	1.438	-0.0158	-0.22	0.4102	0.4974	1919073	CBDivE_009993	CC(C)(C)S(=O)(=O)c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D14	compound treatment	1.229	-0.02	-0.27	1.401	-0.0528	-0.72	-0.7002	-0.9102	1919074	CBDivE_009994	Oc1cccc2ccc(/C=N/Nc3ccc4ccccc4n3)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D15	compound treatment	1.215	-0.034	-0.46	1.465	0.0112	0.15	-0.2166	-0.4482	1254498	CBDivE_009995	Cn1ccc(C#CCN2CCOCC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D16	compound treatment	1.222	-0.027	-0.36	1.338	-0.116	-1.58	-1.3744	-0.8479	1919075	CBDivE_009996	CC(C)(C)S(=O)(=O)c1ccsc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D17	compound treatment	1.203	-0.046	-0.62	1.439	-0.0148	-0.2	-0.5818	-0.8914	1543974	CBDivE_009997	CN(Cc1ccccc1)C(=O)N2c3ccccc3C=Cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D18	compound treatment	1.209	-0.04	-0.54	1.405	-0.0488	-0.67	-0.8524	-0.9946	1919076	CBDivE_009998	CC(=O)NC1(CC(=O)C(C)(C)C)CCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D19	compound treatment	1.297	0.048	0.65	1.466	0.0122	0.17	0.5752	0.8605	1919077	CBDivE_009999	CCN(CC)CC#CC(C)(O)CCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	D20	compound treatment	1.237	-0.012	-0.16	1.461	0.00717	0.1	-0.0453	-0.2397	1062288	CBDivE_010000	Oc1cccc2ccc(nc12)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E01	compound treatment	1.301	0.052	0.7	1.464	0.0102	0.14	0.5941	0.8308	1919078	CBDivE_010001	[O-][N+](=O)c1cccc(c1)C2(C(=O)c3ccccc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E02	compound treatment	1.237	-0.012	-0.16	1.459	0.00517	0.07	-0.0646	-0.3659	1919079	CBDivE_010002	COc1cc2CCNC(c3cccc(c3)[N+](=O)[O-])c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E03	compound treatment	1.253	0.004	0.05	1.492	0.0382	0.52	0.4062	0.7762	1919080	CBDivE_010003	Cn1nc(c2ccccc2)c3c(Br)cc(Br)c3c1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E04	compound treatment	1.23	-0.019	-0.26	1.492	0.0382	0.52	0.1868	0.3219	1415075	CBDivE_010004	CC1=C(C(NC(=S)N1)c2cccc(CC=C)c2O)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E05	compound treatment	1.284	0.035	0.47	1.481	0.0272	0.37	0.5959	0.9928	1919081	CBDivE_010005	CC(C)(CCC(=O)NCc1ccccc1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E06	compound treatment	1.192	-0.057	-0.77	1.462	0.00817	0.11	-0.465	-0.5984	1919082	CBDivE_010006	CCc1cc2c(=O)c(c3nc(C)cs3)c(oc2cc1O)C4CCCN4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E07	compound treatment	1.268	0.019	0.26	1.543	0.0892	1.22	1.0411	0.8377	1919083	CBDivE_010007	Cc1cc(OCC(CN(Cc2ccccc2)C(C)(C)C)OC(=O)c3ccco3)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E08	compound treatment	1.266	0.017	0.23	1.531	0.0772	1.05	0.9063	0.8414	1919084	CBDivE_010008	CCCCNc1cc(O)c(CC(=O)Nc2ccccc2)c3cc(OC)c(OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E09	compound treatment	1.366	0.117	1.58	1.49	0.0362	0.49	1.4649	0.8858	1356583	CBDivE_010009	OC(=O)c1nccnc1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E10	compound treatment	1.279	0.03	0.4	1.453	-8.28E-4	-0.01	0.2782	0.6871	1919085	CBDivE_010010	[O-][N+](=O)c1ccc(/C=N/CCCCCC\N=C\c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E11	compound treatment	1.34	0.091	1.23	1.529	0.0752	1.03	1.5929	0.996	1919086	CBDivE_010011	CC(C)[C@@H](CO)NC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E12	compound treatment	1.248	-0.001	-0.01	1.476	0.0222	0.3	0.2042	0.6748	1919087	CBDivE_010012	NS(=O)(=O)c1ccc(NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E13	compound treatment	1.327	0.078	1.05	1.416	-0.0378	-0.52	0.3793	0.3237	1919088	CBDivE_010013	CCCCNC(=O)c1nccnc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E14	compound treatment	1.222	-0.027	-0.36	1.438	-0.0158	-0.22	-0.4102	-0.9688	1919089	CBDivE_010014	CC(NC(=O)c1ccccc1C(=O)O)C(=O)NC2(CCCC2)C(=O)Nc3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E15	compound treatment	1.318	0.069	0.93	1.434	-0.0198	-0.27	0.467	0.4818	1354287	CBDivE_010015	CCN(CC)S(=O)(=O)NC(=O)Nc1nc(C)cc(C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E16	compound treatment	1.255	0.006	0.08	1.448	-0.00583	-0.08	0.001	0.0089	1919090	CBDivE_010016	OC(=O)C(C/C(=N/NC(=O)c1cccc(c1)[N+](=O)[O-])/c2ccccc2)C3=CNC4C=CC=CC43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E17	compound treatment	1.347	0.098	1.32	1.51	0.0562	0.77	1.4765	0.9663	1919091	CBDivE_010017	CC(=O)n1cc(C(C[N+](=O)[O-])SCCN)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E18	compound treatment	1.25	9.97E-4	0.01	1.467	0.0132	0.18	0.1365	0.7579	1919092	CBDivE_010018	ClC(=C(Cl)COC(=O)c1ccccc1C(=O)Nc2nc3ccccc3s2)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E19	compound treatment	1.332	0.083	1.12	1.526	0.0722	0.98	1.4877	0.9979	1919093	CBDivE_010019	O=S1(=O)CC[C@@H](C1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	E20	compound treatment	1.302	0.053	0.71	1.456	0.00217	0.03	0.5265	0.7358	1919094	CBDivE_010020	[O-][N+](=O)c1ccc(/C=N/Nc2nnn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F01	compound treatment	1.197	-0.052	-0.7	1.396	-0.0578	-0.79	-1.0537	-0.9983	1919095	CBDivE_010021	OC(=O)C(C/C(=N/Cc1ccccc1)/c2ccccc2)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F02	compound treatment	1.189	-0.06	-0.81	1.396	-0.0578	-0.79	-1.13	-0.9999	1919096	CBDivE_010022	[O-][N+](=O)c1cccc(c1)c2nc3ccc(cc3c(=O)o2)c4ccc5nc(oc(=O)c5c4)c6cccc(c6)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F03	compound treatment	1.154	-0.095	-1.28	1.416	-0.0378	-0.52	-1.271	-0.92	1919097	CBDivE_010023	CCSc1sc(CC)cc1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F04	compound treatment	1.212	-0.037	-0.5	1.416	-0.0378	-0.52	-0.7177	-0.9999	1919098	CBDivE_010024	O=C(COc1ccccc1)N/N=C/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F05	compound treatment	1.249	-3.13E-6	0.0	1.424	-0.0298	-0.41	-0.2876	-0.7072	1919099	CBDivE_010025	FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN4CCCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F06	compound treatment	1.2	-0.049	-0.66	1.422	-0.0318	-0.43	-0.7744	-0.9792	1919100	CBDivE_010026	Nc1c(Cl)cc(/N=C/c2ccc(Cl)cc2Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F07	compound treatment	1.227	-0.022	-0.3	1.384	-0.0698	-0.95	-0.8832	-0.8855	1919101	CBDivE_010027	COc1ccc(CCN(C)CC(=O)Nc2cc(C)nc3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F08	compound treatment	1.251	0.002	0.03	1.463	0.00917	0.13	0.1075	0.8401	1231613	CBDivE_010028	CCN(CC)CCCn1nnc2c(=O)oc3ccccc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F09	compound treatment	1.153	-0.096	-1.3	1.467	0.0132	0.18	-0.7888	-0.6033	1919102	CBDivE_010029	O=C(CN1CCOCC1)N2c3ccccc3C=Cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F10	compound treatment	1.211	-0.038	-0.51	1.448	-0.00583	-0.08	-0.4187	-0.8071	1919103	CBDivE_010030	Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc(cc2)c3ccc(\N=C\c4cc(Cl)cc(Cl)c4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F11	compound treatment	1.227	-0.022	-0.3	1.491	0.0372	0.51	0.1485	0.2529	1919104	CBDivE_010031	CC1=CCC2COC(C1C2)c3ccc[n+](Cc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F12	compound treatment	1.144	-0.105	-1.42	1.398	-0.0558	-0.76	-1.54	-0.9576	1919105	CBDivE_010032	Oc1cccc2ccc(/C=N/N=C/c3ccc4cccc(O)c4n3)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F13	compound treatment	1.226	-0.023	-0.31	1.449	-0.00483	-0.07	-0.266	-0.8385	1919106	CBDivE_010033	FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN4CCCCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F14	compound treatment	1.192	-0.057	-0.77	1.411	-0.0428	-0.58	-0.9567	-0.9908	1166480	CBDivE_010034	CN1CCN(CC1)c2ccc(Nc3ncnc4sc5CCCCc5c34)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F15	compound treatment	1.244	-0.005	-0.07	1.472	0.0182	0.25	0.1275	0.4964	1919107	CBDivE_010035	Cc1cc(NCCCN2CCOCC2)nc(n1)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F16	compound treatment	1.209	-0.04	-0.54	1.427	-0.0268	-0.37	-0.6403	-0.9821	1702887	CBDivE_010036	OC(=O)C1CCCN1S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F17	compound treatment	1.187	-0.062	-0.84	1.475	0.0212	0.29	-0.3873	-0.4377	1919108	CBDivE_010037	[O-][N+](=O)c1ccc2nc3c4ccccc4c(=O)c(Cl)c3oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F18	compound treatment	1.246	-0.003	-0.04	1.469	0.0152	0.21	0.1177	0.558	1919109	CBDivE_010038	Cc1ccc(c(I)c1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F19	compound treatment	1.188	-0.061	-0.82	1.466	0.0122	0.17	-0.4646	-0.5533	1919110	CBDivE_010039	Clc1ccc(N/N=C/c2cccc(I)c2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	F20	compound treatment	1.194	-0.055	-0.74	1.382	-0.0718	-0.98	-1.2173	-0.9906	1919111	CBDivE_010040	Nc1c(Cl)cc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G01	compound treatment	1.196	-0.053	-0.72	1.44	-0.0138	-0.19	-0.6389	-0.864	1919112	CBDivE_010041	COc1ccc(cc1)C2CC(=NN2c3ccc(Cl)c(Cl)c3)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G02	compound treatment	1.201	-0.048	-0.65	1.442	-0.0118	-0.16	-0.572	-0.857	1919113	CBDivE_010042	COc1ccc(CC/N=C/c2cc(ccc2O)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G03	compound treatment	1.278	0.029	0.39	1.493	0.0392	0.53	0.6543	0.9883	1919114	CBDivE_010043	Clc1cc(Cl)c2c(c3ccccc3)n(nc(c4ccccc4)c12)C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G04	compound treatment	1.255	0.006	0.08	1.463	0.00917	0.13	0.1457	0.9778	1919115	CBDivE_010044	COc1ccc(CC/N=C/c2ccccc2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G05	compound treatment	1.236	-0.013	-0.18	1.456	0.00217	0.03	-0.1031	-0.5795	1486194	CBDivE_010045	Ic1ccc(NC(=O)CCC2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G06	compound treatment	1.278	0.029	0.39	1.433	-0.0208	-0.28	0.0758	0.1568	1919116	CBDivE_010046	[O-][n+]1c(/C=C/c2ccccc2)ccc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G07	compound treatment	1.315	0.066	0.89	1.468	0.0142	0.19	0.7662	0.841	1919117	CBDivE_010047	[O-][N+]1=C(C(C(O1)C(=O)OCc2ccccc2)c3c[nH]c4ccccc34)C(=O)OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G08	compound treatment	1.251	0.002	0.03	1.488	0.0342	0.47	0.3486	0.7467	1703094	CBDivE_010048	COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(N4CCOCC4)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G09	compound treatment	1.295	0.046	0.62	1.48	0.0262	0.36	0.6911	0.9655	1919118	CBDivE_010049	CCC1(CC)OC(Nc2c(Br)cc(Br)cc21)c3ccc(o3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G10	compound treatment	1.233	-0.016	-0.22	1.489	0.0352	0.48	0.1865	0.3546	1919119	CBDivE_010050	C(CCC/N=C/c1ccco1)CC/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G11	compound treatment	1.334	0.085	1.15	1.532	0.0782	1.07	1.5646	0.9993	1919120	CBDivE_010051	O=C(Nc1ccc(Cc2ccc(NC(=O)Nc3cccc4ccccc34)cc2)cc1)Nc5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G12	compound treatment	1.186	-0.063	-0.85	1.459	0.00517	0.07	-0.5511	-0.6462	1919121	CBDivE_010052	NS(=O)(=O)c1ccc(NC(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G13	compound treatment	1.35	0.101	1.36	1.498	0.0442	0.6	1.3894	0.9326	1919122	CBDivE_010053	CC(=O)Nc1ccc(cc1)/C(=N/NC(=O)c2ccncc2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G14	compound treatment	1.248	-0.001	-0.01	1.485	0.0312	0.43	0.291	0.6842	1919123	CBDivE_010054	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G15	compound treatment	1.326	0.077	1.04	1.533	0.0792	1.08	1.4979	0.9998	1919124	CBDivE_010055	[O-][N+](=O)c1cccc(/C=N/NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G16	compound treatment	1.249	-3.13E-6	0.0	1.51	0.0562	0.77	0.5416	0.7071	1919125	CBDivE_010056	OC(=O)C(C/C(=N/NC(=O)c1ccccc1[N+](=O)[O-])/c2ccccc2)C3=CNC4C=CC=CC43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G17	compound treatment	1.31	0.061	0.82	1.556	0.102	1.39	1.5671	0.9684	1851043	CBDivE_010057	O=C(Cc1cccc2ccccc12)Nc3ccc(Cc4ccc(NC(=O)Cc5cccc6ccccc56)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G18	compound treatment	1.259	0.01	0.13	1.471	0.0172	0.23	0.2609	0.9656	1663446	CBDivE_010058	CC(=O)N1C=CN(C(C1c2cn(C)c3ccccc23)c4cn(C)c5ccccc45)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G19	compound treatment	1.327	0.078	1.05	1.523	0.0692	0.94	1.411	0.9985	1919126	CBDivE_010059	[O-][N+](=O)c1ccc(/C=C/2\S\C(=N\N=C\3/C(=O)Nc4ccccc34)\NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	G20	compound treatment	1.287	0.038	0.51	1.448	-0.00583	-0.08	0.3063	0.5904	1919127	CBDivE_010060	CC(C)(C)c1cc(/C=N/c2nc(O)cc(O)n2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H01	compound treatment	1.207	-0.042	-0.57	1.331	-0.123	-1.67	-1.585	-0.8964	1919128	CBDivE_010061	O=C1NN=C(CC1c2c[nH]c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H02	compound treatment	1.224	-0.025	-0.34	1.435	-0.0188	-0.26	-0.4201	-0.9909	1228288	CBDivE_010062	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3cc(Cl)cc(Cl)c3O)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H03	compound treatment	1.249	-3.13E-6	0.0	1.414	-0.0398	-0.54	-0.3841	-0.7072	1919129	CBDivE_010063	CCN(CC)C(=S)NC(=O)/C=C/c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H04	compound treatment	1.251	0.002	0.03	1.408	-0.0458	-0.62	-0.4228	-0.676	1919130	CBDivE_010064	Clc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ncccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H05	compound treatment	1.166	-0.083	-1.12	1.413	-0.0408	-0.56	-1.1855	-0.948	1919131	CBDivE_010065	OC(/C(=N\N=C(/C(O)c1ccccc1)\c2ccccc2)/c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H06	compound treatment	1.233	-0.016	-0.22	1.373	-0.0808	-1.1	-0.932	-0.8298	1919132	CBDivE_010066	Cc1c(/N=C/c2ccc(\C=N\c3c(C)n(C)n(c4ccccc4)c3=O)cc2)c(=O)n(c5ccccc5)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H07	compound treatment	1.202	-0.047	-0.63	1.395	-0.0588	-0.8	-1.0156	-0.9932	1708885	CBDivE_010067	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H08	compound treatment	1.235	-0.014	-0.19	1.413	-0.0408	-0.56	-0.5273	-0.8968	1301814	CBDivE_010068	Cc1cc(nc2nc(nc(C)c12)c3ccccc3)c4c(C)nc(nc4N)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H09	compound treatment	1.176	-0.073	-0.98	1.401	-0.0528	-0.72	-1.2058	-0.9882	1919133	CBDivE_010069	COc1cccc(/C=N/NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H10	compound treatment	1.241	-0.008	-0.11	1.48	0.0262	0.36	0.176	0.4721	1919134	CBDivE_010070	Cc1cc(ccc1/N=C/c2cc(Cl)cc(Cl)c2O)c3ccc(/N=C/c4cc(Cl)cc(Cl)c4O)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H11	compound treatment	1.35	0.101	1.36	1.406	-0.0478	-0.65	0.5023	0.3325	1919135	CBDivE_010071	[O-][N+](=O)c1ccc2nc3-c4cccc5cccc(-c3nc2c1)c45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H12	compound treatment	1.288	0.039	0.53	1.461	0.00717	0.1	0.4412	0.8244	1574001	CBDivE_010072	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)C(=O)OCC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H13	compound treatment	1.28	0.031	0.42	1.535	0.0812	1.11	1.0784	0.9114	1919136	CBDivE_010073	[O-][N+](=O)c1cc(ccc1Cl)C(=O)NC2c3ccccc3Oc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H14	compound treatment	1.24	-0.009	-0.12	1.439	-0.0148	-0.2	-0.2289	-0.9703	1919137	CBDivE_010074	Fc1ccc(/C=N/NC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H15	compound treatment	1.202	-0.047	-0.63	1.437	-0.0168	-0.23	-0.6106	-0.9055	1601581	CBDivE_010075	Cn1nccc1C#CCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H16	compound treatment	1.191	-0.058	-0.78	1.492	0.0382	0.52	-0.1852	-0.1971	1167565	CBDivE_010076	Brc1ccc2nc3CCCCc3n2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H17	compound treatment	1.201	-0.048	-0.65	1.485	0.0312	0.43	-0.1573	-0.2031	1669235	CBDivE_010077	Cc1ccc(Oc2ccc(cc2)N3C(=O)c4cccc(N)c4C3=O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H18	compound treatment	1.264	0.015	0.2	1.408	-0.0458	-0.62	-0.2988	-0.4549	1919138	CBDivE_010078	CC(C)(C)Nc1nc(Cl)nc(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H19	compound treatment	1.235	-0.014	-0.19	1.484	0.0302	0.41	0.1574	0.3476	1653912	CBDivE_010079	COc1ccc(cc1)C2N=C(c3ccccc3)C(C)(C)N2OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	H20	compound treatment	1.228	-0.021	-0.28	1.438	-0.0158	-0.22	-0.353	-0.991	1919139	CBDivE_010080	[O-][N+](=O)C(/C=N/c1ccccc1I)/C=N/c2ccccc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I01	compound treatment	1.237	-0.012	-0.16	1.463	0.00917	0.13	-0.0261	-0.1274	1919140	CBDivE_010081	COc1cc(cc(OC)c1OC)C(=O)N(C)c2c(C)n(C)n(c3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I02	compound treatment	1.21	-0.039	-0.53	1.472	0.0182	0.25	-0.1968	-0.3384	1310461	CBDivE_010082	Cc1cc(ccc1NC(=O)COc2ccc(Cl)cc2Cl)c3ccc(NC(=O)COc4ccc(Cl)cc4Cl)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I03	compound treatment	1.315	0.066	0.89	1.496	0.0422	0.58	1.0362	0.9776	1919141	CBDivE_010083	Cn1nc(c2ccccc2)c3ccc(C(=O)C(F)(F)F)c3c1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I04	compound treatment	1.189	-0.06	-0.81	1.454	1.72E-4	0.0	-0.5707	-0.7051	1919142	CBDivE_010084	COc1ccc(CC/N=C/c2cccc(c2)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I05	compound treatment	1.284	0.035	0.47	1.498	0.0442	0.6	0.7598	0.9927	1159195	CBDivE_010085	O=C(CCC1CCCCC1)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I06	compound treatment	1.209	-0.04	-0.54	1.464	0.0102	0.14	-0.2835	-0.5088	1919143	CBDivE_010086	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=S)N)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I07	compound treatment	1.293	0.044	0.59	1.517	0.0632	0.86	1.0288	0.9835	1919144	CBDivE_010087	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc2ccccc2OC(F)(F)C(F)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I08	compound treatment	1.276	0.027	0.36	1.52	0.0662	0.9	0.8956	0.9204	1919145	CBDivE_010088	COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(NCc4ccccc4)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I09	compound treatment	1.278	0.029	0.39	1.466	0.0122	0.17	0.394	0.9271	1469354	CBDivE_010089	OC(=O)c1nccnc1C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I10	compound treatment	1.277	0.028	0.38	1.479	0.0252	0.34	0.5098	0.9989	1919146	CBDivE_010090	OC(=O)c1cc(/N=C/c2ccco2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I11	compound treatment	1.339	0.09	1.21	1.501	0.0472	0.64	1.3134	0.9559	1067368	CBDivE_010091	CCOC(=O)c1c(C)nc(C)c(C(=O)OCC)c1c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I12	compound treatment	1.22	-0.029	-0.39	1.481	0.0272	0.37	-0.0147	-0.0272	1919147	CBDivE_010092	COc1ccc(C2NC(Cc3c2[nH]c4ccccc34)C(=O)O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I13	compound treatment	1.343	0.094	1.27	1.461	0.00717	0.1	0.9658	0.7594	1312955	CBDivE_010093	OC(=O)c1ccc(NC(=O)c2nccnc2C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I14	compound treatment	1.288	0.039	0.53	1.465	0.0112	0.15	0.4797	0.8759	1919148	CBDivE_010094	CC(=O)c1ccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I15	compound treatment	1.373	0.124	1.67	1.524	0.0702	0.96	1.8595	0.9649	1032259	CBDivE_010095	CC(=O)NC(CO)C(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I16	compound treatment	1.271	0.022	0.3	1.463	0.00917	0.13	0.2983	0.9262	1375861	CBDivE_010096	COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(N4CCCCCC4)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I17	compound treatment	1.328	0.079	1.07	1.497	0.0432	0.59	1.1699	0.9609	1919149	CBDivE_010097	Cc1cc([N+](=O)[O-])c(NCCc2ccccc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I18	compound treatment	1.245	-0.004	-0.05	1.489	0.0352	0.48	0.301	0.6235	1919150	CBDivE_010098	Clc1cccc(Cl)c1NC(=O)Cc2ccsc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I19	compound treatment	1.333	0.084	1.13	1.483	0.0292	0.4	1.0826	0.9014	1919151	CBDivE_010099	Cc1ccc(/N=C/2\C(=O)N(CN3CCCCC3)c4ccc(Br)cc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	I20	compound treatment	1.257	0.008	0.11	1.465	0.0112	0.15	0.184	0.9857	1919152	CBDivE_010100	CCC1(CC)C(=O)NC(=NNc2ccccc2)NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J01	compound treatment	1.221	-0.028	-0.38	1.415	-0.0388	-0.53	-0.6415	-0.9863	1919153	CBDivE_010101	O=C1C(CC(=NN1c2ccccc2)c3ccccc3)c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J02	compound treatment	1.23	-0.019	-0.26	1.471	0.0172	0.23	-0.0157	-0.0452	1919154	CBDivE_010102	Cc1cc(c2cccnc2c1O)C3(OC(=O)c4ccccc43)c5cc(C)c(O)c6ncccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J03	compound treatment	1.155	-0.094	-1.27	1.361	-0.0928	-1.27	-1.7918	-1.0	1919155	CBDivE_010103	CC(C)(C)S(=O)(=O)c1sccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J04	compound treatment	1.206	-0.043	-0.58	1.43	-0.0238	-0.32	-0.64	-0.9625	1524245	CBDivE_010104	Clc1c(Cl)c(Cl)c(C(=O)n2nnc3ccccc23)c(C(=O)OCC#C)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J05	compound treatment	1.201	-0.048	-0.65	1.455	0.00117	0.02	-0.4466	-0.6894	1919156	CBDivE_010105	COc1ccc2cc(/C=N/Nc3ccc(cc3)S(=O)(=O)O)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J06	compound treatment	1.219	-0.03	-0.4	1.376	-0.0778	-1.06	-1.0367	-0.9127	1919157	CBDivE_010106	Cc1ccc(cc1)S(=O)(=O)N/N=C\2/CCCCC3CC32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J07	compound treatment	1.241	-0.008	-0.11	1.407	-0.0468	-0.64	-0.5279	-0.8151	1919158	CBDivE_010107	FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J08	compound treatment	1.264	0.015	0.2	1.442	-0.0118	-0.16	0.029	0.1121	1011857	CBDivE_010108	O=C(CCN1CCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J09	compound treatment	1.186	-0.063	-0.85	1.444	-0.00983	-0.13	-0.6958	-0.8086	1919159	CBDivE_010109	Cc1ccc(s1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J10	compound treatment	1.239	-0.01	-0.13	1.461	0.00717	0.1	-0.0263	-0.1576	1919160	CBDivE_010110	Oc1c(Cl)cc(Cl)cc1/C=N/c2ccccc2c3ccccc3\N=C\c4cc(Cl)cc(Cl)c4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J11	compound treatment	1.239	-0.01	-0.13	1.46	0.00617	0.08	-0.0359	-0.2258	1566895	CBDivE_010111	CCOC(=O)c1ccc(cc1)N2C(=O)c3cccc(N)c3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J12	compound treatment	1.209	-0.04	-0.54	1.458	0.00417	0.06	-0.3414	-0.6291	1219289	CBDivE_010112	CC1(C)N(O)C(N=C1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J13	compound treatment	1.272	0.023	0.31	1.448	-0.00583	-0.08	0.1632	0.5095	1553414	CBDivE_010113	O=C(Oc1ccc(cc1)c2cnc3ccccc3n2)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J14	compound treatment	1.224	-0.025	-0.34	1.354	-0.0998	-1.36	-1.2011	-0.8564	1377552	CBDivE_010114	Clc1ccc(cc1)c2cc3C(=O)c4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J15	compound treatment	1.206	-0.043	-0.58	1.466	0.0122	0.17	-0.2928	-0.4853	1710491	CBDivE_010115	CN1CCc2c(C1)c3ccccc3n2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J16	compound treatment	1.161	-0.088	-1.19	1.446	-0.00783	-0.11	-0.915	-0.7676	1595587	CBDivE_010116	Cc1cc(C)c2ccc(C=O)nc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J17	compound treatment	1.19	-0.059	-0.8	1.465	0.0112	0.15	-0.4551	-0.5616	1479441	CBDivE_010117	CN(C)CCCn1nnc2c(=O)oc3ccccc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J18	compound treatment	1.16	-0.089	-1.2	1.416	-0.0378	-0.52	-1.2138	-0.9288	1575201	CBDivE_010118	CN(C)CCn1nnc2c(=O)oc3ccccc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J19	compound treatment	1.192	-0.057	-0.77	1.508	0.0542	0.74	-0.0214	-0.0201	1636144	CBDivE_010119	CC(C)(C)S(=O)(=O)c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	J20	compound treatment	1.268	0.019	0.26	1.458	0.00417	0.06	0.2214	0.8436	1919161	CBDivE_010120	CN(Cc1cccs1)C(=S)SCC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K01	compound treatment	1.289	0.04	0.54	1.463	0.00917	0.13	0.47	0.8485	1049687	CBDivE_010121	Cc1ccc(cc1)S(=O)(=O)Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K02	compound treatment	1.249	-3.13E-6	0.0	1.446	-0.00783	-0.11	-0.0755	-0.7074	1541025	CBDivE_010122	COc1nc(CC(=O)C2CC2)nc(n1)N(C)C(=O)NS(=O)(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K03	compound treatment	1.233	-0.016	-0.22	1.484	0.0302	0.41	0.1383	0.2976	1775843	CBDivE_010123	[O-][N+](=O)c1ccccc1c2nc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K04	compound treatment	1.215	-0.034	-0.46	1.434	-0.0198	-0.27	-0.5156	-0.9682	1919162	CBDivE_010124	COc1ccc(CC/N=C/c2ccc(cc2)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K05	compound treatment	1.328	0.079	1.07	1.48	0.0262	0.36	1.0059	0.8951	1919163	CBDivE_010125	O=C(CCCC(=O)OCC#C)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K06	compound treatment	1.306	0.057	0.77	1.455	0.00117	0.02	0.555	0.7217	1296031	CBDivE_010126	COc1ccc2C3=NN(C(C3CCc2c1)c4cccc(F)c4)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K07	compound treatment	1.272	0.023	0.31	1.482	0.0282	0.38	0.491	0.9944	1919164	CBDivE_010127	[O-][N+](=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K08	compound treatment	1.241	-0.008	-0.11	1.507	0.0532	0.73	0.4364	0.5953	1919165	CBDivE_010128	Oc1ccc(/C=N/N=C2c3ccccc3Cc4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K09	compound treatment	1.268	0.019	0.26	1.504	0.0502	0.68	0.665	0.9102	1919166	CBDivE_010129	Cc1ccc(/N=C/c2ccccc2O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K10	compound treatment	1.262	0.013	0.18	1.494	0.0402	0.55	0.5113	0.889	1919167	CBDivE_010130	CC(C)c1ccc(/C=N/c2ccc(O)c(c2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K11	compound treatment	1.307	0.058	0.78	1.481	0.0272	0.37	0.8153	0.9417	1450281	CBDivE_010131	OC(=O)c1ccccc1C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccccc4C(=O)O)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K12	compound treatment	1.234	-0.015	-0.2	1.489	0.0352	0.48	0.196	0.3766	1919168	CBDivE_010132	CCO/C(=C/c1sc2ccc(C)cc2[n+]1CCCS(=O)(=O)O)/CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K13	compound treatment	1.286	0.037	0.5	1.496	0.0422	0.58	0.7596	0.9975	1919169	CBDivE_010133	Oc1ccccc1/C=N\NC(=O)c2[nH]ncc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K14	compound treatment	1.214	-0.035	-0.47	1.433	-0.0208	-0.28	-0.5347	-0.9704	1919170	CBDivE_010134	CC(=O)Nc1ccc(NC(=O)[C@H]2[C@H](C3CC2C=C3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K15	compound treatment	1.313	0.064	0.86	1.524	0.0702	0.96	1.2871	0.9987	1919171	CBDivE_010135	Oc1ccc(Br)cc1/C=N/Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K16	compound treatment	1.277	0.028	0.38	1.535	0.0812	1.11	1.0498	0.8976	1919172	CBDivE_010136	OC(=O)C(C/C(=N/c1ccc(Br)cc1)/c2ccccc2)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K17	compound treatment	1.302	0.053	0.71	1.459	0.00517	0.07	0.5554	0.7731	1241410	CBDivE_010137	CC(=O)Nc1ccc(NC(=O)CCCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K18	compound treatment	1.243	-0.006	-0.08	1.432	-0.0218	-0.3	-0.2677	-0.8679	1919173	CBDivE_010138	OC(=O)c1nccnc1C(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K19	compound treatment	1.297	0.048	0.65	1.556	0.102	1.39	1.443	0.9393	1919174	CBDivE_010139	CCCN1CC2C(N(N=C2/C(=C/c3cccc(c3)[N+](=O)[O-])/C1)C(=O)C)c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	K20	compound treatment	1.293	0.044	0.59	1.534	0.0802	1.09	1.1928	0.9588	1775567	CBDivE_010140	CC(C)(c1ccc(O)cc1)c2ccc(Oc3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L01	compound treatment	1.207	-0.042	-0.57	1.41	-0.0438	-0.6	-0.8233	-0.9996	1662552	CBDivE_010141	O=C1C(CC(=NN1Cc2ccccc2)c3ccccc3)c4cn(Cc5ccccc5)c6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L02	compound treatment	1.204	-0.045	-0.61	1.367	-0.0868	-1.18	-1.2665	-0.9518	1575189	CBDivE_010142	C1CCC2(CC1)OCC3(CO2)COC4(CCCCC4)OC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L03	compound treatment	1.271	0.022	0.3	1.423	-0.0308	-0.42	-0.0874	-0.1699	1919175	CBDivE_010143	CCCCOc1ccc(cc1)C(=O)Oc2ccc(cc2)c3nc4ccccc4nc3c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L04	compound treatment	1.181	-0.068	-0.92	1.391	-0.0628	-0.86	-1.2545	-0.9994	1273681	CBDivE_010144	Brc1cccc(c1)C(=O)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L05	compound treatment	1.13	-0.119	-1.61	1.444	-0.00983	-0.13	-1.23	-0.7635	1547468	CBDivE_010145	CC(C)(C)S(=O)(=O)c1ccccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L06	compound treatment	1.229	-0.02	-0.27	1.395	-0.0588	-0.8	-0.7581	-0.8957	1919176	CBDivE_010146	Cc1cc(C)nc(N/N=C/c2cccc(I)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L07	compound treatment	1.174	-0.075	-1.01	1.409	-0.0448	-0.61	-1.1477	-0.9709	1919177	CBDivE_010147	Cc1cc(=S)n(c2ccccc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L08	compound treatment	1.174	-0.075	-1.01	1.418	-0.0358	-0.49	-1.0609	-0.9442	1919178	CBDivE_010148	N(/N=C/c1ccc2ccccc2n1)c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L09	compound treatment	1.212	-0.037	-0.5	1.451	-0.00283	-0.04	-0.3802	-0.7595	1919179	CBDivE_010149	NC(=S)NNc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L10	compound treatment	1.21	-0.039	-0.53	1.403	-0.0508	-0.69	-0.8622	-0.9908	1560470	CBDivE_010150	Oc1c(Cl)cc(Cl)cc1C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L11	compound treatment	1.216	-0.033	-0.45	1.427	-0.0268	-0.37	-0.5735	-0.9952	1189995	CBDivE_010151	Clc1ccc(cc1)C(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L12	compound treatment	1.223	-0.026	-0.35	1.432	-0.0218	-0.3	-0.4585	-0.9967	1919180	CBDivE_010152	Brc1ccc(/C=N/NC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L13	compound treatment	1.251	0.002	0.03	1.454	1.72E-4	0.0	0.0207	0.7659	1736587	CBDivE_010153	Fc1ccc(cc1)C(=O)Oc2ccccc2c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L14	compound treatment	1.246	-0.003	-0.04	1.413	-0.0408	-0.56	-0.4223	-0.7566	1919181	CBDivE_010154	Cc1ccc2nc3c4ccccc4[nH]c3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L15	compound treatment	1.236	-0.013	-0.18	1.394	-0.0598	-0.82	-0.7009	-0.84	1919182	CBDivE_010155	O=C(CN1CCCCCC1)N2c3ccccc3C=Cc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L16	compound treatment	1.191	-0.058	-0.78	1.43	-0.0238	-0.32	-0.7831	-0.9242	1919183	CBDivE_010156	Nc1c(Cl)cc(/N=C/c2ccc(\C=N\c3cc(Cl)c(N)c(Cl)c3)cc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L17	compound treatment	1.223	-0.026	-0.35	1.478	0.0242	0.33	-0.015	-0.0311	1919184	CBDivE_010157	O=C(Oc1ccc(cc1)c2cccc(n2)c3ccc(OC(=O)c4ccco4)cc3)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L18	compound treatment	1.221	-0.028	-0.38	1.392	-0.0618	-0.84	-0.8633	-0.9344	1919185	CBDivE_010158	Cn1nccc1C(=O)C#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L19	compound treatment	1.234	-0.015	-0.2	1.497	0.0432	0.59	0.2732	0.4388	1713847	CBDivE_010159	COc1ccc(cc1)C2N=C(c3ccccc3)C(C)(C)N2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	L20	compound treatment	1.209	-0.04	-0.54	1.459	0.00517	0.07	-0.3317	-0.6095	1919186	CBDivE_010160	[O-][N+](=O)c1cc(ccc1Br)C(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M01	compound treatment	1.276	0.027	0.36	1.43	-0.0238	-0.32	0.0278	0.0569	1290672	CBDivE_010161	Nc1ccc(cc1)c2nc3cc(N)ccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M02	compound treatment	1.195	-0.054	-0.73	1.455	0.00117	0.02	-0.5038	-0.6914	1329725	CBDivE_010162	Cc1cccc(C)c1NC(=O)c2nccnc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M03	compound treatment	1.258	0.009	0.12	1.49	0.0362	0.49	0.4346	0.8556	1919187	CBDivE_010163	Oc1ccc(/C=N/N2C(=O)C3C4CC(C=C4)C3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M04	compound treatment	1.198	-0.051	-0.69	1.487	0.0332	0.45	-0.1667	-0.2024	1919188	CBDivE_010164	COc1ccc(CC/N=C/c2ccc(O)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M05	compound treatment	1.329	0.08	1.08	1.423	-0.0308	-0.42	0.4659	0.4022	1919189	CBDivE_010165	Oc1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M06	compound treatment	1.214	-0.035	-0.47	1.472	0.0182	0.25	-0.1587	-0.2976	1919190	CBDivE_010166	[O-][N+](=O)c1cc2OCOc2cc1/C=N/NC(=O)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M07	compound treatment	1.359	0.11	1.48	1.501	0.0472	0.64	1.5042	0.93	1919191	CBDivE_010167	Clc1ccc(cc1)c2ccc(NC(=O)NS(=O)(=O)c3ccccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M08	compound treatment	1.235	-0.014	-0.19	1.456	0.00217	0.03	-0.1126	-0.589	1919192	CBDivE_010168	CC(=O)C1=C(C)NC(=S)NC1c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M09	compound treatment	1.289	0.04	0.54	1.531	0.0772	1.05	1.1257	0.9518	1739316	CBDivE_010169	COC(=O)C(C(c1ccccc1)c2ccc(cc2)C(C(=O)OC)C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M10	compound treatment	1.241	-0.008	-0.11	1.491	0.0372	0.51	0.2821	0.5443	1919193	CBDivE_010170	CC(C)(C)NC(NC(=O)c1ccc(Br)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M11	compound treatment	1.27	0.021	0.28	1.443	-0.0108	-0.15	0.0959	0.3002	1914114	CBDivE_010171	CN(C(=N)NC(=N)N)c1c(C)n(C)n(c2ccccc2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M12	compound treatment	1.241	-0.008	-0.11	1.438	-0.0158	-0.22	-0.229	-0.9487	1919194	CBDivE_010172	Cc1sc2ccc(cc2[n+]1CCCS(=O)(=O)O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M13	compound treatment	1.318	0.069	0.93	1.548	0.0942	1.28	1.5662	0.9875	1919195	CBDivE_010173	[O-][N+](=O)c1cccc(/C=N\NC(=O)c2[nH]ncc2I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M14	compound treatment	1.258	0.009	0.12	1.453	-8.28E-4	-0.01	0.0778	0.6386	1919196	CBDivE_010174	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3cccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M15	compound treatment	1.311	0.062	0.84	1.428	-0.0258	-0.35	0.3424	0.3773	1919197	CBDivE_010175	[O-][N+](=O)c1cccc(/C=N/Nc2ccc(Cl)nn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M16	compound treatment	1.227	-0.022	-0.3	1.489	0.0352	0.48	0.1293	0.2291	1919198	CBDivE_010176	[O-][N+](=O)c1ccccc1NC(=O)CCCC(=O)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M17	compound treatment	1.349	0.1	1.35	1.523	0.0692	0.94	1.6209	0.9847	1111919	CBDivE_010177	COc1ccc(NC(=O)CCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M18	compound treatment	1.251	0.002	0.03	1.493	0.0392	0.53	0.3968	0.7418	1421275	CBDivE_010178	Clc1ccc(cc1)C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccc(Cl)cc4)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M19	compound treatment	1.347	0.098	1.32	1.589	0.135	1.84	2.2382	0.9867	1919199	CBDivE_010179	COc1ccc(CC/N=C(/c2ccccc2)\c3ccccn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	M20	compound treatment	1.256	0.007	0.09	1.508	0.0542	0.74	0.5891	0.791	1919200	CBDivE_010180	CC(=O)c1ccc(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N01	compound treatment	1.196	-0.053	-0.72	1.428	-0.0258	-0.35	-0.7547	-0.9468	1431707	CBDivE_010181	COc1cc2C(CC(=O)Nc3ccccc3)C(=O)N(N=C(C)c2cc1OC)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N02	compound treatment	1.171	-0.078	-1.05	1.382	-0.0718	-0.98	-1.4367	-0.9994	1403398	CBDivE_010182	CC(=O)Nc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c4ccc(NC(=O)C)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N03	compound treatment	1.239	-0.01	-0.13	1.361	-0.0928	-1.27	-0.9905	-0.7781	1422094	CBDivE_010183	Nc1ccc(cc1)C(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N04	compound treatment	1.207	-0.042	-0.57	1.348	-0.106	-1.44	-1.4211	-0.9166	1919201	CBDivE_010184	Clc1ccc(C2SCC(=O)N2c3ccc(Br)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N05	compound treatment	1.265	0.016	0.22	1.437	-0.0168	-0.23	-0.0097	-0.0307	1609916	CBDivE_010185	CCN(CC)C(=S)NC(=O)c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N06	compound treatment	1.256	0.007	0.09	1.386	-0.0678	-0.92	-0.5873	-0.6317	1919202	CBDivE_010186	Cc1cc(C)nc(Sc2c(F)c(F)c(c(F)c2F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N07	compound treatment	1.169	-0.08	-1.08	1.466	0.0122	0.17	-0.6458	-0.5914	1567392	CBDivE_010187	Brc1ccc(cc1)C(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N08	compound treatment	1.187	-0.062	-0.84	1.434	-0.0198	-0.27	-0.7827	-0.8903	1919203	CBDivE_010188	CCCCNc1ccc2cccc(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N09	compound treatment	1.209	-0.04	-0.54	1.456	0.00217	0.03	-0.3607	-0.6673	1919204	CBDivE_010189	Cc1cc(C)c(c(C)c1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N10	compound treatment	1.224	-0.025	-0.34	1.429	-0.0248	-0.34	-0.4779	-1.0	1919205	CBDivE_010190	Oc1c(Cl)cc(Cl)cc1/C=N/C2CCCCC2\N=C\c3cc(Cl)cc(Cl)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N11	compound treatment	1.215	-0.034	-0.46	1.445	-0.00883	-0.12	-0.4095	-0.8634	1240863	CBDivE_010191	CCc1nc2ccccc2c(NC(=O)Cc3ccc(OC)c(OC)c3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N12	compound treatment	1.187	-0.062	-0.84	1.381	-0.0728	-0.99	-1.2937	-0.9964	1919206	CBDivE_010192	[O-][N+](=O)c1ccc(o1)C2Nc3ccccc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N13	compound treatment	1.247	-0.002	-0.03	1.421	-0.0328	-0.45	-0.3356	-0.7484	1775271	CBDivE_010193	[O-][N+](=O)c1cccc(c1)C(=O)Oc2ccc(cc2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N14	compound treatment	1.217	-0.032	-0.43	1.438	-0.0158	-0.22	-0.4579	-0.9487	1919207	CBDivE_010194	Cc1ccc(cc1)C(=O)OCC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N15	compound treatment	1.213	-0.036	-0.49	1.431	-0.0228	-0.31	-0.5636	-0.9769	1919208	CBDivE_010195	CCN/N=C\1/C(=N/O)/CCc2nonc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N16	compound treatment	1.241	-0.008	-0.11	1.421	-0.0328	-0.45	-0.3929	-0.8532	1919209	CBDivE_010196	[O-][N+](=O)c1ccc(/C=N/OC(=O)c2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N17	compound treatment	1.151	-0.098	-1.32	1.419	-0.0348	-0.47	-1.2707	-0.9045	1919210	CBDivE_010197	CNc1ccc2cc(cc(O)c2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N18	compound treatment	1.259	0.01	0.13	1.408	-0.0458	-0.62	-0.3465	-0.542	1919211	CBDivE_010198	NC(=O)NNc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N19	compound treatment	1.212	-0.037	-0.5	1.502	0.0482	0.66	0.1115	0.1352	1368916	CBDivE_010199	CC(C)(C)S(=O)(=O)c1ccc(s1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	N20	compound treatment	1.232	-0.017	-0.23	1.424	-0.0298	-0.41	-0.4498	-0.9633	1255169	CBDivE_010200	Clc1ccc(C(=O)Oc2cccc(c2)c3cnc4ccccc4n3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O01	compound treatment	1.293	0.044	0.59	1.527	0.0732	1.0	1.1253	0.9692	1919212	CBDivE_010201	[O-][N+](=O)c1ccc(/C=C/c2ccccc2)c(c1)S(=O)(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O02	compound treatment	1.216	-0.033	-0.45	1.497	0.0432	0.59	0.1015	0.1375	1719639	CBDivE_010202	OC(=O)c1nccnc1C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O03	compound treatment	1.217	-0.032	-0.43	1.534	0.0802	1.09	0.4678	0.398	1919213	CBDivE_010203	CC(C)C(N1C(=O)C2C(C3C=CC2C4C3C(=O)N(C(C(C)C)C(=O)O)C4=O)C1=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O04	compound treatment	1.29	0.041	0.55	1.469	0.0152	0.21	0.5374	0.91	1467800	CBDivE_010204	CCOC(=O)C1=C(C)NC(=O)NC1c2ccc(O)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O05	compound treatment	1.312	0.063	0.85	1.494	0.0402	0.55	0.9883	0.9774	1919214	CBDivE_010205	[O-][N+](=O)c1ccc(cc1)C(=O)CC(NC=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O06	compound treatment	1.214	-0.035	-0.47	1.445	-0.00883	-0.12	-0.419	-0.8599	1919215	CBDivE_010206	Clc1cc(Cl)cc(c1)C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O07	compound treatment	1.268	0.019	0.26	1.467	0.0132	0.18	0.3082	0.9849	1919216	CBDivE_010207	FC(F)Oc1ccccc1NC(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O08	compound treatment	1.254	0.005	0.07	1.506	0.0522	0.71	0.5507	0.7707	1919217	CBDivE_010208	CCC1=NC(=O)C(CC(=O)Nc2ccccc2)c3cc(OC)c(OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O09	compound treatment	1.298	0.049	0.66	1.458	0.00417	0.06	0.5076	0.7651	1919218	CBDivE_010209	OC(=O)CCCC(=O)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O10	compound treatment	1.197	-0.052	-0.7	1.447	-0.00683	-0.09	-0.5619	-0.794	1919219	CBDivE_010210	CC(C)(C)NC(NC(=O)c1cccnc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O11	compound treatment	1.344	0.095	1.28	1.475	0.0212	0.29	1.1104	0.8452	1919220	CBDivE_010211	CCCN(CCC)C/C(=N/O)/C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O12	compound treatment	1.288	0.039	0.53	1.497	0.0432	0.59	0.7883	0.9984	1919221	CBDivE_010212	CCO/C(=C/c1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O13	compound treatment	1.3	0.051	0.69	1.476	0.0222	0.3	0.7003	0.9318	1919222	CBDivE_010213	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2[nH]ncc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O14	compound treatment	1.226	-0.023	-0.31	1.5	0.0462	0.63	0.2258	0.3216	1919223	CBDivE_010214	NC(=S)N/N=C(/CC(C(=O)O)C1=CNC2C=CC=CC21)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O15	compound treatment	1.322	0.073	0.98	1.476	0.0222	0.3	0.9101	0.8835	1618460	CBDivE_010215	Clc1ccc(cc1)C(=O)Oc2c(Cl)cc(Cl)c(Cl)c2CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O16	compound treatment	1.334	0.085	1.15	1.481	0.0272	0.37	1.0728	0.8903	1919224	CBDivE_010216	O=C(CCCC(=O)OCC#C)Nc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O17	compound treatment	1.305	0.056	0.76	1.575	0.121	1.65	1.7026	0.9371	1614742	CBDivE_010217	OC(=O)CCC(=O)Nc1ccccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O18	compound treatment	1.222	-0.027	-0.36	1.504	0.0502	0.68	0.2262	0.2918	1291196	CBDivE_010218	OC(=O)c1nccnc1C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O19	compound treatment	1.361	0.112	1.51	1.522	0.0682	0.93	1.7257	0.9728	1179928	CBDivE_010219	COc1cc2CCNC(c3ccccc3O)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	O20	compound treatment	1.2	-0.049	-0.66	1.467	0.0132	0.18	-0.3404	-0.497	1122872	CBDivE_010220	COc1ccc(cc1)C(=O)c2cc3c(C)c(OC(=O)C)c4ccccc4c3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P01	compound treatment	1.22	-0.029	-0.39	1.443	-0.0108	-0.15	-0.3811	-0.9112	1919225	CBDivE_010221	Nc1ccc(cc1)C(=O)NNC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P02	compound treatment	1.242	-0.007	-0.09	1.431	-0.0228	-0.31	-0.2869	-0.882	1423723	CBDivE_010222	O=C1CCNc2ccc(cc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P03	compound treatment	1.263	0.014	0.19	1.377	-0.0768	-1.05	-0.6073	-0.5705	1334473	CBDivE_010223	Cc1ccc(cc1)N(C(=O)c2ccncc2)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P04	compound treatment	1.17	-0.079	-1.07	1.428	-0.0258	-0.35	-1.0027	-0.8933	1919226	CBDivE_010224	COc1ccc(NC(=O)C2(CCC3CC4CC32)CC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P05	compound treatment	1.191	-0.058	-0.78	1.4	-0.0538	-0.73	-1.0723	-0.9995	1919227	CBDivE_010225	c1csc(c1)c2cn3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P06	compound treatment	1.186	-0.063	-0.85	1.372	-0.0818	-1.12	-1.39	-0.991	1919228	CBDivE_010226	CCCCCc1ccc(nc1)c2ccc(/C=C/C(=O)N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P07	compound treatment	1.209	-0.04	-0.54	1.417	-0.0368	-0.5	-0.7367	-0.9994	1774719	CBDivE_010227	[O-][N+](=O)c1ccccc1C(=O)Oc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P08	compound treatment	1.227	-0.022	-0.3	1.39	-0.0638	-0.87	-0.8253	-0.8975	1692638	CBDivE_010228	CC(C)(C)S(=O)(=O)c1ccc(N)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P09	compound treatment	1.144	-0.105	-1.42	1.345	-0.109	-1.48	-2.051	-0.9997	1391816	CBDivE_010229	CC(=O)Oc1ccc(cc1)N2C(=O)c3ccc(N)cc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P10	compound treatment	0.712	-0.537	-7.24	0.93	-0.524	-7.14	-10.1736	-1.0	1919229	CBDivE_010230	Oc1ccc(Br)cc1/C=N/c2cccc3c(\N=C\c4cc(Br)ccc4O)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P11	compound treatment	1.231	-0.018	-0.24	1.391	-0.0628	-0.86	-0.7775	-0.8732	1775627	CBDivE_010231	[O-][N+](=O)c1ccc2nc(c3ccco3)c(nc2c1)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P12	compound treatment	1.193	-0.056	-0.76	1.353	-0.101	-1.37	-1.5065	-0.9602	1663186	CBDivE_010232	Oc1ccccc1N2C(=O)c3ccc(cc3C2=O)c4ccc5C(=O)N(C(=O)c5c4)c6ccccc6O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P13	compound treatment	1.23	-0.019	-0.26	1.429	-0.0248	-0.34	-0.4207	-0.9906	1211939	CBDivE_010233	Fc1ccccc1C(=O)Oc2cccc3ncccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P14	compound treatment	1.204	-0.045	-0.61	1.414	-0.0398	-0.54	-0.8133	-0.9985	1157579	CBDivE_010234	CC1NC(=O)NC2NC(=O)NC(C)C12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P15	compound treatment	1.265	0.016	0.22	1.433	-0.0208	-0.28	-0.0482	-0.1352	1919230	CBDivE_010235	CCCC(=O)CC1(CCC1)NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P16	compound treatment	1.221	-0.028	-0.38	1.393	-0.0608	-0.83	-0.8537	-0.9366	1919231	CBDivE_010236	Cc1cc(S)n(n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P17	compound treatment	1.17	-0.079	-1.07	1.378	-0.0758	-1.03	-1.4848	-0.9999	1919232	CBDivE_010237	O/N=C(\N1CCCCC1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P18	compound treatment	1.141	-0.108	-1.46	1.475	0.0212	0.29	-0.8261	-0.5562	1919233	CBDivE_010238	CC(C)(C)S(=O)(=O)c1ccsc1S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P19	compound treatment	1.257	0.008	0.11	1.452	-0.00183	-0.02	0.0587	0.5298	1686206	CBDivE_010239	CC(C)(C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.32	P20	compound treatment	1.223	-0.026	-0.35	1.391	-0.0628	-0.86	-0.8539	-0.9223	1919234	CBDivE_010240	CSc1nc(=S)n(c(C)c1C(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A01	compound treatment	1.273	0.0159	0.21	1.428	-0.0122	-0.17	0.0341	0.1256	1919235	CBDivE_010241	FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN4CCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A02	compound treatment	1.293	0.0359	0.48	1.442	0.0018	0.02	0.3599	0.742	1919236	CBDivE_010242	COc1cccc(/C=N/c2ccc(Nc3ccccc3)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A03	compound treatment	1.326	0.0689	0.93	1.495	0.0548	0.75	1.1857	0.9941	1919237	CBDivE_010243	Oc1ccccc1C(=O)NNC(=S)NC(NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A04	compound treatment	1.299	0.0419	0.57	1.428	-0.0122	-0.17	0.2821	0.4788	1919238	CBDivE_010244	COc1cccc(/C=N/NC(=O)C2CC2c3ccccc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A05	compound treatment	1.321	0.0639	0.86	1.506	0.0658	0.9	1.2441	0.9998	1919239	CBDivE_010245	C/C(=N\NC(=O)CCc1ccccc1)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A06	compound treatment	1.257	-9.72E-5	0.0	1.407	-0.0332	-0.45	-0.321	-0.7092	1919240	CBDivE_010246	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)Nc4ccc(cc4Br)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A07	compound treatment	1.37	0.113	1.52	1.554	0.114	1.55	2.1743	1.0	1919241	CBDivE_010247	O/N=C(\C(=O)c1ccco1)/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A08	compound treatment	1.335	0.0779	1.05	1.535	0.0948	1.29	1.6573	0.9947	1609490	CBDivE_010248	COc1ccc(cc1)C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A09	compound treatment	1.377	0.12	1.62	1.437	-0.0032	-0.04	1.113	0.6878	1919242	CBDivE_010249	Cc1cccc(c1)C(=O)Oc2ccc(cc2)C3(OC(=O)c4ccccc43)c5ccc(OC(=O)c6cccc(C)c6)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A10	compound treatment	1.33	0.0729	0.98	1.434	-0.0062	-0.08	0.6357	0.644	1919243	CBDivE_010250	OC(C(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A11	compound treatment	1.323	0.0659	0.89	1.525	0.0848	1.16	1.4464	0.9916	1919244	CBDivE_010251	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C3(CCCC3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A12	compound treatment	1.276	0.0189	0.26	1.484	0.0438	0.6	0.6027	0.928	1919245	CBDivE_010252	CCn1c(C)[n+](CCCS(=O)(=O)O)c2cc(ccc12)S(=O)(=O)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A13	compound treatment	1.355	0.0979	1.32	1.503	0.0628	0.86	1.5395	0.978	1919246	CBDivE_010253	CN1CCN(CCC(=O)N2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A14	compound treatment	1.247	-0.0101	-0.14	1.486	0.0458	0.62	0.3453	0.5402	1919247	CBDivE_010254	COc1cc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A15	compound treatment	1.278	0.0209	0.28	1.509	0.0688	0.94	0.8628	0.8807	1919248	CBDivE_010255	COc1ccc(cc1)N2C(=O)CC(NCc3ccco3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A16	compound treatment	1.251	-0.0061	-0.08	1.458	0.0178	0.24	0.1135	0.4428	1919249	CBDivE_010256	CC(=O)Nc1ccc(cc1[N+](=O)[O-])c2ccc(NC(=O)C)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A17	compound treatment	1.4	0.143	1.93	1.54	0.0998	1.36	2.3255	0.9855	1919250	CBDivE_010257	Oc1ccc(cc1/N=C/c2ccc(s2)[N+](=O)[O-])S(=O)(=O)c3ccc(O)c(/N=C/c4ccc(s4)[N+](=O)[O-])c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A18	compound treatment	1.303	0.0459	0.62	1.421	-0.0192	-0.26	0.2528	0.376	1919251	CBDivE_010258	Oc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(Cl)cc3)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A19	compound treatment	1.313	0.0559	0.75	1.512	0.0718	0.98	1.2256	0.9917	1365627	CBDivE_010259	Cc1ccc(OCC(=O)NCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	A20	compound treatment	1.228	-0.0291	-0.39	1.457	0.0168	0.23	-0.1156	-0.2542	1377033	CBDivE_010260	O=C(CSc1nc2ccccc2[nH]1)Nc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B01	compound treatment	1.265	0.0079	0.11	1.364	-0.0762	-1.04	-0.6593	-0.6312	1919252	CBDivE_010261	O=C1N/C(=N\c2ccccc2)/SC1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B02	compound treatment	1.295	0.0379	0.51	1.464	0.0238	0.32	0.5911	0.9759	1478878	CBDivE_010262	COC(=O)C1CC=CCC1C(=O)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B03	compound treatment	1.265	0.0079	0.11	1.407	-0.0332	-0.45	-0.2447	-0.5262	1919253	CBDivE_010263	Cc1nc2ccc(Cc3ccc4nc(C)n(c5cccc(c5)[N+](=O)[O-])c(=O)c4c3)cc2c(=O)n1c6cccc(c6)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B04	compound treatment	1.268	0.0109	0.15	1.471	0.0308	0.42	0.401	0.9011	1140863	CBDivE_010264	O=C1NC(=O)C(Cc2ccccc2)(Cc3ccccc3)C(=O)N1Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B05	compound treatment	1.259	0.0019	0.03	1.472	0.0318	0.43	0.3248	0.7477	1919254	CBDivE_010265	COc1ccc(cc1)N2C(=O)CC(N3CCN(C)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B06	compound treatment	1.21	-0.0471	-0.64	1.417	-0.0232	-0.32	-0.673	-0.9481	1919255	CBDivE_010266	Cc1cc(C)c(C(=O)/C=C/c2ccccc2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B07	compound treatment	1.29	0.0329	0.44	1.453	0.0128	0.17	0.4373	0.9169	1919256	CBDivE_010267	N/C(=N\[N+](=O)[O-])/N/N=C/c1ccccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B08	compound treatment	1.349	0.0919	1.24	1.393	-0.0472	-0.64	0.4216	0.3018	1919257	CBDivE_010268	C1CCc2c(/N=C/c3ccncc3)cccc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B09	compound treatment	1.226	-0.0311	-0.42	1.486	0.0458	0.62	0.145	0.1927	1392261	CBDivE_010269	Fc1ccc2C(=O)N(C(=O)c2c1)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B10	compound treatment	1.343	0.0859	1.16	1.476	0.0358	0.49	1.1647	0.9262	1638129	CBDivE_010270	CC1=C(C(NC(=O)N1)c2cccc(F)c2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B11	compound treatment	1.258	9.03E-4	0.01	1.395	-0.0452	-0.62	-0.4272	-0.693	1645980	CBDivE_010271	Fc1ccc2C(=O)N(Cc3ccccc3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B12	compound treatment	1.25	-0.0071	-0.1	1.434	-0.0062	-0.08	-0.1275	-0.9981	1919258	CBDivE_010272	Nc1cccc2ccc(cc12)S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B13	compound treatment	1.306	0.0489	0.66	1.371	-0.0692	-0.94	-0.2007	-0.1743	1409959	CBDivE_010273	CCOc1nc(NC(C)(C)CO)nc(OCC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B14	compound treatment	1.218	-0.0391	-0.53	1.462	0.0218	0.3	-0.1627	-0.2688	1576913	CBDivE_010274	COc1cc(ccc1O)C2N(C)c3ccccc3N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B15	compound treatment	1.274	0.0169	0.23	1.419	-0.0212	-0.29	-0.0432	-0.1172	1563240	CBDivE_010275	COc1ccc(cc1)C2CNC(=O)C2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B16	compound treatment	1.212	-0.0451	-0.61	1.429	-0.0112	-0.15	-0.5382	-0.858	1919259	CBDivE_010276	Oc1ccc(O)c(SCCCCN2CCOCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B17	compound treatment	1.264	0.0069	0.09	1.451	0.0108	0.15	0.17	0.9755	1919260	CBDivE_010277	CC(C)(C)c1cc(/C=N/NC(=O)CC2(O)CCCCC2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B18	compound treatment	1.228	-0.0291	-0.39	1.466	0.0258	0.35	-0.0288	-0.0546	1919261	CBDivE_010278	COc1ccc(/C=N/c2ccc(Oc3ccc(cc3)C(C)(C)c4ccc(Oc5ccc(\N=C\c6ccc(OC)cc6)cc5)cc4)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B19	compound treatment	1.246	-0.0111	-0.15	1.38	-0.0602	-0.82	-0.6863	-0.8225	1919262	CBDivE_010279	Brc1ccc(cc1)c2csc(=NC(=O)c3ccccc3)n2c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	B20	compound treatment	1.212	-0.0451	-0.61	1.453	0.0128	0.17	-0.3067	-0.4846	1919263	CBDivE_010280	CCCC1(CCC)C(CC)C1/C(=N/NC(=O)N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C01	compound treatment	1.259	0.0019	0.03	1.419	-0.0212	-0.29	-0.1862	-0.6418	1919264	CBDivE_010281	CCCC(=O)NNC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C02	compound treatment	1.254	-0.0031	-0.04	1.433	-0.0072	-0.1	-0.0989	-0.9276	1919265	CBDivE_010282	COc1cc(/C=N/c2ccc(NC(=O)C)cc2)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C03	compound treatment	1.426	0.169	2.28	1.47	0.0298	0.41	1.8986	0.8203	1919266	CBDivE_010283	CN(C)CCCNC(=O)/C(=C\c1ccc(o1)c2ccc(Cl)cc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C04	compound treatment	1.313	0.0559	0.75	1.39	-0.0502	-0.68	0.0493	0.0484	1010673	CBDivE_010284	Oc1ccccc1c2c3cc(O)c(O)cc3oc4cc(=O)c(O)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C05	compound treatment	1.284	0.0269	0.36	1.509	0.0688	0.94	0.9201	0.9146	1919267	CBDivE_010285	CCCCCCc1cc2cc(/C(=N\NC(=O)c3ccc(cc3)[N+](=O)[O-])/C)c(=O)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C06	compound treatment	1.284	0.0269	0.36	1.5	0.0598	0.82	0.8333	0.9335	1633404	CBDivE_010286	CC(=N)c1c(O)c2c(F)c(F)c(F)c(F)c2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C07	compound treatment	1.397	0.14	1.89	1.478	0.0378	0.52	1.6991	0.8684	1919268	CBDivE_010287	O=C(CCCC(=O)OCC#C)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C08	compound treatment	1.258	9.03E-4	0.01	1.446	0.0058	0.08	0.0646	0.8065	1444397	CBDivE_010288	CCOC(=O)C1=C(CC)NC(=C(C1C(=O)O)C(=O)OCC)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C09	compound treatment	1.295	0.0379	0.51	1.5	0.0598	0.82	0.9382	0.9747	1919269	CBDivE_010289	FC(F)(F)c1ccccc1NC(=O)CCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C10	compound treatment	1.296	0.0389	0.52	1.502	0.0618	0.84	0.967	0.974	1919270	CBDivE_010290	Clc1cccc(c1)c2ccc(/C=N/NC(=O)c3ccc4OCCOc4c3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C11	compound treatment	1.328	0.0709	0.96	1.439	-0.0012	-0.02	0.6648	0.6949	1919271	CBDivE_010291	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(N3CCOCC3)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C12	compound treatment	1.288	0.0309	0.42	1.451	0.0108	0.15	0.399	0.9023	1919272	CBDivE_010292	COc1cc(/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C13	compound treatment	1.335	0.0779	1.05	1.479	0.0388	0.53	1.1173	0.9496	1919273	CBDivE_010293	CSc1nnc(Nc2ccccc2)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C14	compound treatment	1.331	0.0739	1.0	1.496	0.0558	0.76	1.2431	0.9911	1919274	CBDivE_010294	COc1cc(/C=N/NC(=O)C2CC2c3ccccc3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C15	compound treatment	1.358	0.101	1.36	1.486	0.0458	0.62	1.4042	0.9376	1919275	CBDivE_010295	C/C(=N\O)/c1ccc-2c(Cc3ccccc32)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C16	compound treatment	1.243	-0.0141	-0.19	1.463	0.0228	0.31	0.0854	0.2343	1775894	CBDivE_010296	OCC1OC(Nc2cccc(c2)[N+](=O)[O-])C(O)C1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C17	compound treatment	1.322	0.0649	0.88	1.493	0.0528	0.72	1.1283	0.9953	1919276	CBDivE_010297	[O-][N+](=O)c1ccc(/C=N/c2ccc(Cc3ccc(\N=C\c4ccc(s4)[N+](=O)[O-])cc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C18	compound treatment	1.241	-0.0161	-0.22	1.483	0.0428	0.58	0.2592	0.4162	1919277	CBDivE_010298	CC1(C)CC(=O)C(=NNc2ccc3OCOc3c2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C19	compound treatment	1.272	0.0149	0.2	1.518	0.0778	1.06	0.8924	0.8264	1919278	CBDivE_010299	CC(C)c1ccc(C)cc1OCC(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	C20	compound treatment	1.219	-0.0381	-0.51	1.44	-1.97E-4	0.0	-0.3653	-0.7108	1919279	CBDivE_010300	COc1ccc(cc1)C2C3CCc4ccc(OC)cc4C3=NN2/C(=C/C(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D01	compound treatment	1.226	-0.0311	-0.42	1.374	-0.0662	-0.9	-0.9349	-0.9393	1919280	CBDivE_010301	ClC(Cl)(Cl)C(NC(=O)c1ccccc1)Nc2ncccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D02	compound treatment	1.267	0.0099	0.13	1.37	-0.0702	-0.96	-0.5824	-0.6026	1291413	CBDivE_010302	CC(C)(C)C1(O)C(=O)Nc2ccccc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D03	compound treatment	1.133	-0.124	-1.67	1.435	-0.0052	-0.07	-1.2339	-0.7364	1509994	CBDivE_010303	C(C#Cc1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D04	compound treatment	1.254	-0.0031	-0.04	1.402	-0.0382	-0.52	-0.3979	-0.7614	1106675	CBDivE_010304	CN(C)CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D05	compound treatment	1.205	-0.0521	-0.7	1.421	-0.0192	-0.26	-0.6821	-0.9094	1329710	CBDivE_010305	CCN(CC)c1ccc2c(C)c(CN3CCOCC3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D06	compound treatment	1.295	0.0379	0.51	1.466	0.0258	0.35	0.6104	0.9834	1919281	CBDivE_010306	Cc1cc(C)c(C(=O)/C=C/c2ccc(Cl)cc2Cl)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D07	compound treatment	1.27	0.0129	0.17	1.444	0.0038	0.05	0.1597	0.8796	1561164	CBDivE_010307	O=C1CCCc2c1[nH]c3ccc(Oc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D08	compound treatment	1.23	-0.0271	-0.37	1.408	-0.0322	-0.44	-0.569	-0.9959	1919282	CBDivE_010308	CN1CCN(CC(=O)N2CCCC2=O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D09	compound treatment	1.248	-0.0091	-0.12	1.397	-0.0432	-0.59	-0.5033	-0.8365	1919283	CBDivE_010309	Fc1ccc2C(=O)N(CC=C)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D10	compound treatment	1.198	-0.0591	-0.8	1.419	-0.0212	-0.29	-0.7681	-0.9058	1139053	CBDivE_010310	CN1C2CCC1CC(C2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D11	compound treatment	1.216	-0.0411	-0.55	1.506	0.0658	0.9	0.2425	0.2299	1616962	CBDivE_010311	O=C1CCCCC1CN(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D12	compound treatment	1.296	0.0389	0.52	1.478	0.0378	0.52	0.7356	1.0	1489098	CBDivE_010312	CN1C2CCC1CC(C2)OC(=O)CCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D13	compound treatment	1.335	0.0779	1.05	1.439	-0.0012	-0.02	0.7316	0.696	1919284	CBDivE_010313	[O-][N+](=O)c1ccc(/C=N/Nc2nnc3c4ccccc4[nH]c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D14	compound treatment	1.242	-0.0151	-0.2	1.399	-0.0412	-0.56	-0.5413	-0.9058	1519165	CBDivE_010314	Cn1c(=O)n(C)c2c(Br)nccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D15	compound treatment	1.197	-0.0601	-0.81	1.448	0.0078	0.11	-0.4981	-0.6091	1199994	CBDivE_010315	CCOC(=O)c1c(C)nc(C)cc1N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D16	compound treatment	1.261	0.0039	0.05	1.373	-0.0672	-0.92	-0.6107	-0.6654	1919285	CBDivE_010316	CN1CCN(CC1)c2c(nc(C)n2Cc3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D17	compound treatment	1.217	-0.0401	-0.54	1.424	-0.0162	-0.22	-0.5387	-0.9219	1919286	CBDivE_010317	CC(=O)Nc1ccc(cc1)c2ccc(OCc3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D18	compound treatment	1.226	-0.0311	-0.42	1.419	-0.0212	-0.29	-0.501	-0.9835	1919287	CBDivE_010318	[O-][N+](=O)c1ccccc1Oc2ccc(cc2)C(C3C(=O)c4ccccc4C3=O)C5C(=O)c6ccccc6C5=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D19	compound treatment	1.312	0.0549	0.74	1.483	0.0428	0.58	0.9365	0.993	1919288	CBDivE_010319	C/C(=N\NC(=O)Cc1ccccc1)/c2ccc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	D20	compound treatment	1.237	-0.0201	-0.27	1.454	0.0138	0.19	-0.0586	-0.1776	1919289	CBDivE_010320	COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E01	compound treatment	1.314	0.0569	0.77	1.439	-0.0012	-0.02	0.5313	0.6919	1622729	CBDivE_010321	Cc1ccc(cc1)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E02	compound treatment	1.255	-0.0021	-0.03	1.438	-0.0022	-0.03	-0.0412	-0.9996	1919290	CBDivE_010322	COc1cc(/C=N/c2cccc3c(=O)[nH][nH]c(=O)c23)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E03	compound treatment	1.288	0.0309	0.42	1.448	0.0078	0.11	0.37	0.86	1919291	CBDivE_010323	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E04	compound treatment	1.297	0.0399	0.54	1.489	0.0488	0.67	0.8512	0.9945	1919292	CBDivE_010324	CCOC(=O)CNC(=O)C1=C(CCCC1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E05	compound treatment	1.319	0.0619	0.84	1.466	0.0258	0.35	0.8393	0.9262	1919293	CBDivE_010325	NCC(O)COCCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E06	compound treatment	1.236	-0.0211	-0.28	1.469	0.0288	0.39	0.0765	0.1577	1614241	CBDivE_010326	OCCN(CCO)C1=CC(=O)OC21CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E07	compound treatment	1.308	0.0509	0.69	1.577	0.137	1.87	1.8047	0.9078	1919294	CBDivE_010327	CC(=O)c1ccc(NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E08	compound treatment	1.278	0.0209	0.28	1.487	0.0468	0.64	0.6507	0.9326	1243741	CBDivE_010328	CCOC(=O)C1=C(C)NC2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E09	compound treatment	1.42	0.163	2.2	1.475	0.0348	0.47	1.8896	0.8404	1544797	CBDivE_010329	Clc1cccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E10	compound treatment	1.282	0.0249	0.34	1.484	0.0438	0.6	0.6599	0.963	1919295	CBDivE_010330	Cc1ccccc1OCC(=O)N/N=C/C=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E11	compound treatment	1.334	0.0769	1.04	1.522	0.0818	1.12	1.5224	0.9993	1919296	CBDivE_010331	CCC(C)(Nc1ccc(Cl)cc1)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E12	compound treatment	1.254	-0.0031	-0.04	1.47	0.0298	0.41	0.2578	0.6311	1919297	CBDivE_010332	COc1cc(/C=N/c2cccc3c(\N=C\c4ccc(O)c(OC)c4)cccc23)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E13	compound treatment	1.301	0.0439	0.59	1.487	0.0468	0.64	0.8701	0.9993	1561305	CBDivE_010333	CC(C)(C)c1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E14	compound treatment	1.245	-0.0121	-0.16	1.435	-0.0052	-0.07	-0.1655	-0.9303	1919298	CBDivE_010334	Cc1cc(C)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E15	compound treatment	1.351	0.0939	1.27	1.444	0.0038	0.05	0.9324	0.7354	1133150	CBDivE_010335	Cc1nc(C)c2c(=O)n(c3ccccc3)c(=O)[nH]c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E16	compound treatment	1.259	0.0019	0.03	1.413	-0.0272	-0.37	-0.2441	-0.6566	1236332	CBDivE_010336	COc1ccccc1NC(=O)C2CC=CCC2C(=O)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E17	compound treatment	1.327	0.0699	0.94	1.424	-0.0162	-0.22	0.5106	0.5272	1872732	CBDivE_010337	[O-][N+](=O)c1ccc(s1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E18	compound treatment	1.253	-0.0041	-0.06	1.462	0.0218	0.3	0.1711	0.5659	1919299	CBDivE_010338	Clc1ccccc1C2SC(=N)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E19	compound treatment	1.331	0.0739	1.0	1.506	0.0658	0.9	1.3395	0.9986	1919300	CBDivE_010339	CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc3ccc(cc3)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	E20	compound treatment	1.301	0.0439	0.59	1.448	0.0078	0.11	0.494	0.821	1919301	CBDivE_010340	COc1ccc(cc1)C2C3CCc4cc(OC)ccc4C3=NN2/C(=C/C(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F01	compound treatment	1.211	-0.0461	-0.62	1.374	-0.0662	-0.9	-1.078	-0.9835	1336619	CBDivE_010341	CN(C)CCOC(=O)NC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F02	compound treatment	1.21	-0.0471	-0.64	1.379	-0.0612	-0.83	-1.0394	-0.9909	1919302	CBDivE_010342	Nc1ccc2C3c4ccccc4C(c2c1)c5cc(N)ccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F03	compound treatment	1.179	-0.0781	-1.05	1.421	-0.0192	-0.26	-0.9301	-0.8568	1123996	CBDivE_010343	CC(Oc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F04	compound treatment	1.232	-0.0251	-0.34	1.353	-0.0872	-1.19	-1.0802	-0.8737	1563269	CBDivE_010344	CC(=C1C(=O)NC(=O)NC1=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F05	compound treatment	1.281	0.0239	0.32	1.457	0.0168	0.23	0.39	0.986	1919303	CBDivE_010345	CCN/C(=N\CC)/SC1CC(=O)N(C1=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F06	compound treatment	1.207	-0.0501	-0.68	1.387	-0.0532	-0.73	-0.9908	-0.9994	1919304	CBDivE_010346	Cc1cc(C)c(C(=O)/C=C/c2ccccc2Cl)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F07	compound treatment	1.263	0.0059	0.08	1.389	-0.0512	-0.7	-0.4374	-0.6224	1919305	CBDivE_010347	Oc1ccc(SCCCCCN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F08	compound treatment	1.271	0.0139	0.19	1.452	0.0118	0.16	0.2464	0.9971	1919306	CBDivE_010348	Cc1cc(C)c(NC(=O)CNC2CC(C)(C)NC(C)(C)C2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F09	compound treatment	1.182	-0.0751	-1.01	1.443	0.0028	0.04	-0.6894	-0.6799	1919307	CBDivE_010349	CCN1C(=O)c2ccc(F)cc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F10	compound treatment	1.24	-0.0171	-0.23	1.455	0.0148	0.2	-0.0204	-0.0664	1409643	CBDivE_010350	CN1C2CCC1CC(C2)OC(=O)CCN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F11	compound treatment	1.214	-0.0431	-0.58	1.488	0.0478	0.65	0.0498	0.057	1774883	CBDivE_010351	[O-][N+](=O)c1cccc(c1)C(=O)OCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F12	compound treatment	1.152	-0.105	-1.42	1.413	-0.0272	-0.37	-1.2648	-0.863	1312254	CBDivE_010352	CC1(C)CC(O)(CC(C)(C)N1)C2(O)CC(C)(C)NC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F13	compound treatment	1.236	-0.0211	-0.28	1.472	0.0318	0.43	0.1054	0.2032	1919308	CBDivE_010353	CCOC(=O)/C=C/1\CC(=O)Nc2nonc2N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F14	compound treatment	1.208	-0.0491	-0.66	1.442	0.0018	0.02	-0.451	-0.6804	1919309	CBDivE_010354	Cn1c(=O)n(C)c2c(ncc(Br)c12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F15	compound treatment	1.272	0.0149	0.2	1.457	0.0168	0.23	0.3042	0.9979	1573763	CBDivE_010355	CCOC(=O)C(C1CCCCC1)C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F16	compound treatment	1.196	-0.0611	-0.82	1.409	-0.0312	-0.43	-0.8836	-0.9527	1636330	CBDivE_010356	CN1C(N(C)c2ccccc12)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F17	compound treatment	1.197	-0.0601	-0.81	1.479	0.0388	0.53	-0.1991	-0.2057	1919310	CBDivE_010357	CC(=O)Nc1ccc(cc1)c2ccc(OCc3ccccc3F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F18	compound treatment	1.265	0.0079	0.11	1.448	0.0078	0.11	0.1506	1.0	1919311	CBDivE_010358	O=C/1Nc2ccccc2\C1=N\c3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F19	compound treatment	1.202	-0.0551	-0.74	1.483	0.0428	0.58	-0.1129	-0.1194	1008390	CBDivE_010359	[O-][N+](=O)c1ccc(NN=Nc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	F20	compound treatment	1.212	-0.0451	-0.61	1.393	-0.0472	-0.64	-0.8853	-0.9996	1919312	CBDivE_010360	COc1ccc(cc1)C(=O)/C=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G01	compound treatment	1.25	-0.0071	-0.1	1.44	-1.97E-4	0.0	-0.0696	-0.7267	1352640	CBDivE_010361	OC(=O)C(Cc1ccccc1)NC(=O)COc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G02	compound treatment	1.216	-0.0411	-0.55	1.403	-0.0372	-0.51	-0.7507	-0.999	1919313	CBDivE_010362	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G03	compound treatment	1.215	-0.0421	-0.57	1.47	0.0298	0.41	-0.1142	-0.1635	1919314	CBDivE_010363	CCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(N3CCOCC3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G04	compound treatment	1.289	0.0319	0.43	1.459	0.0188	0.26	0.4856	0.9694	1919315	CBDivE_010364	Cc1c(C(c2c(C)n(C)n(c3ccccc3)c2=O)c4ccccc4)c(=O)n(c5ccccc5)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G05	compound treatment	1.265	0.0079	0.11	1.448	0.0078	0.11	0.1506	1.0	1919316	CBDivE_010365	Cc1cc(O)c(C2=NCCSC(C2)c3cc(ccc3O)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G06	compound treatment	1.252	-0.0051	-0.07	1.402	-0.0382	-0.52	-0.4169	-0.7936	1919317	CBDivE_010366	FC(F)(F)C1=Nc2ccccc2NC(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G07	compound treatment	1.277	0.0199	0.27	1.445	0.0048	0.07	0.2362	0.8545	1187738	CBDivE_010367	Nc1cccc2C(=O)N(C(=O)c21)c3ccccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G08	compound treatment	1.256	-0.0011	-0.01	1.437	-0.0032	-0.04	-0.0413	-0.8969	1136705	CBDivE_010368	OCCN(CCO)Cn1c(=S)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G09	compound treatment	1.281	0.0239	0.32	1.488	0.0478	0.65	0.6889	0.9473	1126057	CBDivE_010369	O=C(NCCc1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G10	compound treatment	1.277	0.0199	0.27	1.505	0.0648	0.88	0.8147	0.8821	1919318	CBDivE_010370	CC1(C)CC(=O)C(=CNCCO)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G11	compound treatment	1.343	0.0859	1.16	1.493	0.0528	0.72	1.3286	0.9738	1919319	CBDivE_010371	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(C)(C)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G12	compound treatment	1.18	-0.0771	-1.04	1.472	0.0318	0.43	-0.4288	-0.3805	1919320	CBDivE_010372	COc1cc(/C=N/Nc2ccc(cc2)[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G13	compound treatment	1.289	0.0319	0.43	1.466	0.0258	0.35	0.5531	0.995	1919321	CBDivE_010373	[O-][N+](=O)c1ccc2NC(=O)/C(=N\NC(=O)C3CC3(c4ccccc4)c5ccccc5)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G14	compound treatment	1.301	0.0439	0.59	1.43	-0.0102	-0.14	0.3205	0.5268	1919322	CBDivE_010374	COc1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G15	compound treatment	1.327	0.0699	0.94	1.542	0.102	1.39	1.6484	0.9823	1919323	CBDivE_010375	CCN(CC)c1ccc(/C=N/NC(=O)C2CC2c3ccccc3)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G16	compound treatment	1.249	-0.0081	-0.11	1.501	0.0608	0.83	0.509	0.6087	1496299	CBDivE_010376	CCOC(=O)c1c(oc2cc(CN(C)C)c(O)c(CN(C)C)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G17	compound treatment	1.321	0.0639	0.86	1.477	0.0368	0.5	0.9645	0.9668	1919324	CBDivE_010377	CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G18	compound treatment	1.263	0.0059	0.08	1.423	-0.0172	-0.23	-0.1095	-0.4422	1919325	CBDivE_010378	O/N=C/1\C2CN3CC1(CN(C2)CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G19	compound treatment	1.323	0.0659	0.89	1.512	0.0718	0.98	1.321	0.9988	1919326	CBDivE_010379	COC(=O)c1ccc(N=NNc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	G20	compound treatment	1.273	0.0159	0.21	1.412	-0.0282	-0.38	-0.1202	-0.273	1610357	CBDivE_010380	O=C(N1CCCC1)C2(CC3CC4C2)CC(C3)CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H01	compound treatment	1.21	-0.0471	-0.64	1.318	-0.122	-1.67	-1.6276	-0.9126	1919327	CBDivE_010381	O=C1CC(N(Cc2ccccc2)Cc3ccccc3)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H02	compound treatment	1.223	-0.0341	-0.46	1.42	-0.0202	-0.28	-0.52	-0.9699	1243334	CBDivE_010382	CC1=C(C)CC(C(C1)C(=O)O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H03	compound treatment	1.274	0.0169	0.23	1.387	-0.0532	-0.73	-0.3517	-0.4625	1151245	CBDivE_010383	Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H04	compound treatment	1.275	0.0179	0.24	1.39	-0.0502	-0.68	-0.3132	-0.4315	1919328	CBDivE_010384	C/C(=C/1\C(=O)NC(=O)N(Cc2ccccc2)C1=O)/NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H05	compound treatment	1.182	-0.0751	-1.01	1.412	-0.0282	-0.38	-0.9883	-0.912	1919329	CBDivE_010385	COc1ccccc1N2C(=O)CC(N3CCN(CC3)c4ccc(Cl)cc4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H06	compound treatment	1.251	-0.0061	-0.08	1.392	-0.0482	-0.66	-0.5229	-0.7894	1919330	CBDivE_010386	Cc1cc(C)c(C(=O)/C=C/c2cccc3ccccc23)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H07	compound treatment	1.21	-0.0471	-0.64	1.407	-0.0332	-0.45	-0.7694	-0.9862	1919331	CBDivE_010387	Oc1ccc(SCCCCN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H08	compound treatment	1.263	0.0059	0.08	1.4	-0.0402	-0.55	-0.3313	-0.5981	1919332	CBDivE_010388	CCCCNC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H09	compound treatment	1.211	-0.0461	-0.62	1.384	-0.0562	-0.77	-0.9816	-0.9946	1919333	CBDivE_010389	NC(=N)N/N=C/c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H10	compound treatment	1.248	-0.0091	-0.12	1.439	-0.0012	-0.02	-0.0983	-0.7942	1396200	CBDivE_010390	CCC(CC)COC(=O)C1=C(C)NC(=O)NC1c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H11	compound treatment	1.369	0.112	1.51	1.395	-0.0452	-0.62	0.6317	0.3874	1029030	CBDivE_010391	OC(Cc1cccnc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H12	compound treatment	1.241	-0.0161	-0.22	1.443	0.0028	0.04	-0.1265	-0.5739	1718227	CBDivE_010392	Cn1cnc2c(nccc12)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H13	compound treatment	1.325	0.0679	0.92	1.546	0.106	1.44	1.6679	0.976	1081216	CBDivE_010393	Cn1c2ccccc2c3nnc(S)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H14	compound treatment	1.248	-0.0091	-0.12	1.433	-0.0072	-0.1	-0.1562	-0.9939	1510797	CBDivE_010394	O=c1[nH]c2cnccc2n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H15	compound treatment	1.213	-0.0441	-0.59	1.405	-0.0352	-0.48	-0.76	-0.9943	1408250	CBDivE_010395	CCOC(=O)C(C1CCCCC1)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H16	compound treatment	1.167	-0.0901	-1.22	1.443	0.0028	0.04	-0.8324	-0.6845	1723898	CBDivE_010396	C1CCc2c(C1)sc3ncnc(Nc4ccncc4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H17	compound treatment	1.219	-0.0381	-0.51	1.462	0.0218	0.3	-0.1532	-0.258	1919334	CBDivE_010397	O=C(NN=C1CCCC1)c2cccc(n2)C(=O)NN=C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H18	compound treatment	1.257	-9.72E-5	0.0	1.355	-0.0852	-1.16	-0.8224	-0.7079	1919335	CBDivE_010398	Cc1cc(C)c(/N=C/2\C(=O)Nc3ccccc23)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H19	compound treatment	1.236	-0.0211	-0.28	1.463	0.0228	0.31	0.0186	0.0442	1919336	CBDivE_010399	FC(F)(F)C(=O)c1ccc2c(n[nH]c(c3ccccc3)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	H20	compound treatment	1.232	-0.0251	-0.34	1.431	-0.0092	-0.13	-0.3281	-0.9087	1919337	CBDivE_010400	[O-][N+](=O)c1ccc(/C=N/n2cnnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I01	compound treatment	1.264	0.0069	0.09	1.425	-0.0152	-0.21	-0.0807	-0.3552	1607964	CBDivE_010401	Cc1ccc(OCC(=O)NC(Cc2ccccc2)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I02	compound treatment	1.208	-0.0491	-0.66	1.437	-0.0032	-0.04	-0.4992	-0.752	1919338	CBDivE_010402	COc1cc(/C=N/NC(=O)c2ccccc2O)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I03	compound treatment	1.322	0.0649	0.88	1.5	0.0598	0.82	1.1958	0.9994	1919339	CBDivE_010403	CCCCCCC(=O)NC(NCc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I04	compound treatment	1.218	-0.0391	-0.53	1.438	-0.0022	-0.03	-0.3941	-0.7461	1919340	CBDivE_010404	CC1CCC(NCN2CCOCC2)C(C1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I05	compound treatment	1.261	0.0039	0.05	1.434	-0.0062	-0.08	-0.0225	-0.2263	1919341	CBDivE_010405	COc1ccccc1NC(=O)CCCCCCC(=O)Nc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I06	compound treatment	1.236	-0.0211	-0.28	1.478	0.0378	0.52	0.1633	0.2772	1919342	CBDivE_010406	FC(F)C(=O)/C=C\1/Nc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I07	compound treatment	1.31	0.0529	0.71	1.497	0.0568	0.77	1.0524	0.9992	1919343	CBDivE_010407	OC(=O)c1cccc(c1)N2C(=O)c3ccc(cc3C2=O)C(=O)c4ccc5C(=O)N(C(=O)c5c4)c6cccc(c6)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I08	compound treatment	1.252	-0.0051	-0.07	1.475	0.0348	0.47	0.287	0.5984	1355286	CBDivE_010408	Clc1ccc(OCc2nc3ccccc3n2S(=O)(=O)c4cccc5nsnc45)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I09	compound treatment	1.295	0.0379	0.51	1.495	0.0548	0.75	0.89	0.9829	1919344	CBDivE_010409	OC(=O)COc1ccc2cc(Br)ccc2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I10	compound treatment	1.266	0.0089	0.12	1.431	-0.0092	-0.13	-0.0038	-0.0216	1919345	CBDivE_010410	Oc1ccccc1/C=N/N=C2c3ccccc3-c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I11	compound treatment	1.357	0.0999	1.35	1.522	0.0818	1.12	1.7418	0.9956	1919346	CBDivE_010411	CN(C)C(c1nnnn1C(/C=C\c2ccc(Cl)cc2Cl)C(C)(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I12	compound treatment	1.225	-0.0321	-0.43	1.505	0.0648	0.88	0.3187	0.3238	1919347	CBDivE_010412	COc1cc(/C=N/c2ccc(cc2C)c3ccc(\N=C\c4ccc(O)c(OC)c4)c(C)c3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I13	compound treatment	1.346	0.0889	1.2	1.456	0.0158	0.22	1.0004	0.821	1919348	CBDivE_010413	[O-][N+](=O)c1ccc2NC(=O)/C(=N\NC(=O)COc3ccccc3)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I14	compound treatment	1.275	0.0179	0.24	1.445	0.0048	0.07	0.2171	0.8675	1919349	CBDivE_010414	COc1ccc(/C=N/c2ccc(Cc3ccc(\N=C\c4ccc(OC)c(O)c4)cc3)cc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I15	compound treatment	1.31	0.0529	0.71	1.492	0.0518	0.71	1.0042	1.0	1260255	CBDivE_010415	CCN(CC)c1ccc(C2N(Cc3ccccc3)CCN2Cc4ccccc4)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I16	compound treatment	1.25	-0.0071	-0.1	1.455	0.0148	0.2	0.075	0.3358	1267690	CBDivE_010416	CCOC(=O)C1=C(C)NC2=C(C1c3cc(Br)cs3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I17	compound treatment	1.33	0.0729	0.98	1.513	0.0728	0.99	1.3974	1.0	1380535	CBDivE_010417	CCN(CC)c1ccc(C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I18	compound treatment	1.259	0.0019	0.03	1.478	0.0378	0.52	0.3827	0.7414	1919350	CBDivE_010418	NC(=S)NC1C2CN3CC1(CN(C2)CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I19	compound treatment	1.343	0.0859	1.16	1.419	-0.0212	-0.29	0.6151	0.515	1919351	CBDivE_010419	COc1cc(ccc1NN=Nc2cccc(Br)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	I20	compound treatment	1.303	0.0459	0.62	1.447	0.0068	0.09	0.5035	0.8041	1369943	CBDivE_010420	Cc1[nH]c(nc1C2(CC3CC4CC(C3)C2)C4)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J01	compound treatment	1.213	-0.0441	-0.59	1.415	-0.0252	-0.34	-0.6636	-0.966	1919352	CBDivE_010421	Clc1ccc2n(C=C3CC(=Cn4c5ccc(Cl)cc5c6cc(Cl)ccc46)C3)c7ccc(Cl)cc7c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J02	compound treatment	1.236	-0.0211	-0.28	1.436	-0.0042	-0.06	-0.2417	-0.8326	1919353	CBDivE_010422	C/C(=C/1\C(=O)NC(=O)N(Cc2ccccc2)C1=O)/Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J03	compound treatment	1.183	-0.0741	-1.0	1.401	-0.0392	-0.53	-1.0848	-0.957	1734595	CBDivE_010423	c1cc(ccn1)c2nc3cnccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J04	compound treatment	1.225	-0.0321	-0.43	1.417	-0.0232	-0.32	-0.5299	-0.9881	1148068	CBDivE_010424	CN(C)c1ccc2nc3c(=O)[nH]c(=O)nc3[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J05	compound treatment	1.209	-0.0481	-0.65	1.419	-0.0212	-0.29	-0.6632	-0.9337	1919354	CBDivE_010425	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccc4OC)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J06	compound treatment	1.209	-0.0481	-0.65	1.35	-0.0902	-1.23	-1.3285	-0.9553	1774884	CBDivE_010426	[O-][N+](=O)c1ccc(cc1)C(=O)OCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J07	compound treatment	1.26	0.0029	0.04	1.402	-0.0382	-0.52	-0.3406	-0.6521	1353434	CBDivE_010427	CC(C)(C)Nc1nc(Cl)nc(NC2CCCCC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J08	compound treatment	1.248	-0.0091	-0.12	1.435	-0.0052	-0.07	-0.1369	-0.966	1474431	CBDivE_010428	CN1CCN(CC1)C(=O)c2sc3ccccc3c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J09	compound treatment	1.222	-0.0351	-0.47	1.438	-0.0022	-0.03	-0.356	-0.7504	1919355	CBDivE_010429	CCOC(=O)c1c(C)c(sc1N)/C(=N\Nc2cccc(c2)[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J10	compound treatment	1.216	-0.0411	-0.55	1.43	-0.0102	-0.14	-0.4904	-0.8579	1033092	CBDivE_010430	CC1=NN(C(=O)C1)c2cc(Cl)c(cc2Cl)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J11	compound treatment	1.245	-0.0121	-0.16	1.419	-0.0212	-0.29	-0.3198	-0.9634	1157307	CBDivE_010431	COc1ccc(cc1)C(O)Cc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J12	compound treatment	1.209	-0.0481	-0.65	1.449	0.0088	0.12	-0.3739	-0.5667	1919356	CBDivE_010432	COc1ccc(cc1)c2n(C)c3ccccc3[n+]2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J13	compound treatment	1.26	0.0029	0.04	1.406	-0.0342	-0.47	-0.3021	-0.6455	1919357	CBDivE_010433	CC(C)(C)c1cc(CNCCO)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J14	compound treatment	1.207	-0.0501	-0.68	1.338	-0.102	-1.39	-1.4633	-0.9448	1919358	CBDivE_010434	Cc1nc([N+](=O)[O-])c(N2CCOCC2)n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J15	compound treatment	1.212	-0.0451	-0.61	1.451	0.0108	0.15	-0.326	-0.5208	1919359	CBDivE_010435	COc1cc(/C=N/c2ccc(NC(=O)C)cc2)cc(Br)c1OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J16	compound treatment	1.139	-0.118	-1.59	1.454	0.0138	0.19	-0.9935	-0.6193	1103189	CBDivE_010436	C1CCN(CC1)c2ncnc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J17	compound treatment	1.206	-0.0511	-0.69	1.472	0.0318	0.43	-0.1808	-0.222	1919360	CBDivE_010437	[O-][N+](=O)c1cc(Cl)ccc1NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J18	compound treatment	1.155	-0.102	-1.38	1.414	-0.0262	-0.36	-1.2265	-0.862	1919361	CBDivE_010438	CC1(C)CC1C(=O)Oc2ccc(cc2)C3(OC(=O)c4ccccc43)c5cccc(OC(=O)C6CC6(C)C)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J19	compound treatment	1.222	-0.0351	-0.47	1.48	0.0398	0.54	0.049	0.068	1919362	CBDivE_010439	COc1ccc(cc1)/C(=N\Nc2ccc(cc2)[N+](=O)[O-])/N=Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	J20	compound treatment	1.264	0.0069	0.09	1.442	0.0018	0.02	0.0832	0.8642	1919363	CBDivE_010440	CC/1=CC(=[N+](CCO)CCO)C=C\C1=C(\c2ccc(cc2)[N+](=O)[O-])/c3ccc(cc3C)N(CCO)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K01	compound treatment	1.308	0.0509	0.69	1.447	0.0068	0.09	0.5512	0.7954	1254482	CBDivE_010441	Cc1ccc(OCC(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K02	compound treatment	1.254	-0.0031	-0.04	1.429	-0.0112	-0.15	-0.1375	-0.8687	1919364	CBDivE_010442	COc1cc(/C=N/NC(=O)c2cccc(C)c2)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K03	compound treatment	1.258	9.03E-4	0.01	1.447	0.0068	0.09	0.0742	0.7931	1219316	CBDivE_010443	Cc1oc2cc(OCc3ccccc3)ccc2c(=O)c1c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K04	compound treatment	1.215	-0.0421	-0.57	1.414	-0.0262	-0.36	-0.6542	-0.975	1233656	CBDivE_010444	Cc1cccc(C)c1NC(=O)C(C)(C)NC(=O)CN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K05	compound treatment	1.337	0.0799	1.08	1.447	0.0068	0.09	0.8278	0.7651	1919365	CBDivE_010445	O=C(CCCCCCC(=O)NCCc1ccccc1)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K06	compound treatment	1.267	0.0099	0.13	1.448	0.0078	0.11	0.1697	0.9936	1919366	CBDivE_010446	CCOC(=O)c1c(C)[nH]nc1c2c(O)c(F)c(F)c(F)c2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K07	compound treatment	1.244	-0.0131	-0.18	1.483	0.0428	0.58	0.2878	0.4719	1919367	CBDivE_010447	[O-][N+](=O)c1ccccc1S(=O)(=O)Oc2ccc(cc2)S(=O)(=O)c3ccc(OS(=O)(=O)c4ccccc4[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K08	compound treatment	1.231	-0.0261	-0.35	1.437	-0.0032	-0.04	-0.2798	-0.7887	1919368	CBDivE_010448	Oc1ccc(Br)cc1/C=N/NC(=O)/C(=C\c2cccs2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K09	compound treatment	1.266	0.0089	0.12	1.471	0.0308	0.42	0.3819	0.8743	1332123	CBDivE_010449	COC(=O)C(CC(C)C)NC(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K10	compound treatment	1.245	-0.0121	-0.16	1.474	0.0338	0.46	0.2105	0.4306	1775960	CBDivE_010450	OC(=O)c1cc(ccc1O)N2C(=O)c3ccc(cc3C2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K11	compound treatment	1.304	0.0469	0.63	1.429	-0.0112	-0.15	0.3395	0.5215	1919369	CBDivE_010451	CCC(C)(N1CCOCC1)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K12	compound treatment	1.244	-0.0131	-0.18	1.439	-0.0012	-0.02	-0.1365	-0.7692	1919370	CBDivE_010452	COc1cc(/C=N/NC(=O)COc2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K13	compound treatment	1.288	0.0309	0.42	1.461	0.0208	0.28	0.4954	0.9824	1210834	CBDivE_010453	Cc1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K14	compound treatment	1.208	-0.0491	-0.66	1.463	0.0228	0.31	-0.2485	-0.3396	1386871	CBDivE_010454	COc1ccc(cc1O)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K15	compound treatment	1.29	0.0329	0.44	1.501	0.0608	0.83	0.9002	0.9571	1919371	CBDivE_010455	COc1cccc(/C=N/c2ccc(\N=C\c3cccc(OC)c3O)c(Cl)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K16	compound treatment	1.261	0.0039	0.05	1.484	0.0438	0.6	0.4596	0.7665	1194684	CBDivE_010456	CCOC(=O)C1=C(C)NC2=C(C1c3cc(C)ccc3C)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K17	compound treatment	1.296	0.0389	0.52	1.449	0.0088	0.12	0.456	0.847	1423493	CBDivE_010457	COc1cccc(C2N(Cc3ccccc3)CCN2Cc4ccccc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K18	compound treatment	1.244	-0.0131	-0.18	1.449	0.0088	0.12	-0.0401	-0.1875	1513627	CBDivE_010458	Clc1ccc(cc1)S(=O)(=O)n2c(Cc3ccccc3)nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K19	compound treatment	1.318	0.0609	0.82	1.528	0.0878	1.2	1.4276	0.9831	1919372	CBDivE_010459	CCOc1ccc(NC(=N)NC(=N)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	K20	compound treatment	1.277	0.0199	0.27	1.504	0.0638	0.87	0.8051	0.8842	1039810	CBDivE_010460	CN(C)N1C(=O)c2c(C1=O)c(Br)c(Br)c(Br)c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L01	compound treatment	1.203	-0.0541	-0.73	1.414	-0.0262	-0.36	-0.7687	-0.946	1205692	CBDivE_010461	CCOC(=O)C1=C(C)NC(=C(C1c2ccc(O)cc2)C(=O)OCC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L02	compound treatment	1.207	-0.0501	-0.68	1.373	-0.0672	-0.92	-1.1258	-0.9888	1919373	CBDivE_010462	CN1C(=O)N(C)C(=O)C(=Cc2ccc(O)c(O)c2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L03	compound treatment	1.254	-0.0031	-0.04	1.389	-0.0512	-0.7	-0.5232	-0.7481	1919374	CBDivE_010463	COc1ccc(cc1)N2C(=O)CC(N(C)Cc3ccccc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L04	compound treatment	1.198	-0.0591	-0.8	1.365	-0.0752	-1.03	-1.2888	-0.9923	1919375	CBDivE_010464	Oc1nc2SCCCn2c(=O)c1C(c3ccc(Cl)cc3)c4c(O)nc5SCCCn5c4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L05	compound treatment	1.134	-0.123	-1.66	1.456	0.0158	0.22	-1.0219	-0.6102	1472362	CBDivE_010465	Clc1ccc(cc1Cl)N2C(=O)CC(SCC(=O)Nc3ccc(Br)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L06	compound treatment	1.249	-0.0081	-0.11	1.376	-0.0642	-0.88	-0.6963	-0.7892	1687107	CBDivE_010466	CN1CCC(O)(CC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L07	compound treatment	1.195	-0.0621	-0.84	1.427	-0.0132	-0.18	-0.7196	-0.8399	1606691	CBDivE_010467	CC(C)(C)Nc1nc(Cl)nc(NCCO)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L08	compound treatment	1.205	-0.0521	-0.7	1.443	0.0028	0.04	-0.4699	-0.6677	1919376	CBDivE_010468	CCOC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L09	compound treatment	1.25	-0.0071	-0.1	1.422	-0.0182	-0.25	-0.2432	-0.9142	1067367	CBDivE_010469	CC(=O)CCN(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L10	compound treatment	1.219	-0.0381	-0.51	1.378	-0.0622	-0.85	-0.9632	-0.9712	1669228	CBDivE_010470	COc1cccc2cc(c3nc4ccccc4[nH]3)c(=N)oc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L11	compound treatment	1.216	-0.0411	-0.55	1.392	-0.0482	-0.66	-0.8568	-0.9964	1661797	CBDivE_010471	OC1CCCCC1CN(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L12	compound treatment	1.223	-0.0341	-0.46	1.394	-0.0462	-0.63	-0.7707	-0.9881	1919377	CBDivE_010472	Cc1cc-2c(CCCCc3nnnn32)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L13	compound treatment	1.27	0.0129	0.17	1.425	-0.0152	-0.21	-0.0235	-0.0867	1577618	CBDivE_010473	OC(=O)C1C(CNC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L14	compound treatment	1.235	-0.0221	-0.3	1.377	-0.0632	-0.86	-0.8202	-0.8994	1919378	CBDivE_010474	CC1(C)CC(C)(C)N=C(O1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L15	compound treatment	1.247	-0.0101	-0.14	1.379	-0.0612	-0.83	-0.6864	-0.8118	1919379	CBDivE_010475	CN(CC(=O)N1CCCC1=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L16	compound treatment	1.219	-0.0381	-0.51	1.408	-0.0322	-0.44	-0.6739	-0.9969	1266096	CBDivE_010476	CSCCC(Nc1ncnc2sc3CCCCc3c12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L17	compound treatment	1.26	0.0029	0.04	1.431	-0.0092	-0.13	-0.061	-0.4642	1919380	CBDivE_010477	CN1CCN(CC1)c2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L18	compound treatment	1.24	-0.0171	-0.23	1.408	-0.0322	-0.44	-0.4736	-0.9548	1299550	CBDivE_010478	OCC1N(CCN1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L19	compound treatment	1.255	-0.0021	-0.03	1.507	0.0668	0.91	0.6241	0.6848	1919381	CBDivE_010479	FC1(F)C(F)(F)C2(F)C3CC(CC3/C=N/NC(=O)c4sc5ccccc5c4Cl)C12F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	L20	compound treatment	1.204	-0.0531	-0.72	1.469	0.0288	0.39	-0.2288	-0.2801	1919382	CBDivE_010480	CC(C)(C)Cc1ccc(OCCCC(=O)Nc2ccc(Cl)c(c2)[N+](=O)[O-])c(CC(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M01	compound treatment	1.344	0.0869	1.17	1.405	-0.0352	-0.48	0.4896	0.3865	1919383	CBDivE_010481	Cc1cccc(c1)C(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M02	compound treatment	1.211	-0.0461	-0.62	1.408	-0.0322	-0.44	-0.7502	-0.9855	1919384	CBDivE_010482	COc1cccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M03	compound treatment	1.296	0.0389	0.52	1.456	0.0158	0.22	0.5235	0.9227	1919385	CBDivE_010483	Cc1ccc2NC(=O)/C(=N/NC(=O)c3ccc(cc3)C(=O)N\N=C/4\C(=O)Nc5ccc(C)cc45)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M04	compound treatment	1.197	-0.0601	-0.81	1.437	-0.0032	-0.04	-0.6041	-0.7441	1919386	CBDivE_010484	CN(C(=O)CN1C(=O)c2ccccc2C1=O)C(C)(C)C(=O)Nc3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M05	compound treatment	1.371	0.114	1.54	1.408	-0.0322	-0.44	0.7761	0.4856	1919387	CBDivE_010485	O=C(CCCCCCC(=O)NCc1ccccc1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M06	compound treatment	1.241	-0.0161	-0.22	1.439	-0.0012	-0.02	-0.1651	-0.7581	1919388	CBDivE_010486	Cc1ccc(c(C)c1N2CCCC2=O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M07	compound treatment	1.311	0.0539	0.73	1.451	0.0108	0.15	0.6184	0.8334	1919389	CBDivE_010487	C/C(=N\NC(=O)c1cccc(I)c1)/CC(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M08	compound treatment	1.234	-0.0231	-0.31	1.419	-0.0212	-0.29	-0.4247	-0.9993	1919390	CBDivE_010488	COc1ccc(/C=N/c2ccc(cc2)c3ccc(cc3)[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M09	compound treatment	1.266	0.0089	0.12	1.495	0.0548	0.75	0.6134	0.8104	1606064	CBDivE_010489	CC(C)CC(NC(=O)c1ccccc1Cl)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M10	compound treatment	1.248	-0.0091	-0.12	1.45	0.0098	0.13	0.0077	0.0426	1594242	CBDivE_010490	OC(=O)C1CC(C(CC1C(=O)O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M11	compound treatment	1.272	0.0149	0.2	1.417	-0.0232	-0.32	-0.0815	-0.2175	1919391	CBDivE_010491	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(C)(C)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M12	compound treatment	1.247	-0.0101	-0.14	1.401	-0.0392	-0.53	-0.4743	-0.8598	1919392	CBDivE_010492	COc1cc(/C=N/NC(=O)CCc2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M13	compound treatment	1.278	0.0209	0.28	1.484	0.0438	0.6	0.6218	0.9413	1919393	CBDivE_010493	COc1ccc(/C=N/c2ccc(Nc3ccccc3)cc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M14	compound treatment	1.255	-0.0021	-0.03	1.436	-0.0042	-0.06	-0.0605	-0.9472	1919394	CBDivE_010494	COc1ccc(/C=N/c2ccc(\N=C\c3ccc(OC)c(O)c3)cc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M15	compound treatment	1.369	0.112	1.51	1.426	-0.0142	-0.19	0.9306	0.6114	1919395	CBDivE_010495	Oc1ccc(/C=N/c2ccc(\N=C\c3ccc(O)cc3O)c(Cl)c2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M16	compound treatment	1.231	-0.0261	-0.35	1.463	0.0228	0.31	-0.0291	-0.0619	1579208	CBDivE_010496	CCCc1nc2ccc(Cl)cc2c(C(=O)O)c1CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M17	compound treatment	1.351	0.0939	1.27	1.483	0.0428	0.58	1.3085	0.9381	1919396	CBDivE_010497	COc1cccc(/C=N/c2ccc(C)c(\N=C\c3cccc(OC)c3O)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M18	compound treatment	1.245	-0.0121	-0.16	1.462	0.0218	0.3	0.0948	0.2796	1919397	CBDivE_010498	Clc1ccc(cc1Cl)c2csc(N/N=C/c3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M19	compound treatment	1.322	0.0649	0.88	1.534	0.0938	1.28	1.5236	0.9829	1016234	CBDivE_010499	CC(=O)c1c(O)ccc2c(C)cc(=O)oc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	M20	compound treatment	1.265	0.0079	0.11	1.483	0.0428	0.58	0.4881	0.8227	1919398	CBDivE_010500	CCCCCCC/1CCC\C1=N/NC(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N01	compound treatment	1.176	-0.0811	-1.09	1.375	-0.0652	-0.89	-1.4023	-0.9947	1919399	CBDivE_010501	COC(=O)c1cccc2c(CN(C)C)c[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N02	compound treatment	1.186	-0.0711	-0.96	1.367	-0.0732	-1.0	-1.384	-0.9998	1919400	CBDivE_010502	COc1ccc(NC=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N03	compound treatment	1.259	0.0019	0.03	1.373	-0.0672	-0.92	-0.6298	-0.687	1919401	CBDivE_010503	Clc1ccc(cc1)N2CCN(CC2)C3CC(=O)N(C3=O)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N04	compound treatment	1.202	-0.0551	-0.74	1.314	-0.126	-1.72	-1.7424	-0.9295	1919402	CBDivE_010504	COc1cc(=O)[nH]c(SCc2c(F)c(F)c(F)c(F)c2F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N05	compound treatment	1.261	0.0039	0.05	1.39	-0.0502	-0.68	-0.4468	-0.6508	1025815	CBDivE_010505	CC(=O)Nc1ccc(N)c(c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N06	compound treatment	1.235	-0.0221	-0.3	1.379	-0.0612	-0.83	-0.8009	-0.9038	1919403	CBDivE_010506	COc1ccc2[nH]c(C)c(C(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N07	compound treatment	1.167	-0.0901	-1.22	1.438	-0.0022	-0.03	-0.8807	-0.7243	1214131	CBDivE_010507	COc1ccccc1NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N08	compound treatment	1.179	-0.0781	-1.05	1.351	-0.0892	-1.22	-1.6051	-0.9974	1919404	CBDivE_010508	CC1(C)CC(=NOC(=O)N2c3ccccc3CCc4ccccc24)CC(C)(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N09	compound treatment	1.206	-0.0511	-0.69	1.381	-0.0592	-0.81	-1.0582	-0.9969	1705778	CBDivE_010509	C(NCc1ccccc1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N10	compound treatment	1.222	-0.0351	-0.47	1.415	-0.0252	-0.34	-0.5778	-0.9876	1479629	CBDivE_010510	NS(=O)(=O)c1ccc2c(O)cc(cc2c1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N11	compound treatment	1.21	-0.0471	-0.64	1.414	-0.0262	-0.36	-0.7019	-0.9629	1919405	CBDivE_010511	CCn1c2ccccc2c3nnc(S)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N12	compound treatment	1.2	-0.0571	-0.77	1.374	-0.0662	-0.9	-1.183	-0.9969	1919406	CBDivE_010512	OC(=O)c1ccc(s1)c2ccc(s2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N13	compound treatment	1.259	0.0019	0.03	1.395	-0.0452	-0.62	-0.4177	-0.6771	1212179	CBDivE_010513	CN1CCCC(C1)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N14	compound treatment	1.203	-0.0541	-0.73	1.386	-0.0542	-0.74	-1.0386	-1.0	1919407	CBDivE_010514	Oc1ccc(SCCCCN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N15	compound treatment	1.201	-0.0561	-0.76	1.413	-0.0272	-0.37	-0.7974	-0.9461	1919408	CBDivE_010515	CC1(C)CC(=NOC(=O)N2c3ccccc3C=Cc4ccccc24)CC(C)(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N16	compound treatment	1.25	-0.0071	-0.1	1.41	-0.0302	-0.41	-0.3589	-0.8489	1919409	CBDivE_010516	O=C1Nc2ccc(Cc3ccc4NC(=O)C(=O)c4c3)cc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N17	compound treatment	1.202	-0.0551	-0.74	1.439	-0.0012	-0.02	-0.5371	-0.7225	1919410	CBDivE_010517	Cc1ccc(Nc2nc(cs2)c3ccc(Br)cc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N18	compound treatment	1.271	0.0139	0.19	1.392	-0.0482	-0.66	-0.3321	-0.4859	1919411	CBDivE_010518	O=C(Cc1ccccc1)C2CCOC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N19	compound treatment	1.231	-0.0261	-0.35	1.496	0.0558	0.76	0.2891	0.3448	1919412	CBDivE_010519	O=C(Cn1nc(c2ccccc2)c3cccc3c1c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	N20	compound treatment	1.225	-0.0321	-0.43	1.396	-0.0442	-0.6	-0.7324	-0.9868	1919413	CBDivE_010520	C/C(=N\NS(=O)(=O)c1ccc(C)cc1)/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O01	compound treatment	1.294	0.0369	0.5	1.459	0.0188	0.26	0.5333	0.9524	1919414	CBDivE_010521	Cc1cccc(c1)C(=O)NC(NC2CCS(=O)(=O)C2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O02	compound treatment	1.219	-0.0381	-0.51	1.445	0.0048	0.07	-0.3171	-0.6121	1919415	CBDivE_010522	COc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O03	compound treatment	1.19	-0.0671	-0.91	1.496	0.0558	0.76	-0.102	-0.0862	1919416	CBDivE_010523	Cc1ccccc1C(=O)NNC(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O04	compound treatment	1.291	0.0339	0.46	1.44	-1.97E-4	0.0	0.3215	0.7029	1919417	CBDivE_010524	[O-][N+](=O)c1ccc(CC(N2C(=O)c3ccccc3C2=O)C(=O)Nc4ccccc4[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O05	compound treatment	1.345	0.0879	1.19	1.482	0.0418	0.57	1.2416	0.9436	1919418	CBDivE_010525	CCOC(=O)c1ccc(NC(=O)CCCC(=O)OCC#C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O06	compound treatment	1.241	-0.0161	-0.22	1.441	8.03E-4	0.01	-0.1458	-0.6706	1919419	CBDivE_010526	Clc1c(Cl)c(Cl)c(OC(=O)CNC(=O)OCc2ccccc2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O07	compound treatment	1.28	0.0229	0.31	1.422	-0.0182	-0.25	0.043	0.1085	1703107	CBDivE_010527	OC(=O)c1ccccc1NC2SC(=O)N(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O08	compound treatment	1.277	0.0199	0.27	1.476	0.0358	0.49	0.5351	0.9603	1919420	CBDivE_010528	COc1cc(Br)cc(/C=N/c2cccc(c2)c3cn4ccccc4n3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O09	compound treatment	1.294	0.0369	0.5	1.439	-0.0012	-0.02	0.3405	0.6835	1919421	CBDivE_010529	COc1cc2c(c(C)oc2cc1/C=N/NC(=S)N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O10	compound treatment	1.216	-0.0411	-0.55	1.418	-0.0222	-0.3	-0.6061	-0.9595	1919422	CBDivE_010530	[O-][N+](=O)c1ccc(Nc2cccc3c(Nc4ccc([N+](=O)[O-])c5nonc45)cccc23)c6nonc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O11	compound treatment	1.35	0.0929	1.25	1.546	0.106	1.44	1.9064	0.9975	1919423	CBDivE_010531	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O12	compound treatment	1.284	0.0269	0.36	1.447	0.0068	0.09	0.3222	0.8602	1919424	CBDivE_010532	COc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O13	compound treatment	1.243	-0.0141	-0.19	1.454	0.0138	0.19	-0.0014	-0.0052	1919425	CBDivE_010533	COc1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O14	compound treatment	1.198	-0.0591	-0.8	1.432	-0.0082	-0.11	-0.6428	-0.7984	1919426	CBDivE_010534	COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O15	compound treatment	1.318	0.0609	0.82	1.49	0.0498	0.68	1.0612	0.9955	1919427	CBDivE_010535	Cc1cc(ccc1/N=C/c2cc(Br)ccc2O)c3ccc(/N=C/c4cc(Br)ccc4O)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O16	compound treatment	1.278	0.0209	0.28	1.463	0.0228	0.31	0.4193	0.9988	1919428	CBDivE_010536	COc1cc(/C=C/2\SC(=S)N(CC(=O)NNC(=O)c3ccccc3O)C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O17	compound treatment	1.3	0.0429	0.58	1.567	0.127	1.73	1.6319	0.895	1919429	CBDivE_010537	Cc1ccsc1/C=N/c2cc(ccc2O)S(=O)(=O)c3ccc(O)c(\N=C\c4sccc4C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O18	compound treatment	1.232	-0.0251	-0.34	1.492	0.0518	0.71	0.2601	0.332	1919430	CBDivE_010538	COc1ccc2C3=NN(C(C3CCc2c1)c4ccc(cc4)[N+](=O)[O-])/C(=C/C(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O19	compound treatment	1.35	0.0929	1.25	1.479	0.0388	0.53	1.2604	0.9265	1919431	CBDivE_010539	CN(C)C1(CCCC1)c2nnnn2C(/C=C\c3ccc(Cl)cc3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	O20	compound treatment	1.18	-0.0771	-1.04	1.482	0.0418	0.57	-0.3324	-0.2802	1919432	CBDivE_010540	CN/1C(=O)CS\C1=N\CC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P01	compound treatment	1.227	-0.0301	-0.41	1.427	-0.0132	-0.18	-0.4144	-0.933	1776747	CBDivE_010541	Cn1cc([N+](=O)[O-])c(/C=C/N2CCOCC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P02	compound treatment	1.208	-0.0491	-0.66	1.399	-0.0412	-0.56	-0.8656	-0.9966	1063612	CBDivE_010542	CN1C(=O)N(C)C(=O)C(Cc2ccccc2)(Cc3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P03	compound treatment	1.275	0.0179	0.24	1.335	-0.105	-1.43	-0.8436	-0.5799	1919433	CBDivE_010543	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C4CC(=O)N(C4=O)c5ccc(OCC)cc5)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P04	compound treatment	1.178	-0.0791	-1.07	1.381	-0.0592	-0.81	-1.3253	-0.9905	1919434	CBDivE_010544	CC(=C1C(=O)NC(=S)NC1=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P05	compound treatment	1.222	-0.0351	-0.47	1.375	-0.0652	-0.89	-0.9635	-0.9565	1919435	CBDivE_010545	Nc1cccc(c1)S(=O)(=O)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P06	compound treatment	1.206	-0.0511	-0.69	1.336	-0.104	-1.42	-1.4921	-0.9448	1777670	CBDivE_010546	COc1ccc(/C=C/C2=CCN(Cc3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P07	compound treatment	1.189	-0.0681	-0.92	1.382	-0.0582	-0.79	-1.2108	-0.9973	1919436	CBDivE_010547	OC(=O)c1cccc(c1)N2C(=O)CC(SC(=N)N/N=C/c3ccnc4ccccc34)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P08	compound treatment	1.202	-0.0551	-0.74	1.377	-0.0632	-0.86	-1.135	-0.9973	1174475	CBDivE_010548	CN1C2CCC1CC(C2)OC(=O)CCN3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P09	compound treatment	1.148	-0.109	-1.47	1.34	-0.1	-1.37	-2.0069	-0.9993	1919437	CBDivE_010549	Brc1ccc2C(=O)N(C(=O)c2c1)n3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P10	compound treatment	0.781	-0.476	-6.42	0.931	-0.509	-6.94	-9.4515	-0.9992	1919438	CBDivE_010550	NS(=O)(=O)c1ccc(cc1)N2N=C(CC2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P11	compound treatment	1.224	-0.0331	-0.45	1.377	-0.0632	-0.86	-0.9251	-0.9531	1919439	CBDivE_010551	N(/N=C/c1ccccc1)c2nnc3c4ccccc4[nH]c3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P12	compound treatment	1.185	-0.0721	-0.97	1.337	-0.103	-1.41	-1.6828	-0.9837	1919440	CBDivE_010552	CCN(CC)c1ccc(/C=N/c2c(C)c3ccc(cc3oc2=O)N(CC)CC)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P13	compound treatment	1.214	-0.0431	-0.58	1.403	-0.0372	-0.51	-0.7698	-0.9977	1919441	CBDivE_010553	[O-][N+](=O)c1ccc(N/N=C/2\C(=O)N(CN3CCCCC3)c4ccc(Br)cc24)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P14	compound treatment	1.199	-0.0581	-0.78	1.394	-0.0462	-0.63	-0.9997	-0.9941	1919442	CBDivE_010554	Oc1ccc(SCCCCN2CCCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P15	compound treatment	1.281	0.0239	0.32	1.414	-0.0262	-0.36	-0.0246	-0.0511	1919443	CBDivE_010555	OC1(CC(=O)N/N=C/c2ccc(Cl)cc2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P16	compound treatment	1.226	-0.0311	-0.42	1.387	-0.0532	-0.73	-0.8096	-0.9661	1919444	CBDivE_010556	CCc1cc2c(N/N=C/c3c[nH]c4ccccc34)ncnc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P17	compound treatment	1.194	-0.0631	-0.85	1.358	-0.0822	-1.12	-1.3945	-0.9908	1919445	CBDivE_010557	Cc1ccc(NC(=S)NC(=O)c2ccccc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P18	compound treatment	1.116	-0.141	-1.9	1.436	-0.0042	-0.06	-1.3864	-0.728	1919446	CBDivE_010558	CC(=CCC/C(=C/CC/C(=N/O)/C)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P19	compound treatment	1.271	0.0139	0.19	1.401	-0.0392	-0.53	-0.2453	-0.4331	1350	CBDivE_010559	COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.33	P20	compound treatment	1.217	-0.0401	-0.54	1.387	-0.0532	-0.73	-0.8955	-0.9896	1919447	CBDivE_010560	NS(=O)(=O)c1ccc(N/N=C(/N=Nc2ccc(cc2)S(=O)(=O)N)\c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A01	compound treatment	1.259	-0.0102	-0.14	1.448	-0.0143	-0.19	-0.2353	-0.9859	1919448	CBDivE_010561	COc1ccc(/C=N/Nc2nc(OCC(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A02	compound treatment	1.31	0.0408	0.55	1.474	0.0117	0.16	0.5019	0.8764	1255430	CBDivE_010562	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A03	compound treatment	1.327	0.0578	0.78	1.49	0.0277	0.38	0.8183	0.9449	1919449	CBDivE_010563	CCOC(=O)/C(=N\Nc1cc(OC)c(OC)cc1C(=O)OC)/CCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A04	compound treatment	1.315	0.0458	0.62	1.472	0.00973	0.13	0.5303	0.8399	1919450	CBDivE_010564	CC(C)(C)C(/C=C\c1ccc(Cl)cc1Cl)n2nnnc2C(N3CCOCC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A05	compound treatment	1.316	0.0468	0.63	1.507	0.0447	0.61	0.8773	0.9999	1919451	CBDivE_010565	OS(=O)(=O)CCCSc1sc2ccccc2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A06	compound treatment	1.271	0.00176	0.02	1.422	-0.0403	-0.55	-0.3716	-0.6759	1919452	CBDivE_010566	Oc1ccccc1C2NC(=NC(=N2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A07	compound treatment	1.394	0.125	1.68	1.573	0.111	1.51	2.2578	0.9985	1919453	CBDivE_010567	COc1ccc(cc1)C2=NN(C(C2)C=C(Cl)Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A08	compound treatment	1.389	0.12	1.62	1.56	0.0977	1.33	2.0847	0.9954	1919454	CBDivE_010568	COC(=O)CC(NC(=O)c1ccc(F)cc1)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A09	compound treatment	1.373	0.104	1.4	1.434	-0.0283	-0.39	0.7172	0.4939	1919455	CBDivE_010569	COc1ccc2sc(SCCCS(=O)(=O)O)[n+](CCCS(=O)(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A10	compound treatment	1.341	0.0718	0.97	1.451	-0.0113	-0.15	0.5758	0.5875	1919456	CBDivE_010570	Cc1ccc(cc1)S(=O)(=O)C/N=C(/c2ccccc2)\n3c(=S)nc(c4ccccc4)n(CS(=O)(=O)c5ccc(C)cc5)c3=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A11	compound treatment	1.307	0.0378	0.51	1.547	0.0847	1.16	1.1772	0.9323	1919457	CBDivE_010571	CCCOC(=O)/C(=N\NC(=O)c1ccco1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A12	compound treatment	1.299	0.0298	0.4	1.497	0.0347	0.47	0.6187	0.9966	1919458	CBDivE_010572	COc1ccc(CNC(=N)NC(=N)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A13	compound treatment	1.339	0.0698	0.94	1.501	0.0387	0.53	1.0389	0.9627	1320476	CBDivE_010573	OC(=O)CC(N1C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A14	compound treatment	1.266	-0.00324	-0.04	1.48	0.0177	0.24	0.14	0.5699	1919459	CBDivE_010574	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2ccccc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A15	compound treatment	1.286	0.0168	0.23	1.504	0.0417	0.57	0.5622	0.9182	1919460	CBDivE_010575	CCOC(=O)NCC(C#C)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A16	compound treatment	1.241	-0.0282	-0.38	1.499	0.0367	0.5	0.0847	0.1346	1919461	CBDivE_010576	CO/C(=N\C(NC(=S)NN)C(Cl)(Cl)Cl)/c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A17	compound treatment	1.441	0.172	2.32	1.532	0.0697	0.95	2.3108	0.9226	1919462	CBDivE_010577	OCC(C#C)N(CCN(Cc1ccccc1)C(CO)C#C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A18	compound treatment	1.298	0.0288	0.39	1.43	-0.0323	-0.44	-0.0369	-0.0628	1428318	CBDivE_010578	COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2CN4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A19	compound treatment	1.327	0.0578	0.78	1.546	0.0837	1.14	1.3583	0.9827	1919463	CBDivE_010579	[O-][N+](=O)c1cccc(/C=N\Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	A20	compound treatment	1.247	-0.0222	-0.3	1.488	0.0257	0.35	0.0359	0.0778	1720850	CBDivE_010580	OC(=O)c1cc(O)ccc1NC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B01	compound treatment	1.303	0.0338	0.46	1.414	-0.0483	-0.66	-0.1434	-0.1792	1179736	CBDivE_010581	OC(=O)c1cc(NC(=O)Cc2ccccc2)c(cc1NC(=O)Cc3ccccc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B02	compound treatment	1.318	0.0488	0.66	1.486	0.0237	0.32	0.6939	0.9466	1919464	CBDivE_010582	Oc1ccc(/C=N/c2ccc3oc(nc3c2)c4ccccc4Br)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B03	compound treatment	1.28	0.0108	0.15	1.453	-0.00927	-0.13	0.0132	0.0686	1919465	CBDivE_010583	CC/C(=N\Nc1ccccc1)/CC(c2ccccc2)c3c(O)c4ccccc4sc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B04	compound treatment	1.276	0.00676	0.09	1.488	0.0257	0.35	0.3125	0.8622	1919466	CBDivE_010584	COc1ccc(OCC(=O)N/N=C(\C)/c2ccc(Br)s2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B05	compound treatment	1.283	0.0138	0.19	1.512	0.0497	0.68	0.6107	0.8687	1919467	CBDivE_010585	CCCCCCCCCCCCS(=O)(=O)c1ccc(cc1[N+](=O)[O-])C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B06	compound treatment	1.219	-0.0502	-0.68	0.322	-1.14	-15.55	-11.4743	-0.7372	1261080	CBDivE_010586	CCOC(=O)c1[nH]c(C)c(Cc2ccc(OCC)cc2)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B07	compound treatment	1.297	0.0278	0.37	1.479	0.0167	0.23	0.4261	0.9717	1919468	CBDivE_010587	Cc1ccc(cc1)C(=O)N/C(=C\c2ccc(o2)c3ccc(Cl)cc3)/C(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B08	compound treatment	1.36	0.0908	1.22	1.406	-0.0563	-0.77	0.3232	0.2236	1916148	CBDivE_010588	COc1cc(cc(c1OC)S(=O)(=O)O)c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B09	compound treatment	1.242	-0.0272	-0.37	1.466	0.00373	0.05	-0.2239	-0.6036	1919469	CBDivE_010589	FC(Cl)C(F)(F)Oc1ccccc1Nc2nc(Cl)nc(Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B10	compound treatment	1.368	0.0988	1.33	1.465	0.00273	0.04	0.9684	0.7266	1581530	CBDivE_010590	COc1ccccc1C(=O)Nc2ccc3oc(nc3c2)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B11	compound treatment	1.267	-0.00224	-0.03	1.402	-0.0603	-0.82	-0.6026	-0.7326	1919470	CBDivE_010591	N=C1N/C(=N\c2ccc(Cc3ccc(/N=C/4\NC(=N)c5ccccc45)cc3)cc2)/c6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B12	compound treatment	1.258	-0.0112	-0.15	1.434	-0.0283	-0.39	-0.3799	-0.9169	1919471	CBDivE_010592	CC(C)CS(=O)(=O)c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B13	compound treatment	1.308	0.0388	0.52	1.382	-0.0803	-1.09	-0.4043	-0.3333	1919472	CBDivE_010593	ClC(Cl)(Cl)C(NCc1ccccc1)NC(=O)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B14	compound treatment	1.229	-0.0402	-0.54	1.479	0.0167	0.23	-0.2226	-0.378	1225846	CBDivE_010594	CC(=CCCC1(C)Oc2ccccc2C3OCC(C)(C)CC31)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B15	compound treatment	1.275	0.00576	0.08	1.434	-0.0283	-0.39	-0.2177	-0.5535	1222343	CBDivE_010595	OC(=O)c1cc(Nc2ccccc2)c(cc1Nc3ccccc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B16	compound treatment	1.239	-0.0302	-0.41	1.461	-0.00127	-0.02	-0.3008	-0.7365	1919473	CBDivE_010596	Cc1ccc(/N=C/c2cc(ccc2O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B17	compound treatment	1.283	0.0138	0.19	1.485	0.0227	0.31	0.3504	0.9699	1915436	CBDivE_010597	CC(C)NCC(O)COCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B18	compound treatment	1.221	-0.0482	-0.65	1.491	0.0287	0.39	-0.1832	-0.2412	1919474	CBDivE_010598	Cc1cc(ccc1[N+](=O)[O-])C(=O)Nc2cccc(NC(=O)c3ccc(cc3)C(C)(C)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B19	compound treatment	1.261	-0.00824	-0.11	1.395	-0.0673	-0.92	-0.7273	-0.787	1919475	CBDivE_010599	CCCCCCCC(=O)NC(Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	B20	compound treatment	1.187	-0.0822	-1.11	1.467	0.00473	0.06	-0.739	-0.6649	1919476	CBDivE_010600	[O-][N+](=O)c1cccc(/C=N/Nc2nnn[nH]2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C01	compound treatment	1.228	-0.0412	-0.56	1.45	-0.0123	-0.17	-0.5118	-0.8808	1919477	CBDivE_010601	CC1CC(=O)C2(C)CCCCC2S1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C02	compound treatment	1.347	0.0778	1.05	1.538	0.0757	1.03	1.472	1.0	1919478	CBDivE_010602	OC(=O)c1ccc(NC(=S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C03	compound treatment	1.47	0.201	2.71	1.465	0.00273	0.04	1.9414	0.7167	1510864	CBDivE_010603	CC(NC(=O)c1ccccc1N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C04	compound treatment	1.289	0.0198	0.27	1.455	-0.00727	-0.1	0.1184	0.4161	1919479	CBDivE_010604	Clc1ccc(NC(=O)OCCCNC(=O)COc2ccccc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C05	compound treatment	1.327	0.0578	0.78	1.528	0.0657	0.9	1.1847	0.9976	1919480	CBDivE_010605	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)c(Cl)c2)N(C(=O)N1CC(=O)N/N=C\c3ccco3)c4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C06	compound treatment	1.29	0.0208	0.28	1.513	0.0507	0.69	0.6872	0.9208	1919481	CBDivE_010606	FC(F)(F)C1N=C(NC(=N1)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C07	compound treatment	1.34	0.0708	0.95	1.498	0.0357	0.49	1.0195	0.9513	1919482	CBDivE_010607	Oc1c(C(C2C(=O)c3ccccc3C2=O)c4cccc(Br)c4)c(=O)sc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C08	compound treatment	1.273	0.00376	0.05	1.485	0.0227	0.31	0.255	0.812	1242623	CBDivE_010608	COc1ccc(CCNC(=O)c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C09	compound treatment	1.31	0.0408	0.55	1.536	0.0737	1.01	1.0997	0.9597	1919483	CBDivE_010609	CC(=C)C(=O)Nc1ccc2OCCOCCOCCOCCOCCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C10	compound treatment	1.31	0.0408	0.55	1.52	0.0577	0.79	0.9454	0.9846	1919484	CBDivE_010610	Cc1ccc(cc1)/C(=N/CS(=O)(=O)c2ccccc2)/n3c(=O)nc(c4ccc(C)cc4)n(CS(=O)(=O)c5ccccc5)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C11	compound treatment	1.397	0.128	1.72	1.476	0.0137	0.19	1.3511	0.7793	1919485	CBDivE_010611	O=C1C2=C(OC3=C(C2)C(=O)c4ccccc34)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C12	compound treatment	1.287	0.0178	0.24	1.454	-0.00827	-0.11	0.0896	0.3385	1919486	CBDivE_010612	NC(=O)c1c(NC(=O)c2ccc(Cl)c(c2)[N+](=O)[O-])sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C13	compound treatment	1.344	0.0748	1.01	1.502	0.0397	0.54	1.0962	0.9575	1334791	CBDivE_010613	CCOC(=O)c1c(NS(=O)(=O)c2ccc(C)cc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C14	compound treatment	1.334	0.0648	0.87	1.495	0.0327	0.45	0.9333	0.9514	1585194	CBDivE_010614	CC(=O)NCCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C15	compound treatment	1.345	0.0758	1.02	1.516	0.0537	0.73	1.2407	0.9867	1269840	CBDivE_010615	Cc1ccsc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C16	compound treatment	1.259	-0.0102	-0.14	1.48	0.0177	0.24	0.0732	0.263	1919487	CBDivE_010616	CO/C(=N\C(NC(=S)Nc1ccccc1)C(Cl)(Cl)Cl)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C17	compound treatment	1.335	0.0658	0.89	1.499	0.0367	0.5	0.9814	0.9634	1919488	CBDivE_010617	CN(C)CCCNC(=O)/C(=C\c1ccc(Cl)cc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C18	compound treatment	1.298	0.0288	0.39	1.524	0.0617	0.84	0.8695	0.9382	1919489	CBDivE_010618	OCC1OC(C(OC(=O)c2ccccc2)C1OC(=O)c3ccccc3)n4ncc(NC(=O)c5ccccc5)nc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C19	compound treatment	1.297	0.0278	0.37	1.505	0.0427	0.58	0.6768	0.9772	1239950	CBDivE_010619	Clc1ccc(cc1)N2CCN(Cc3ccc(Br)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	C20	compound treatment	1.248	-0.0212	-0.29	1.439	-0.0233	-0.32	-0.427	-0.9987	1664263	CBDivE_010620	O=C(Cc1ccccc1)Nc2ccc3-c4ccc(NC(=O)Cc5ccccc5)cc4S(=O)(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D01	compound treatment	1.245	-0.0242	-0.33	1.407	-0.0553	-0.75	-0.7642	-0.9301	1919490	CBDivE_010621	C(#Cc1cccc(c1)c2nc3ccccc3nc2c4cccc(C#Cc5ccc(cc5)c6ccccc6)c4)c7ccc(cc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D02	compound treatment	1.26	-0.00924	-0.12	1.396	-0.0663	-0.9	-0.7272	-0.7971	1919491	CBDivE_010622	CCCCOc1ccc(cc1)C(C)(N)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D03	compound treatment	1.121	-0.148	-2.0	1.43	-0.0323	-0.44	-1.7253	-0.8426	1919492	CBDivE_010623	NC(=O)NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D04	compound treatment	1.297	0.0278	0.37	1.439	-0.0233	-0.32	0.0404	0.0823	1420489	CBDivE_010624	CCc1ccc(cc1)c2nc3cc(NC(=O)c4ccco4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D05	compound treatment	1.203	-0.0662	-0.89	1.479	0.0167	0.23	-0.4706	-0.5103	1919493	CBDivE_010625	CCOC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D06	compound treatment	1.322	0.0528	0.71	0.33	-1.13	-15.44	-10.4146	-0.6738	1919494	CBDivE_010626	CCCCCOc1ccc(CN2CCOCC2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D07	compound treatment	1.286	0.0168	0.23	1.476	0.0137	0.19	0.2922	0.9956	1919495	CBDivE_010627	[O-][N+](=O)c1ccccc1C(=O)NC(NC2CCS(=O)(=O)C2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D08	compound treatment	1.239	-0.0302	-0.41	1.424	-0.0383	-0.52	-0.6575	-0.9926	1777712	CBDivE_010628	CCc1ccc(cc1)c2nc3cc(NC(=O)c4cccc(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D09	compound treatment	1.238	-0.0312	-0.42	1.412	-0.0503	-0.69	-0.7828	-0.9727	1919496	CBDivE_010629	CCCCCCS(=O)(=O)C1CCS(=O)(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D10	compound treatment	1.218	-0.0512	-0.69	1.439	-0.0233	-0.32	-0.7132	-0.9376	1919497	CBDivE_010630	COc1ccc(OCC(=O)N/N=C/c2ccc(OC)c(c2)[N+](=O)[O-])c(I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D11	compound treatment	1.234	-0.0352	-0.48	1.51	0.0477	0.65	0.124	0.1539	1919498	CBDivE_010631	N(/N=C/c1cccnc1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D12	compound treatment	1.309	0.0398	0.54	1.452	-0.0103	-0.14	0.2802	0.5055	1919499	CBDivE_010632	CCCCCC1CC(O)C=C(C)C1C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D13	compound treatment	1.35	0.0808	1.09	1.475	0.0127	0.17	0.8931	0.8095	1919500	CBDivE_010633	CCCCCC(=O)NC(N1CCOCC1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D14	compound treatment	1.243	-0.0262	-0.35	1.39	-0.0723	-0.99	-0.9472	-0.9045	1226797	CBDivE_010634	CC1CC(=CCC1(CO)CO)CCC=C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D15	compound treatment	1.248	-0.0212	-0.29	1.502	0.0397	0.54	0.1804	0.2944	1648053	CBDivE_010635	OC(=O)c1ccccc1NC(=O)c2ccc(cc2)C(=O)Nc3ccccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D16	compound treatment	1.285	0.0158	0.21	1.378	-0.0843	-1.15	-0.6623	-0.5667	1919501	CBDivE_010636	Cc1c(C(=O)NCCN2CCCCC2)c(nn1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D17	compound treatment	1.227	-0.0422	-0.57	1.448	-0.0143	-0.19	-0.5406	-0.8977	1919502	CBDivE_010637	FC(F)(F)c1ccc(nc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D18	compound treatment	1.223	-0.0462	-0.62	1.442	-0.0203	-0.28	-0.6366	-0.933	1919503	CBDivE_010638	Cc1ccc(cc1[N+](=O)[O-])C(=O)Nc2cc(ccc2Br)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D19	compound treatment	1.311	0.0418	0.56	1.503	0.0407	0.56	0.7911	1.0	1919504	CBDivE_010639	Cc1ccc(SC(c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	D20	compound treatment	1.24	-0.0292	-0.39	1.487	0.0247	0.34	-0.0405	-0.0781	1919505	CBDivE_010640	C(Sc1nnnn1c2ccccc2)c3cccc4nsnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E01	compound treatment	1.318	0.0488	0.66	1.485	0.0227	0.31	0.6843	0.941	1919506	CBDivE_010641	CSc1nc2c(ccc3ccccc23)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E02	compound treatment	1.289	0.0198	0.27	1.493	0.0307	0.42	0.4848	0.9762	1919507	CBDivE_010642	OC(=O)c1cccc(NC(=S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E03	compound treatment	1.288	0.0188	0.25	1.469	0.00673	0.09	0.2438	0.9057	1919508	CBDivE_010643	COC(=O)c1ccc(NN=Nc2ccc(cc2)C(=O)OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E04	compound treatment	1.287	0.0178	0.24	1.525	0.0627	0.86	0.7742	0.8716	1919509	CBDivE_010644	[O-][N+](=O)c1ccccc1S(=O)(=O)NCCOC(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E05	compound treatment	1.33	0.0608	0.82	1.507	0.0447	0.61	1.0109	0.9894	1919510	CBDivE_010645	[O-][N+](=O)c1ccc(N/N=C(/CS(=O)(=O)c2ccccc2)\c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E06	compound treatment	1.231	-0.0382	-0.52	1.48	0.0177	0.24	-0.1939	-0.3403	1919511	CBDivE_010646	NC(=O)CC(N1C(=O)/C(=C/c2ccc(Cl)cc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E07	compound treatment	1.281	0.0118	0.16	1.536	0.0737	1.01	0.8231	0.8087	1919512	CBDivE_010647	COc1ccc(NCn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E08	compound treatment	1.288	0.0188	0.25	1.509	0.0467	0.64	0.6295	0.9182	1675086	CBDivE_010648	Cc1cccc(OCC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E09	compound treatment	1.418	0.149	2.01	1.476	0.0137	0.19	1.5514	0.7697	1919513	CBDivE_010649	Cc1cc(ccc1Nc2ccc([N+](=O)[O-])c3nonc23)c4ccc(Nc5ccc([N+](=O)[O-])c6nonc56)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E10	compound treatment	1.303	0.0338	0.46	1.498	0.0357	0.49	0.6665	0.9994	1919514	CBDivE_010650	Cc1ccc(cc1)/C(=N/Cc2ccccc2)/n3c(=S)nc(c4ccc(C)cc4)n(Cc5ccccc5)c3=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E11	compound treatment	1.365	0.0958	1.29	1.552	0.0897	1.22	1.7787	0.9996	1919515	CBDivE_010651	[O-][N+](=O)C/1C(=O)c2ccccc2\C1=N/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E12	compound treatment	1.247	-0.0222	-0.3	1.488	0.0257	0.35	0.0359	0.0778	1919516	CBDivE_010652	OC(=O)CCC(=O)NNC(=O)OCC1c2ccccc2-c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E13	compound treatment	1.308	0.0388	0.52	1.526	0.0637	0.87	0.9842	0.9704	1503871	CBDivE_010653	CCOC(=O)C1=C(C)NC(=C(C1c2ccco2)C(=O)OCC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E14	compound treatment	1.236	-0.0332	-0.45	1.436	-0.0263	-0.36	-0.5704	-0.9938	1919517	CBDivE_010654	CCN(CC)CCS(=O)(=O)CCC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E15	compound treatment	1.37	0.101	1.36	1.474	0.0117	0.16	1.0742	0.7849	1641089	CBDivE_010655	O=c1c2ccccc2c3nc4c5ccccc5c(=O)c4c(c6ccccc6)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E16	compound treatment	1.267	-0.00224	-0.03	1.441	-0.0213	-0.29	-0.2265	-0.7766	1919518	CBDivE_010656	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NC(Nc2ncccn2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E17	compound treatment	1.298	0.0288	0.39	1.473	0.0107	0.15	0.3778	0.9111	1919519	CBDivE_010657	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N/N=C/c2c[nH]nc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E18	compound treatment	1.265	-0.00424	-0.06	1.489	0.0267	0.36	0.2172	0.5889	1919520	CBDivE_010658	OCCCNc1ccc(cc1[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E19	compound treatment	1.334	0.0648	0.87	1.537	0.0747	1.02	1.3383	0.9971	1694512	CBDivE_010659	Clc1nc(Cl)nc(NCc2ccco2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	E20	compound treatment	1.293	0.0238	0.32	1.481	0.0187	0.26	0.4072	0.9937	1919521	CBDivE_010660	Cc1ccc(CCC(=O)N/N=C/c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F01	compound treatment	1.241	-0.0282	-0.38	1.402	-0.0603	-0.82	-0.8506	-0.9389	1919522	CBDivE_010661	CCOC(=O)N/N=C/c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F02	compound treatment	1.221	-0.0482	-0.65	1.414	-0.0483	-0.66	-0.9257	-1.0	1919523	CBDivE_010662	OC(=O)c1cc(cc(c1)N2C(=O)C3C4CC(C=C4)C3C2=O)N5C(=O)C6C7CC(C=C7)C6C5=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F03	compound treatment	1.198	-0.0712	-0.96	1.427	-0.0353	-0.48	-1.0197	-0.9488	1919524	CBDivE_010663	COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccco3)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F04	compound treatment	1.238	-0.0312	-0.42	1.393	-0.0693	-0.94	-0.966	-0.9339	1153870	CBDivE_010664	CC(C)(C)c1ccc(cc1)c2nc3cc(NC(=O)c4cccc5ccccc45)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F05	compound treatment	1.286	0.0168	0.23	1.484	0.0217	0.3	0.3694	0.9911	1919525	CBDivE_010665	CCOC(=O)c1c(NC(=S)NC(=O)/C=C/c2ccc(F)cc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F06	compound treatment	1.236	-0.0332	-0.45	0.33	-1.13	-15.44	-11.2349	-0.7273	1637610	CBDivE_010666	CC(C)(C)c1cc(c2ccc(Cl)cc2)n(n1)c3cccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F07	compound treatment	1.282	0.0128	0.17	1.379	-0.0833	-1.14	-0.6812	-0.5932	1919526	CBDivE_010667	CCCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(Nc3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F08	compound treatment	1.299	0.0298	0.4	1.47	0.00773	0.11	0.3584	0.8634	1919527	CBDivE_010668	Cc1cccc(NC(=S)NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F09	compound treatment	1.194	-0.0752	-1.02	1.456	-0.00627	-0.09	-0.7782	-0.764	1919528	CBDivE_010669	CCC1(CC)C(=O)N/C(=N\Cc2ccc(OC)cc2)/N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F10	compound treatment	1.267	-0.00224	-0.03	1.447	-0.0153	-0.21	-0.1687	-0.8014	1343439	CBDivE_010670	COc1ccc2c(C)c(oc2c1OC)C(=O)NCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F11	compound treatment	1.244	-0.0252	-0.34	1.497	0.0347	0.47	0.0941	0.1613	1919529	CBDivE_010671	OC(=O)/C=C/c1ccc(o1)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F12	compound treatment	1.163	-0.106	-1.43	1.411	-0.0513	-0.7	-1.5079	-0.9455	1571290	CBDivE_010672	CNC(C)c1ccc(OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F13	compound treatment	1.241	-0.0282	-0.38	1.472	0.00973	0.13	-0.1756	-0.4353	1919530	CBDivE_010673	CCCC(=O)NC(NCc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F14	compound treatment	1.223	-0.0462	-0.62	1.442	-0.0203	-0.28	-0.6366	-0.933	1919531	CBDivE_010674	CC1OC2C(Cc3ccccc23)C(C)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F15	compound treatment	1.273	0.00376	0.05	1.484	0.0217	0.3	0.2454	0.8163	1919532	CBDivE_010675	[O-][N+](=O)c1ccc(/C=N/c2ccc(NC(=O)c3ccc(\N=C\c4ccc(cc4)[N+](=O)[O-])cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F16	compound treatment	1.227	-0.0422	-0.57	1.457	-0.00527	-0.07	-0.4538	-0.7901	1919533	CBDivE_010676	Oc1ccc(/C=N/NC(=O)CNC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F17	compound treatment	1.218	-0.0512	-0.69	1.486	0.0237	0.32	-0.26	-0.3407	1919534	CBDivE_010677	CCOC(=O)NCCCCCCNC(=O)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F18	compound treatment	1.268	-0.00124	-0.02	1.472	0.00973	0.13	0.0819	0.613	1778260	CBDivE_010678	CC1CN(C)C(C)c2c1oc3ccc(cc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F19	compound treatment	1.213	-0.0562	-0.76	1.514	0.0517	0.71	-0.0377	-0.0364	1629488	CBDivE_010679	CNc1nc(NC(C)(C)C)nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	F20	compound treatment	1.223	-0.0462	-0.62	1.401	-0.0613	-0.84	-1.0319	-0.9896	1919535	CBDivE_010680	Brc1ccc(/C=N/Nc2nnn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G01	compound treatment	1.262	-0.00724	-0.1	1.468	0.00573	0.08	-0.0139	-0.1108	1919536	CBDivE_010681	OC(=O)/C=C/c1c2ccccc2cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G02	compound treatment	1.221	-0.0482	-0.65	1.466	0.00373	0.05	-0.4243	-0.6499	1919537	CBDivE_010682	Oc1ccccc1NC(=S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G03	compound treatment	1.236	-0.0332	-0.45	1.47	0.00773	0.11	-0.2426	-0.5266	1919538	CBDivE_010683	Cc1ccc(Nc2ccc3nonc3c2[N+](=O)[O-])cc1Nc4ccc5nonc5c4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G04	compound treatment	1.297	0.0278	0.37	1.481	0.0187	0.26	0.4454	0.9826	1919539	CBDivE_010684	CNC(=O)OCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G05	compound treatment	1.276	0.00676	0.09	1.464	0.00173	0.02	0.0811	0.8614	1340108	CBDivE_010685	COc1ccccc1C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G06	compound treatment	1.278	0.00876	0.12	1.452	-0.0103	-0.14	-0.0155	-0.0846	1919540	CBDivE_010686	OC(=O)CCCNS(=O)(=O)/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G07	compound treatment	1.314	0.0448	0.6	1.482	0.0197	0.27	0.6172	0.9337	1012692	CBDivE_010687	CC(=O)Nc1ccccc1c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G08	compound treatment	1.27	7.59E-4	0.01	1.469	0.00673	0.09	0.0721	0.7812	1192684	CBDivE_010688	COC(=O)c1ccc(NC(=O)CN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G09	compound treatment	1.306	0.0368	0.5	1.513	0.0507	0.69	0.8398	0.9867	1919541	CBDivE_010689	[O-][N+](=O)c1ccc(Nc2ccc(cc2)c3ccc(Nc4ccc([N+](=O)[O-])c5nonc45)cc3)c6nonc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G10	compound treatment	1.281	0.0118	0.16	1.528	0.0657	0.9	0.7459	0.8195	1919542	CBDivE_010690	S=C(N/C(=N\Cc1ccccc1)/c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G11	compound treatment	1.369	0.0998	1.35	1.498	0.0357	0.49	1.2961	0.9056	1919543	CBDivE_010691	CC(C)(C)NC1CC(=O)N(C1=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G12	compound treatment	1.176	-0.0932	-1.26	1.494	0.0317	0.43	-0.5835	-0.4387	1919544	CBDivE_010692	[O-][N+](=O)c1cc(ccc1Br)C(=O)Oc2ccc(OC(=O)c3ccc(Br)c(c3)[N+](=O)[O-])c(c2)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G13	compound treatment	1.288	0.0188	0.25	1.486	0.0237	0.32	0.4077	0.9926	1507702	CBDivE_010693	CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NC(=O)Nc2ncc(cn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G14	compound treatment	1.258	-0.0112	-0.15	1.47	0.00773	0.11	-0.0327	-0.1772	1919545	CBDivE_010694	O=C1CNCC(=O)N1CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G15	compound treatment	1.318	0.0488	0.66	1.535	0.0727	0.99	1.1664	0.9801	1919546	CBDivE_010695	[O-][N+](=O)c1cccc(c1)C2C3=C(Oc4c2c(=O)sc5ccccc45)c6ccccc6C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G16	compound treatment	1.259	-0.0102	-0.14	1.516	0.0537	0.73	0.4204	0.5638	1919547	CBDivE_010696	Clc1ccccc1COC(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G17	compound treatment	1.343	0.0738	1.0	1.523	0.0607	0.83	1.2892	0.9958	1919548	CBDivE_010697	CNC(=S)NCCCCc1n[nH]c(N)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G18	compound treatment	1.266	-0.00324	-0.04	1.49	0.0277	0.38	0.2364	0.6212	1774943	CBDivE_010698	Cc1ccc(NC(=O)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G19	compound treatment	1.359	0.0898	1.21	1.501	0.0387	0.53	1.2297	0.9308	1919549	CBDivE_010699	[O-][N+](=O)c1ccc(N/N=C/c2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	G20	compound treatment	1.277	0.00776	0.1	1.438	-0.0243	-0.33	-0.16	-0.461	1919550	CBDivE_010700	CCc1cccc(NC(=O)C/C(=N/Nc2ccccc2)/C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H01	compound treatment	1.223	-0.0462	-0.62	1.362	-0.1	-1.37	-1.408	-0.9368	1919551	CBDivE_010701	Cc1nc(Sc2ccc(Cl)cc2)c3c4CCCCc4sc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H02	compound treatment	1.235	-0.0342	-0.46	1.446	-0.0163	-0.22	-0.4836	-0.9436	1919552	CBDivE_010702	OC(=O)[C@@]1(CC[C@@H](C1)Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H03	compound treatment	1.29	0.0208	0.28	1.413	-0.0493	-0.67	-0.2771	-0.3807	1919553	CBDivE_010703	CC1(C)C(C=C(Cl)Cl)C1C(=O)NCCOC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H04	compound treatment	1.285	0.0158	0.21	1.416	-0.0463	-0.63	-0.2959	-0.4443	1641702	CBDivE_010704	COc1ccc(Cc2nn[nH]n2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H05	compound treatment	1.213	-0.0562	-0.76	1.447	-0.0153	-0.21	-0.6838	-0.8691	1660299	CBDivE_010705	COc1ccc(cc1)C(=O)CSc2ccc(Oc3ccc(SCC(=O)c4ccc(OC)cc4)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H06	compound treatment	1.262	-0.00724	-0.1	0.327	-1.14	-15.48	-11.0159	-0.7116	1919554	CBDivE_010706	Cc1cc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)cc(C)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H07	compound treatment	1.232	-0.0372	-0.5	1.432	-0.0303	-0.41	-0.6472	-0.9952	1919555	CBDivE_010707	Cc1ccccc1NC(=S)NC(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H08	compound treatment	1.228	-0.0412	-0.56	1.41	-0.0523	-0.71	-0.8975	-0.9925	1739304	CBDivE_010708	CN1CCc2[nH]c3ccc(C)cc3c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H09	compound treatment	1.218	-0.0512	-0.69	1.4	-0.0623	-0.85	-1.0893	-0.9948	1919556	CBDivE_010709	OC(=O)c1cccc2c(ccc(C(=O)O)c12)C(=O)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H10	compound treatment	1.237	-0.0322	-0.43	1.453	-0.00927	-0.13	-0.397	-0.8764	1260130	CBDivE_010710	Cn1c(CN2CCN(Cc3ccccc3)CC2)nc(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H11	compound treatment	1.377	0.108	1.45	1.412	-0.0503	-0.69	0.5432	0.338	1485495	CBDivE_010711	OC(=O)c1cccc(NC(=O)c2cccc(c2)C(=O)Nc3cccc(c3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H12	compound treatment	1.254	-0.0152	-0.21	1.454	-0.00827	-0.11	-0.2252	-0.9601	1919557	CBDivE_010712	CCOc1ccc(CCCNC(=N)N)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H13	compound treatment	1.339	0.0698	0.94	1.527	0.0647	0.88	1.2896	0.9995	1919558	CBDivE_010713	COc1ccccc1C(=O)NC(NC2CCS(=O)(=O)C2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H14	compound treatment	1.282	0.0128	0.17	1.464	0.00173	0.02	0.1384	0.7964	1919559	CBDivE_010714	CCCc1cc(CN(CC)CC)n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H15	compound treatment	1.237	-0.0322	-0.43	1.415	-0.0473	-0.64	-0.7634	-0.9817	1919560	CBDivE_010715	[O-][N+](=O)c1ccc(/C=N/c2cccc(c2)C3(c4ccccc4-c5ccccc53)c6cccc(\N=C\c7ccc(cc7)[N+](=O)[O-])c6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H16	compound treatment	1.19	-0.0792	-1.07	1.481	0.0187	0.26	-0.5753	-0.5235	1919561	CBDivE_010716	CCCCCC(=O)NC(Sc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H17	compound treatment	1.24	-0.0292	-0.39	1.511	0.0487	0.66	0.1909	0.247	1919562	CBDivE_010717	Oc1c(C(=O)NCCCCCCNC(=O)Cc2ccccc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H18	compound treatment	1.29	0.0208	0.28	1.404	-0.0583	-0.79	-0.3639	-0.4319	1919563	CBDivE_010718	Cc1cccc2/C(=N/NC(=O)COc3ccc(cc3C)C(C)(C)C)/C(=O)Nc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H19	compound treatment	1.246	-0.0232	-0.31	1.495	0.0327	0.45	0.0939	0.1721	1688113	CBDivE_010719	Cn1c(S)nc2-c3ccccc3CC4(CCCC4)c2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	H20	compound treatment	1.242	-0.0272	-0.37	1.423	-0.0393	-0.54	-0.6386	-0.9831	1775501	CBDivE_010720	[O-][N+](=O)c1ccc(cc1)n2c(CN3CCOCC3)nc4ccc(Cl)cc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I01	compound treatment	1.288	0.0188	0.25	1.438	-0.0243	-0.33	-0.0551	-0.1323	1919564	CBDivE_010721	CC(C)CC(NC(=O)c1cccc2ccccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I02	compound treatment	1.227	-0.0422	-0.57	1.47	0.00773	0.11	-0.3285	-0.5668	1919565	CBDivE_010722	ClC(Cl)(Cl)C(NC(=O)c1ccco1)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I03	compound treatment	1.353	0.0838	1.13	1.528	0.0657	0.9	1.4328	0.9934	1919566	CBDivE_010723	COc1ccc(Nc2ccc([N+](=O)[O-])c3nonc23)cc1Nc4ccc([N+](=O)[O-])c5nonc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I04	compound treatment	1.229	-0.0402	-0.54	1.457	-0.00527	-0.07	-0.4347	-0.7938	1919567	CBDivE_010724	CCCCNC(=O)OCCNS(=O)(=O)c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I05	compound treatment	1.292	0.0228	0.31	1.469	0.00673	0.09	0.282	0.8799	1511869	CBDivE_010725	COc1ccc(cc1)C(=O)NC(Cc2ccc(O)cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I06	compound treatment	1.253	-0.0162	-0.22	1.479	0.0167	0.23	0.0064	0.0201	1919568	CBDivE_010726	OC(=O)C1CCCN1Cc2c(O)ccc3c(=O)c(Oc4ccccc4)coc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I07	compound treatment	1.312	0.0428	0.58	1.504	0.0417	0.57	0.8102	1.0	1919569	CBDivE_010727	COc1ccc(/C=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I08	compound treatment	1.274	0.00476	0.06	1.52	0.0577	0.79	0.602	0.7622	1099052	CBDivE_010728	OC(=O)C1CSC(N1)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I09	compound treatment	1.324	0.0548	0.74	1.501	0.0387	0.53	0.8958	0.9865	1919570	CBDivE_010729	[O-][N+](=O)c1ccc2nonc2c1Nc3ccc(Cc4ccc(Nc5c(ccc6nonc56)[N+](=O)[O-])cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I10	compound treatment	1.277	0.00776	0.1	1.473	0.0107	0.15	0.1774	0.9865	1919571	CBDivE_010730	COc1ccc(NC(=S)N/C(=N/CS(=O)(=O)c2ccc(C)cc2)/c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I11	compound treatment	1.319	0.0498	0.67	1.504	0.0417	0.57	0.877	0.9966	1919572	CBDivE_010731	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I12	compound treatment	1.251	-0.0182	-0.25	1.509	0.0467	0.64	0.2765	0.4049	1604431	CBDivE_010732	Clc1ccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I13	compound treatment	1.344	0.0748	1.01	1.492	0.0297	0.41	0.9998	0.9198	1363793	CBDivE_010733	Clc1ccc(NC(=O)Oc2cccc(c2)N3CCCC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I14	compound treatment	1.301	0.0318	0.43	1.457	-0.00527	-0.07	0.2521	0.5803	1919573	CBDivE_010734	CC(=O)Nc1ccccc1C(=O)Nc2ccc(cc2)c3nc(c4ccc(NC(=O)c5ccccc5NC(=O)C)cc4)c6ccccc6n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I15	compound treatment	1.319	0.0498	0.67	1.503	0.0407	0.56	0.8674	0.9956	1919574	CBDivE_010735	CCCCN(CCC(=O)N)S(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I16	compound treatment	1.284	0.0148	0.2	1.486	0.0237	0.32	0.3696	0.9728	1919575	CBDivE_010736	Cc1ccc(NC(=S)NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I17	compound treatment	1.348	0.0788	1.06	1.503	0.0407	0.56	1.144	0.9542	1919576	CBDivE_010737	CC(=O)c1ccc(NC(=O)Cn2ccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I18	compound treatment	1.254	-0.0152	-0.21	1.538	0.0757	1.03	0.5848	0.5554	1919577	CBDivE_010738	CC(=O)N1C(=O)/C(=C/2\SC(=S)N(C(CCC(=O)O)C(=O)O)C2=O)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I19	compound treatment	1.376	0.107	1.44	1.494	0.0317	0.43	1.3243	0.8806	1919578	CBDivE_010739	[O-][N+](=O)c1ccc(N/N=C(/c2ccccc2)\c3cccc(c3)C(F)(F)F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	I20	compound treatment	1.285	0.0158	0.21	1.487	0.0247	0.34	0.3888	0.9753	1445935	CBDivE_010740	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Nc2cc(C)ccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J01	compound treatment	1.229	-0.0402	-0.54	1.456	-0.00627	-0.09	-0.4444	-0.8086	1919579	CBDivE_010741	CCN1/C(=C\2/SC(=S)N(CC=C)C2=O)/C=Cc3cc(OC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J02	compound treatment	1.232	-0.0372	-0.5	1.462	-2.73E-4	0.0	-0.3579	-0.7123	1919580	CBDivE_010742	Cc1ccc(cc1)c2nnc(o2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J03	compound treatment	1.194	-0.0752	-1.02	1.407	-0.0553	-0.75	-1.2507	-0.9893	1919581	CBDivE_010743	CC1(C)C(C=C(Cl)Cl)C1C(=O)NCCCOC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J04	compound treatment	1.235	-0.0342	-0.46	1.454	-0.00827	-0.11	-0.4064	-0.8547	1919582	CBDivE_010744	Nc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J05	compound treatment	1.23	-0.0392	-0.53	1.442	-0.0203	-0.28	-0.5698	-0.9541	1919583	CBDivE_010745	Brc1ccc(cc1)c2ccc(/C=C(/NC(=O)c3ccccc3)\C(=O)NCc4ccccc4)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J06	compound treatment	1.226	-0.0432	-0.58	0.319	-1.14	-15.59	-11.4364	-0.7331	1919584	CBDivE_010746	Oc1ccccc1/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J07	compound treatment	1.304	0.0348	0.47	1.458	-0.00427	-0.06	0.2904	0.6145	1919585	CBDivE_010747	NS(=O)(=O)c1ccc(NC(=S)NC(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J08	compound treatment	1.272	0.00276	0.04	1.435	-0.0273	-0.37	-0.2367	-0.6332	1919586	CBDivE_010748	Cc1cc(OCC(=O)N/N=C\c2ccc(Cl)c(c2)[N+](=O)[O-])ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J09	compound treatment	1.236	-0.0332	-0.45	1.461	-0.00127	-0.02	-0.3294	-0.7339	1919587	CBDivE_010749	Nc1ccc2c(nc(nc2c1)c3ccc(cc3)c4nc(c5ccccc5)c6ccc(N)cc6n4)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J10	compound treatment	1.268	-0.00124	-0.02	1.451	-0.0113	-0.15	-0.1205	-0.7795	1919588	CBDivE_010750	Oc1ccc(/N=C/c2cc(ccc2O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J11	compound treatment	1.287	0.0178	0.24	1.478	0.0157	0.21	0.321	0.9985	1035316	CBDivE_010751	OC(=O)c1ccc(NC(=O)c2ccc(cc2)C(=O)Nc3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J12	compound treatment	1.228	-0.0412	-0.56	1.479	0.0167	0.23	-0.2321	-0.386	1919589	CBDivE_010752	COc1ccc(OCC(=O)N/N=C/2\C(=O)Nc3ccc(Br)cc23)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J13	compound treatment	1.264	-0.00524	-0.07	1.431	-0.0313	-0.43	-0.3515	-0.8132	1919590	CBDivE_010753	CN(C)CCCNC(=O)/C(=C\c1ccc(o1)c2ccc(Br)cc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J14	compound treatment	1.229	-0.0402	-0.54	1.37	-0.0923	-1.26	-1.2736	-0.9294	1919591	CBDivE_010754	FC1(F)C(F)(F)C(F)(F)C(F)(C(=O)Nc2ccc(Cl)cc2Cl)C(F)(F)C1(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J15	compound treatment	1.227	-0.0422	-0.57	1.48	0.0177	0.24	-0.232	-0.3748	1647927	CBDivE_010755	Brc1cccc(NC(=O)c2cc3ccccc3oc2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J16	compound treatment	1.163	-0.106	-1.43	1.471	0.00873	0.12	-0.9293	-0.6462	1919592	CBDivE_010756	Sc1nnc2c3c(nc(Cc4ccccc4)n12)-c5ccccc5CC63CCCCC6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J17	compound treatment	1.217	-0.0522	-0.7	1.468	0.00573	0.08	-0.4431	-0.6249	1919593	CBDivE_010757	C/C(=N\NC(=O)Cc1ccccc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J18	compound treatment	1.181	-0.0882	-1.19	1.416	-0.0463	-0.63	-1.2879	-0.9559	1919594	CBDivE_010758	CCCCSc1nnc2c3ccccc3[nH]c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J19	compound treatment	1.233	-0.0362	-0.49	1.498	0.0357	0.49	-0.0012	-0.0018	1919595	CBDivE_010759	Clc1ccc(cc1)c2nc3cc(/N=C/c4ccc(o4)c5cccc(Cl)c5)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	J20	compound treatment	1.281	0.0118	0.16	1.445	-0.0173	-0.24	-0.0544	-0.1915	1919596	CBDivE_010760	FC(F)(F)c1cccc(c1)n2c(CN3CCOCC3)nc4ccccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K01	compound treatment	1.314	0.0448	0.6	1.47	0.00773	0.11	0.5015	0.8181	1919597	CBDivE_010761	CC(C)(C)c1ccc2C3C4C(C(c5ccc(cc35)C(C)(C)C)c2c1)C(=O)N(C4=O)c6ccc(cc6)c7ccc(Cl)cc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K02	compound treatment	1.261	-0.00824	-0.11	1.466	0.00373	0.05	-0.0427	-0.3492	1919598	CBDivE_010762	COc1ccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K03	compound treatment	1.196	-0.0732	-0.99	1.488	0.0257	0.35	-0.4506	-0.4298	1919599	CBDivE_010763	Oc1ccc(Nc2ccc3nonc3c2[N+](=O)[O-])cc1Nc4ccc5nonc5c4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K04	compound treatment	1.237	-0.0322	-0.43	1.438	-0.0243	-0.33	-0.5416	-0.9909	1919600	CBDivE_010764	CNC(=O)NCCOC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K05	compound treatment	1.344	0.0748	1.01	1.479	0.0167	0.23	0.8744	0.8457	1423425	CBDivE_010765	COC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K06	compound treatment	1.276	0.00676	0.09	1.486	0.0237	0.32	0.2933	0.8724	1613915	CBDivE_010766	Cc1cc(=O)oc2cc(OCC(=O)Nc3ccccc3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K07	compound treatment	1.251	-0.0182	-0.25	1.458	-0.00427	-0.06	-0.2152	-0.851	1919601	CBDivE_010767	[O-][N+](=O)c1ccccc1S(=O)(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K08	compound treatment	1.246	-0.0232	-0.31	1.466	0.00373	0.05	-0.1858	-0.5849	1919602	CBDivE_010768	Cc1ccc(cc1)C2=NCN(C(=S)N2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K09	compound treatment	1.246	-0.0232	-0.31	1.472	0.00973	0.13	-0.1279	-0.3757	1919603	CBDivE_010769	Oc1ccc(cc1)c2ccc(Cc3ccc(cc3)c4ccc(O)cc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K10	compound treatment	1.272	0.00276	0.04	1.532	0.0697	0.95	0.6986	0.7342	1256170	CBDivE_010770	Oc1ccc(cc1)S(=O)(=O)c2ccc(OCC=C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K11	compound treatment	1.298	0.0288	0.39	1.509	0.0467	0.64	0.7249	0.9717	1919604	CBDivE_010771	Nc1ccc2nsnc2c1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K12	compound treatment	1.253	-0.0162	-0.22	1.43	-0.0323	-0.44	-0.4661	-0.9481	1919605	CBDivE_010772	COc1cc(COC(=O)c2ccc(cc2)[N+](=O)[O-])ccc1OC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K13	compound treatment	1.293	0.0238	0.32	1.471	0.00873	0.12	0.3108	0.909	1919606	CBDivE_010773	CC(=O)Nc1cccc(Nc2c(cc(cc2[N+](=O)[O-])C(=O)O)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K14	compound treatment	1.25	-0.0192	-0.26	1.483	0.0207	0.28	0.0163	0.0425	1919607	CBDivE_010774	OC(=O)c1ccc(O)cc1/N=C/c2ccc(\C=N\c3cc(O)ccc3C(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K15	compound treatment	1.312	0.0428	0.58	1.495	0.0327	0.45	0.7235	0.992	1919608	CBDivE_010775	CC1(C)C(N(O)C(=O)Nc2ccccc2)N(C(=O)N1CC(=O)N/N=C/3\CCCc4c3no[n+]4[O-])c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K16	compound treatment	1.276	0.00676	0.09	1.486	0.0237	0.32	0.2933	0.8724	1919609	CBDivE_010776	CO/C(=N\C(NC(=S)Nc1ccc(Br)cc1)C(Cl)(Cl)Cl)/c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K17	compound treatment	1.337	0.0678	0.91	1.463	7.27E-4	0.01	0.6534	0.7147	1787269	CBDivE_010777	[O-][N+](=O)c1ccc(cc1)c2c3c(=O)c4ccccc4c3nc5c6ccccc6c(=O)c25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K18	compound treatment	1.299	0.0298	0.4	1.475	0.0127	0.17	0.4066	0.9296	1919610	CBDivE_010778	OC(=O)c1ccc(cc1NC(=O)c2cccc3ccccc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K19	compound treatment	1.312	0.0428	0.58	1.584	0.122	1.66	1.5816	0.9	1084273	CBDivE_010779	O=C(C1CCOC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	K20	compound treatment	1.302	0.0328	0.44	1.537	0.0747	1.02	1.033	0.9301	1919611	CBDivE_010780	CC1=C(C(NC(=O)N1)c2cc(ccc2O)[N+](=O)[O-])C(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L01	compound treatment	1.252	-0.0172	-0.23	1.444	-0.0183	-0.25	-0.3407	-0.9994	1919612	CBDivE_010781	Oc1ccccc1/C=N/c2cccc(c2)C3(c4cccc(\N=C\c5ccccc5O)c4)c6ccccc6C(=O)c7ccccc73
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L02	compound treatment	1.215	-0.0542	-0.73	1.365	-0.0973	-1.33	-1.4554	-0.9607	1013997	CBDivE_010782	Cc1ccc2nc(sc2c1)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L03	compound treatment	1.285	0.0158	0.21	1.407	-0.0553	-0.75	-0.3826	-0.4886	1919613	CBDivE_010783	CC1(C)C(C=C(Cl)Cl)C1C(=O)NCCCOC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L04	compound treatment	1.216	-0.0532	-0.72	1.385	-0.0773	-1.05	-1.253	-0.9825	1116820	CBDivE_010784	CCOC(=O)C(Cc1cc(I)c(O)c(I)c1)NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L05	compound treatment	1.156	-0.113	-1.53	1.451	-0.0113	-0.15	-1.1889	-0.7744	1919614	CBDivE_010785	CC(C)(C)NC(=O)/C(=C/c1ccc(o1)c2ccc(cc2)[N+](=O)[O-])/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L06	compound treatment	1.233	-0.0362	-0.49	0.323	-1.14	-15.54	-11.3311	-0.729	1919615	CBDivE_010786	CCOc1c(OCC)c2oc(C(=O)N3CCN(C)CC3)c(C)c2cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L07	compound treatment	1.195	-0.0742	-1.0	1.464	0.00173	0.02	-0.6916	-0.6903	1919616	CBDivE_010787	C1CCc2c(Nc3ccccc3)n[nH]c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L08	compound treatment	1.208	-0.0612	-0.83	1.461	-0.00127	-0.02	-0.5965	-0.7218	1919617	CBDivE_010788	[O-][N+](=O)c1cccc(/C=C/C=N/NC(=O)COc2c(Br)cc(Br)cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L09	compound treatment	1.251	-0.0182	-0.25	1.453	-0.00927	-0.13	-0.2634	-0.9521	1919618	CBDivE_010789	Nc1ccc(cc1)C(=O)Nc2ccc(cc2Cl)c3nc4ccc(NC(=O)c5ccc(N)cc5)c(Cl)c4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L10	compound treatment	1.238	-0.0312	-0.42	1.408	-0.0543	-0.74	-0.8213	-0.9644	1919619	CBDivE_010790	O=C(Sc1cccc2c(SC(=O)c3ccccc3)cccc12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L11	compound treatment	1.227	-0.0422	-0.57	1.42	-0.0423	-0.58	-0.8106	-1.0	1919620	CBDivE_010791	OC(=O)c1ccc(cc1NC(=O)c2cccc(c2)C(=O)Nc3cc(ccc3C(=O)O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L12	compound treatment	1.242	-0.0272	-0.37	1.416	-0.0463	-0.63	-0.7061	-0.9669	1300562	CBDivE_010792	CC(=O)OCCN1C(=O)c2ccc(cc2C1=O)c3ccc4C(=O)N(CCOC(=O)C)C(=O)c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L13	compound treatment	1.298	0.0288	0.39	1.455	-0.00727	-0.1	0.2042	0.5099	1919621	CBDivE_010793	CN(C)CCCNC(=O)/C(=C\c1ccc(o1)c2ccc(Br)cc2)/NC(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L14	compound treatment	1.267	-0.00224	-0.03	1.397	-0.0653	-0.89	-0.6508	-0.7307	1919622	CBDivE_010794	CCCCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L15	compound treatment	1.293	0.0238	0.32	1.379	-0.0833	-1.14	-0.5763	-0.4884	1919623	CBDivE_010795	COc1ccc(cc1)C(OCC2OC(C(O[C@H]3CCCCO3)C2O)n4ncc(=O)[nH]c4=O)(c5ccccc5)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L16	compound treatment	1.257	-0.0122	-0.17	1.406	-0.0563	-0.77	-0.6594	-0.84	1434704	CBDivE_010796	OC(=O)c1ccc(CN2CCCCC2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L17	compound treatment	1.269	-2.41E-4	0.0	1.474	0.0117	0.16	0.1108	0.6926	1919624	CBDivE_010797	CCc1c(C)nn2c1n3nc(C)c(CC)c3n4nc(C)c(CC)c24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L18	compound treatment	1.243	-0.0262	-0.35	1.419	-0.0433	-0.59	-0.6676	-0.9701	1919625	CBDivE_010798	Clc1ccc(/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L19	compound treatment	1.255	-0.0142	-0.19	1.513	0.0507	0.69	0.3533	0.4921	1919626	CBDivE_010799	C/C(=N\NC(=O)COc1c(C)cc(Br)cc1C)/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	L20	compound treatment	1.22	-0.0492	-0.66	1.448	-0.0143	-0.19	-0.6074	-0.8774	1148723	CBDivE_010800	O=c1n(c(CSc2nnnn2c3ccccc3)nc4ccccc14)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M01	compound treatment	1.304	0.0348	0.47	1.43	-0.0323	-0.44	0.0204	0.0317	1919627	CBDivE_010801	Cc1ccc(s1)C(C(=O)O)c2ccc(C)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M02	compound treatment	1.188	-0.0812	-1.1	1.443	-0.0193	-0.26	-0.9608	-0.8525	1919628	CBDivE_010802	Cc1cccc(C)c1n2nnnc2C(C)(C)N3CCN(CC3)C(C)(C)c4nnnn4c5c(C)cccc5C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M03	compound treatment	1.262	-0.00724	-0.1	1.468	0.00573	0.08	-0.0139	-0.1108	1919629	CBDivE_010803	[O-][N+](=O)c1ccc2nonc2c1Nc3ccc(Cc4ccc(Nc5c(ccc6nonc56)[N+](=O)[O-])c(Cl)c4)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M04	compound treatment	1.208	-0.0612	-0.83	1.49	0.0277	0.38	-0.3168	-0.3487	1919630	CBDivE_010804	CCCCNC(=O)NCCOC(=O)Nc1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M05	compound treatment	1.344	0.0748	1.01	1.428	-0.0343	-0.47	0.3827	0.3443	1919631	CBDivE_010805	CN(C)CCCNC(=O)/C(=C\c1ccccc1F)/NC(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M06	compound treatment	1.229	-0.0402	-0.54	1.479	0.0167	0.23	-0.2226	-0.378	1573203	CBDivE_010806	COC(=O)C(Cc1ccccc1)NC(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M07	compound treatment	1.286	0.0168	0.23	1.48	0.0177	0.24	0.3308	0.9994	1919632	CBDivE_010807	[O-][N+](=O)c1ccc(cc1)N2C(=O)CC(N3CCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M08	compound treatment	1.252	-0.0172	-0.23	1.424	-0.0383	-0.52	-0.5335	-0.9337	1919633	CBDivE_010808	COc1ccc(cc1)N2CN=C(NC2=S)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M09	compound treatment	1.329	0.0598	0.81	1.492	0.0297	0.41	0.8567	0.9494	1919634	CBDivE_010809	[O-][N+](=O)c1ccc(cc1)n2cccc2/C=N\NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M10	compound treatment	1.265	-0.00424	-0.06	1.481	0.0187	0.26	0.1401	0.5354	1919635	CBDivE_010810	COc1ccc(CC(C(=O)NN)C(=O)NN)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M11	compound treatment	1.292	0.0228	0.31	1.461	-0.00127	-0.02	0.2048	0.6661	1384557	CBDivE_010811	Cc1ccc2n3CCN(C4CCCc(c43)c2c1)C(=O)c5ccccc5C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M12	compound treatment	1.26	-0.00924	-0.12	1.435	-0.0273	-0.37	-0.3511	-0.8952	1518713	CBDivE_010812	OC(=O)C(Cc1ccccc1)N2C(=O)CSC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M13	compound treatment	1.281	0.0118	0.16	1.52	0.0577	0.79	0.6688	0.8329	1919636	CBDivE_010813	[O-][N+](=O)c1cccc(c1)c2c3c(=O)c4ccccc4c3nc5c6ccccc6c(=O)c25
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M14	compound treatment	1.286	0.0168	0.23	1.498	0.0357	0.49	0.5044	0.9391	1919637	CBDivE_010814	OC(=O)c1ccc(cc1NC(=O)c2ccccc2[N+](=O)[O-])C(=O)c3ccc(C(=O)O)c(NC(=O)c4ccccc4[N+](=O)[O-])c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M15	compound treatment	1.32	0.0508	0.68	1.428	-0.0343	-0.47	0.1537	0.1854	1919638	CBDivE_010815	CC1(C)C(N(O)C(=O)Nc2ccc(Cl)c(Cl)c2)N(C(=O)N1CC(=O)N/N=C\c3ccc(cc3)[N+](=O)[O-])c4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M16	compound treatment	1.284	0.0148	0.2	1.476	0.0137	0.19	0.2731	0.9995	1002042	CBDivE_010816	Oc1c(ccc2cccnc12)C(Nc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M17	compound treatment	1.339	0.0698	0.94	1.516	0.0537	0.73	1.1835	0.9923	1316988	CBDivE_010817	OCc1nc(CO)n(Cc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M18	compound treatment	1.256	-0.0132	-0.18	1.477	0.0147	0.2	0.0157	0.0584	1170420	CBDivE_010818	OC(=O)c1cc(NC(=O)c2cccc3ccccc23)c(cc1NC(=O)c4cccc5ccccc45)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M19	compound treatment	1.34	0.0708	0.95	1.56	0.0977	1.33	1.6173	0.9866	1415163	CBDivE_010819	COc1ccc2[nH]cc(CCN3CCOC3=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	M20	compound treatment	1.283	0.0138	0.19	1.511	0.0487	0.66	0.6011	0.8713	1919639	CBDivE_010820	CC(C)(c1ccc(Oc2cccc(/N=C/c3ccccc3O)c2)cc1)c4ccc(Oc5cccc(/N=C/c6ccccc6O)c5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N01	compound treatment	1.208	-0.0612	-0.83	1.423	-0.0393	-0.54	-0.9629	-0.978	1919640	CBDivE_010821	CCOC(=O)c1ccc(NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C4(CC5CC6CC(C5)C4)C6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N02	compound treatment	1.189	-0.0802	-1.08	1.364	-0.0983	-1.34	-1.713	-0.9944	1919641	CBDivE_010822	C/C(=N\NC(=O)COc1ccc(C)cc1C)/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N03	compound treatment	1.269	-2.41E-4	0.0	1.417	-0.0453	-0.62	-0.4388	-0.7108	1919642	CBDivE_010823	O=C(OCCCN1C(=O)c2ccccc2C1=O)C(Cc3ccccc3)N4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N04	compound treatment	1.221	-0.0482	-0.65	1.334	-0.128	-1.75	-1.6971	-0.9093	1316913	CBDivE_010824	CCCCc1c(cccc1C(O)c2ccccc2)C(O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N05	compound treatment	1.285	0.0158	0.21	1.423	-0.0393	-0.54	-0.2284	-0.3963	1919643	CBDivE_010825	OCCNC(=O)/C(=C/c1ccc(o1)c2ccc(Cl)cc2)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N06	compound treatment	1.247	-0.0222	-0.3	0.315	-1.15	-15.64	-11.2746	-0.7205	1919644	CBDivE_010826	OC(=O)[C@H]1[C@@H]([C@@H]([C@H]1c2ccc(cc2)[N+](=O)[O-])C(=O)O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N07	compound treatment	1.176	-0.0932	-1.26	1.453	-0.00927	-0.13	-0.9789	-0.7743	1917454	CBDivE_010827	c1ccc(cc1)c2ccnc3nc4ccccc4n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N08	compound treatment	1.171	-0.0982	-1.33	1.376	-0.0863	-1.18	-1.769	-0.9982	1919645	CBDivE_010828	CN(C)C(c1nnnn1c2c(C)cccc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N09	compound treatment	1.177	-0.0922	-1.24	1.394	-0.0683	-0.93	-1.5382	-0.9898	1919646	CBDivE_010829	Nc1cc(ccc1C(=O)O)C(=O)c2ccc(C(=O)O)c(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N10	compound treatment	1.219	-0.0502	-0.68	1.416	-0.0463	-0.63	-0.9255	-0.9994	1324727	CBDivE_010830	Oc1cc(Cc2ccccc2)cnc1CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N11	compound treatment	1.218	-0.0512	-0.69	1.421	-0.0413	-0.56	-0.8868	-0.9948	1919647	CBDivE_010831	Clc1ccc(NC(=O)c2cccc(c2)C(=O)Nc3ccc(Cl)cc3C(=O)c4ccccc4)c(c1)C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N12	compound treatment	1.206	-0.0632	-0.85	1.403	-0.0593	-0.81	-1.1748	-0.9996	1776912	CBDivE_010832	Cc1c(cc(cc1[N+](=O)[O-])C(=O)Nc2ccc(cc2)c3nc4cc(Cl)ccc4o3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N13	compound treatment	1.273	0.00376	0.05	1.421	-0.0413	-0.56	-0.3621	-0.6408	1919648	CBDivE_010833	BrCc1cc2ccc3ccccc3c2cc1CBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N14	compound treatment	1.205	-0.0642	-0.87	1.401	-0.0613	-0.84	-1.2036	-0.9998	1919649	CBDivE_010834	Cc1ccc2n(C)c3/C(=N/NC(=S)N)/CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N15	compound treatment	1.249	-0.0202	-0.27	1.409	-0.0533	-0.73	-0.7068	-0.9107	1919650	CBDivE_010835	FC(F)Sc1ccccc1Nc2nc(Cl)nc(Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N16	compound treatment	1.264	-0.00524	-0.07	1.373	-0.0893	-1.22	-0.9108	-0.7469	1919651	CBDivE_010836	COc1ccc(Cn2nnnc2S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N17	compound treatment	1.202	-0.0672	-0.91	1.418	-0.0443	-0.6	-1.0683	-0.9804	1919652	CBDivE_010837	CCCCCCCC(=O)NC(NCc1ccccc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N18	compound treatment	1.293	0.0238	0.32	1.429	-0.0333	-0.45	-0.0942	-0.1696	1919653	CBDivE_010838	O=C(N/N=C/c1c[nH]nc1c2ccccc2)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N19	compound treatment	1.235	-0.0342	-0.46	1.497	0.0347	0.47	0.0082	0.0124	1919654	CBDivE_010839	CC(=C)C(=O)Nc1ccc(cc1)c2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	N20	compound treatment	1.238	-0.0312	-0.42	1.431	-0.0313	-0.43	-0.5996	-1.0	1919655	CBDivE_010840	COc1ccc(cc1OC)c2nc3ccccc3c(=O)n2NC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O01	compound treatment	1.323	0.0538	0.73	1.48	0.0177	0.24	0.6837	0.8944	1919656	CBDivE_010841	CS/C(=C/c1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O02	compound treatment	1.226	-0.0432	-0.58	1.504	0.0417	0.57	-0.0101	-0.0125	1919657	CBDivE_010842	CC(C)(C)C(NC(=O)C1(CCCCC1)N2CCC2=O)/C=C/c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O03	compound treatment	1.18	-0.0892	-1.2	1.512	0.0497	0.68	-0.3718	-0.2691	1919658	CBDivE_010843	[O-][N+](=O)c1ccc(Nc2ccc(Oc3ccc(Nc4ccc([N+](=O)[O-])c5nonc45)cc3)cc2)c6nonc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O04	compound treatment	1.306	0.0368	0.5	1.465	0.00273	0.04	0.3769	0.758	1919659	CBDivE_010844	CC1(C)C(C=C(Cl)Cl)C1C(=O)NCCOC(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O05	compound treatment	1.349	0.0798	1.08	1.455	-0.00727	-0.1	0.6907	0.6392	1361201	CBDivE_010845	COc1cc(NCn2nnc3ccccc23)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O06	compound treatment	1.261	-0.00824	-0.11	1.435	-0.0273	-0.37	-0.3416	-0.88	1919660	CBDivE_010846	COC(=O)CC(NC(=O)c1ccccc1Br)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O07	compound treatment	1.292	0.0228	0.31	1.482	0.0197	0.27	0.4073	0.9978	1919661	CBDivE_010847	CCCCc1c(cccc1C(O)(c2ccccc2)c3ccccc3)C(O)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O08	compound treatment	1.281	0.0118	0.16	1.486	0.0237	0.32	0.341	0.9462	1429493	CBDivE_010848	Cc1ccc(cc1)n2sc(=NS(=O)(=O)c3ccc(C)cc3)nc2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O09	compound treatment	1.309	0.0398	0.54	1.47	0.00773	0.11	0.4538	0.8301	1919662	CBDivE_010849	Clc1ccc2n(C(=O)c3ccncc3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O10	compound treatment	1.211	-0.0582	-0.79	1.464	0.00173	0.02	-0.5389	-0.6856	1919663	CBDivE_010850	NCC(=O)NNC(=O)OCC1c2ccccc2-c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O11	compound treatment	1.331	0.0618	0.83	1.491	0.0287	0.39	0.8661	0.9408	1919664	CBDivE_010851	CCOc1ccccc1N2C(=O)C3C(C2=O)C4(C(=O)C3(C(=C4c5ccccc5)c6ccccc6)c7ccccc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O12	compound treatment	1.284	0.0148	0.2	1.483	0.0207	0.28	0.3406	0.9853	1919665	CBDivE_010852	CC(C)C(N1C(=O)/C(=C\2/C(=O)N(C)c3ccccc23)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O13	compound treatment	1.329	0.0598	0.81	1.466	0.00373	0.05	0.606	0.7502	1919666	CBDivE_010853	ClC(Cl)(Cl)CCCCOC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O14	compound treatment	1.237	-0.0322	-0.43	1.446	-0.0163	-0.22	-0.4645	-0.9512	1919667	CBDivE_010854	Cc1ccc(cc1)/C(=N\C(=S)N(c2ccccc2)c3ccccc3)/NCS(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O15	compound treatment	1.33	0.0608	0.82	1.468	0.00573	0.08	0.6348	0.771	1638527	CBDivE_010855	COc1ccc(CN2CCN(CC2)c3ccccn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O16	compound treatment	1.3	0.0308	0.41	1.503	0.0407	0.56	0.6861	0.9897	122	CBDivE_010856	C(c1c[nH]c2ccccc12)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O17	compound treatment	1.369	0.0998	1.35	1.566	0.104	1.41	1.9518	0.9997	1919668	CBDivE_010857	CSc1sc(SC)c(C(=O)O)c1C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O18	compound treatment	1.245	-0.0242	-0.33	1.499	0.0367	0.5	0.1229	0.2054	1919669	CBDivE_010858	OC(=O)c1cc(ccc1NC(=O)c2cccc3ccccc23)c4ccc(NC(=O)c5cccc6ccccc56)c(c4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O19	compound treatment	1.356	0.0868	1.17	1.596	0.134	1.82	2.1171	0.977	1400621	CBDivE_010859	CCN(CC)C1=CC(=O)OC21CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	O20	compound treatment	1.199	-0.0702	-0.95	1.491	0.0287	0.39	-0.3931	-0.3833	1919670	CBDivE_010860	Oc1ccccc1/C=N/c2ccc(cc2)c3nc(c4ccc(\N=C\c5ccccc5O)cc4)c6ccccc6n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P01	compound treatment	1.246	-0.0232	-0.31	1.449	-0.0133	-0.18	-0.3497	-0.9659	1919671	CBDivE_010861	CC/C(=N\NC(=S)N)/CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P02	compound treatment	1.216	-0.0532	-0.72	1.424	-0.0383	-0.52	-0.8769	-0.9877	1592797	CBDivE_010862	CCc1ccc(cc1)c2nc3cc(NC(=O)c4ccc(Cl)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P03	compound treatment	1.279	0.00976	0.13	1.359	-0.103	-1.41	-0.9027	-0.6382	1919672	CBDivE_010863	OC(=O)CSc1cc(ccc1[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P04	compound treatment	1.187	-0.0822	-1.11	1.404	-0.0583	-0.79	-1.3464	-0.9866	1919673	CBDivE_010864	CCOC(=O)c1c(sc2C(=C(CCc12)C=O)Cl)n3cccc3C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P05	compound treatment	1.241	-0.0282	-0.38	1.458	-0.00427	-0.06	-0.3106	-0.8059	1919674	CBDivE_010865	CCCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(N3CCCCC3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P06	compound treatment	1.193	-0.0762	-1.03	0.336	-1.13	-15.36	-11.5873	-0.7528	1919675	CBDivE_010866	NNC(=O)c1c(O)c2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P07	compound treatment	1.207	-0.0622	-0.84	1.415	-0.0473	-0.64	-1.0496	-0.9915	1919676	CBDivE_010867	O=C/1Nc2ccccc2\C1=N/Nc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P08	compound treatment	1.214	-0.0552	-0.75	1.387	-0.0753	-1.03	-1.2528	-0.9876	1919677	CBDivE_010868	Cc1cccc(C)c1n2nnnc2C(N3CCOCC3)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P09	compound treatment	1.151	-0.118	-1.6	1.335	-0.127	-1.74	-2.3552	-0.9991	1919678	CBDivE_010869	[O-][N+](=O)c1ccccc1c2nc3ccc(Oc4ccc5nc([nH]c5c4)c6ccccc6[N+](=O)[O-])cc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P10	compound treatment	0.836	-0.433	-5.84	0.882	-0.58	-7.91	-9.7281	-0.9889	1630189	CBDivE_010870	CC1CCC2C(O1)c3ccccc3OC2(C)CCC=C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P11	compound treatment	1.233	-0.0362	-0.49	1.389	-0.0733	-1.0	-1.0522	-0.9459	1919679	CBDivE_010871	CC(=O)Nc1cc(ccc1C(=O)O)C(=O)c2ccc(C(=O)O)c(NC(=O)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P12	compound treatment	1.244	-0.0252	-0.34	1.338	-0.124	-1.69	-1.4391	-0.8326	1919680	CBDivE_010872	O/N=C/c1ccc(o1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P13	compound treatment	1.212	-0.0572	-0.77	1.413	-0.0493	-0.67	-1.0212	-0.9976	1722197	CBDivE_010873	Nc1ccc(cc1)c2nc3ccc(Cc4ccc5nc([nH]c5c4)c6ccc(N)cc6)cc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P14	compound treatment	1.226	-0.0432	-0.58	1.413	-0.0493	-0.67	-0.8876	-0.9975	1382844	CBDivE_010874	CC(C)(C)Nc1nc(NC(C)(C)C)nc(n1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P15	compound treatment	1.284	0.0148	0.2	1.421	-0.0413	-0.56	-0.2572	-0.4308	1919681	CBDivE_010875	Cc1cc(C)c(NC(=O)NC(CO)C(O)c2ccc(cc2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P16	compound treatment	1.236	-0.0332	-0.45	1.385	-0.0773	-1.05	-1.0622	-0.9275	1335827	CBDivE_010876	O=C1CSC2N1CCNC32CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P17	compound treatment	1.194	-0.0752	-1.02	1.371	-0.0913	-1.24	-1.5978	-0.9949	1654328	CBDivE_010877	C(Nc1nc(nc(n1)N2CCOCC2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P18	compound treatment	1.125	-0.144	-1.95	1.403	-0.0593	-0.81	-1.9475	-0.9243	1652604	CBDivE_010878	Cn1c(SCc2ccccc2)nc(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P19	compound treatment	1.266	-0.00324	-0.04	1.417	-0.0453	-0.62	-0.4675	-0.7553	1919682	CBDivE_010879	Cc1c(cc(cc1[N+](=O)[O-])C(=O)Nc2cccc(c2)c3nc4ccccc4o3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.34	P20	compound treatment	1.23	-0.0392	-0.53	1.384	-0.0783	-1.07	-1.1291	-0.9477	1919683	CBDivE_010880	COc1ccc(/C=C/c2nc3ccccc3c(=O)n2c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A01	compound treatment	1.278	0.00431	0.06				0.0581	1.0	1229221	CBDivE_010881	O=c1[nH]c(nc2-c3ccccc3CC4(CCCCC4)c21)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A02	compound treatment	1.326	0.0523	0.71				0.7057	1.0	1919684	CBDivE_010882	CCC(N)C(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A03	compound treatment	1.3	0.0263	0.35				0.3549	1.0	1919685	CBDivE_010883	COc1ccc(/C=N/NC(=O)CNC(=O)c2ccccc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A04	compound treatment	1.325	0.0513	0.69				0.6922	1.0	1919686	CBDivE_010884	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A05	compound treatment	1.351	0.0773	1.04				1.0429	1.0	1919687	CBDivE_010885	[O-][N+](=O)c1ccc(cc1)C(=O)NC(Nc2ccc(Cl)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A06	compound treatment	1.283	0.00931	0.13				0.1256	1.0	1919688	CBDivE_010886	CC(C)c1ccc(C)c(OCC(=O)N/N=C/2\C(=O)N(C)c3ccc(Br)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A07	compound treatment	1.341	0.0673	0.91				0.908	1.0	1879036	CBDivE_010887	CC1CC(CCO1)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A08	compound treatment	1.344	0.0703	0.95				0.9485	1.0	1919689	CBDivE_010888	Oc1c(ccc2C(=O)c3ccccc3C(=O)c12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A09	compound treatment	1.33	0.0563	0.76				0.7596	1.0	1919458	CBDivE_010889	COc1ccc(CNC(=N)NC(=N)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A10	compound treatment	1.312	0.0383	0.52				0.5168	1.0	1919690	CBDivE_010890	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc3oc(nc3c2)c4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A11	compound treatment	1.317	0.0433	0.58				0.5842	1.0	1919691	CBDivE_010891	COc1ccc2cc(/C=N/NC(=O)c3ccccc3O)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A12	compound treatment	1.31	0.0363	0.49				0.4898	1.0	1919692	CBDivE_010892	Nc1ccc(c2nc3ccccc3s2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A13	compound treatment	1.361	0.0873	1.18				1.1778	1.0	1438838	CBDivE_010893	OC(=O)CCC(=O)Nc1ccc(cc1)c2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A14	compound treatment	1.283	0.00931	0.13				0.1256	1.0	1919693	CBDivE_010894	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A15	compound treatment	1.272	-0.00169	-0.02				-0.0228	-1.0	1393220	CBDivE_010895	C(Oc1cc2ccoc2cc1OCc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A16	compound treatment	1.235	-0.0387	-0.52				-0.522	-1.0	1591955	CBDivE_010896	Oc1ccc(cc1)c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A17	compound treatment	1.39	0.116	1.57				1.5691	1.0	1919694	CBDivE_010897	O=C(Nc1cccc(c1)C(=O)/C=C/c2ccccc2)c3ccc4C(=O)N(C(=O)c4c3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A18	compound treatment	1.32	0.0463	0.62				0.6247	1.0	1919695	CBDivE_010898	Cc1nn(c(O)c1/C=N/NC(=O)COc2ccc(C)cc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A19	compound treatment	1.295	0.0213	0.29				0.2874	1.0	1919696	CBDivE_010899	CN1CCN(CC1)C(=O)c2oc3c4OCCOc4ccc3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	A20	compound treatment	1.212	-0.0617	-0.83				-0.8323	-1.0	1919697	CBDivE_010900	[O-][N+](=O)c1c(ccc2C(=O)c3ccccc3C(=O)c12)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B01	compound treatment	1.288	0.0143	0.19				0.193	1.0	1919698	CBDivE_010901	CCOC(=O)/C(=N/O)/C(=N/NC(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B02	compound treatment	1.351	0.0773	1.04				1.0429	1.0	1774580	CBDivE_010902	CCOC(=O)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B03	compound treatment	1.283	0.00931	0.13				0.1256	1.0	1743284	CBDivE_010903	Cc1ccc(cc1)S(=O)(=O)n2c(=O)oc3cc(Br)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B04	compound treatment	1.265	-0.00869	-0.12				-0.1173	-1.0	1726164	CBDivE_010904	O=c1c2CCn3c2n(c(=O)c4ccccc34)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B05	compound treatment	1.263	-0.0107	-0.14				-0.1443	-1.0	1301823	CBDivE_010905	OC(=O)CCS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B06	compound treatment	1.233	-0.0407	-0.55				-0.549	-1.0	1919699	CBDivE_010906	Cc1cc(O)c(C2=NCCSC(C2)c3cccc(Br)c3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B07	compound treatment	1.306	0.0323	0.44				0.4358	1.0	1919700	CBDivE_010907	CN(C)c1ccc(/C=N/N=C(\N)/C(=N/N=C/c2ccc(cc2)N(C)C)/N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B08	compound treatment	1.367	0.0933	1.26				1.2588	1.0	1919701	CBDivE_010908	COC(=O)CCS(=O)(=O)c1ccc(C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B09	compound treatment	1.215	-0.0587	-0.79				-0.7918	-1.0	1919702	CBDivE_010909	Clc1cc2CCCNC(=O)c2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B10	compound treatment	1.357	0.0833	1.12				1.1239	1.0	1018868	CBDivE_010910	NC(=N)SCc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B11	compound treatment	1.25	-0.0237	-0.32				-0.3196	-1.0	1919703	CBDivE_010911	CCCc1noc2CC(C)(C)c3c(O)noc3-c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B12	compound treatment	1.269	-0.00469	-0.06				-0.0633	-1.0	1919704	CBDivE_010912	COC(=O)C1C(=O)/C(=C/Nc2ccc(N\C=C\3/C(=O)CC(C)(C)C(C(=O)OC)C3=O)cc2)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B13	compound treatment	1.304	0.0303	0.41				0.4089	1.0	1919705	CBDivE_010913	CCCCCNc1nc(nc(n1)N2CCOCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B14	compound treatment	1.247	-0.0267	-0.36				-0.3601	-1.0	1055032	CBDivE_010914	[O-][N+](=O)c1cccc(c1)c2nc(c([nH]2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B15	compound treatment	1.345	0.0713	0.96				0.962	1.0	1919706	CBDivE_010915	OC(=O)c1cc(cc(c1)C(=O)O)N2C(=O)c3ccc(cc3C2=O)c4ccc5C(=O)N(C(=O)c5c4)c6cc(cc(c6)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B16	compound treatment	1.237	-0.0367	-0.5				-0.495	-1.0	1919707	CBDivE_010916	CSc1sc(C)cc1/C=N/Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B17	compound treatment	1.264	-0.00969	-0.13				-0.1308	-1.0	1306739	CBDivE_010917	CC(C)CNc1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B18	compound treatment	1.243	-0.0307	-0.41				-0.4141	-1.0	1161485	CBDivE_010918	OC(=O)CSc1nc2ccc(Br)cc2o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B19	compound treatment	1.254	-0.0197	-0.27				-0.2657	-1.0	1919708	CBDivE_010919	COc1ccc(cc1)[C@H]2[C@@H]([C@@H]([C@H]2C(=O)O)c3ccc(OC)cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	B20	compound treatment	1.189	-0.0847	-1.14				-1.1426	-1.0	1919709	CBDivE_010920	OS(=O)(=O)c1ccc(N/N=C/c2cccc(\C=N\Nc3ccc(cc3)S(=O)(=O)O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C01	compound treatment	1.257	-0.0167	-0.23				-0.2252	-1.0	1919710	CBDivE_010921	CCCOP(=S)(OCCC)SNC(=O)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C02	compound treatment	1.276	0.00231	0.03				0.0311	1.0	1027347	CBDivE_010922	Oc1c(ccc2C(=O)c3c(O)c(ccc3C(=O)c12)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C03	compound treatment	1.377	0.103	1.39				1.3937	1.0	1919711	CBDivE_010923	Cc1cccc(C)c1n2nnnc2C(Nc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C04	compound treatment	1.268	-0.00569	-0.08				-0.0768	-1.0	1919712	CBDivE_010924	COC(=O)C1=C(C(=O)OC)C2(OC1c3ccc(F)cc3)C(=O)c4ccccc4C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C05	compound treatment	1.297	0.0233	0.31				0.3144	1.0	1119698	CBDivE_010925	Cc1ccc(O)c(CCc2ccc(N)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C06	compound treatment	1.281	0.00731	0.1				0.0986	1.0	1919713	CBDivE_010926	CCCC(=O)NC(Nc1ccc(Br)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C07	compound treatment	1.306	0.0323	0.44				0.4358	1.0	1171914	CBDivE_010927	COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)ncn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C08	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1122981	CBDivE_010928	O=C1NC(=O)c2cc(ccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C09	compound treatment	1.3	0.0263	0.35				0.3549	1.0	1919714	CBDivE_010929	Cc1cc(C)n(n1)C(=O)c2nn(C)cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C10	compound treatment	1.292	0.0183	0.25				0.247	1.0	1777794	CBDivE_010930	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc3oc(nc3c2)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C11	compound treatment	1.382	0.108	1.46				1.4611	1.0	1160203	CBDivE_010931	Cc1cc(=O)oc2cc(OCc3ccccc3)c(OCc4ccccc4)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C12	compound treatment	1.291	0.0173	0.23				0.2335	1.0	1024363	CBDivE_010932	Nc1ccc(cc1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C13	compound treatment	1.312	0.0383	0.52				0.5168	1.0	1674876	CBDivE_010933	CCOC(=O)c1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C14	compound treatment	1.343	0.0693	0.93				0.935	1.0	1919715	CBDivE_010934	O=C(N/N=C/c1ccncc1)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C15	compound treatment	1.359	0.0853	1.15				1.1508	1.0	1919716	CBDivE_010935	CCCCCN(CCCCC)C(=O)c1ccccc1C(=O)Nc2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C16	compound treatment	1.253	-0.0207	-0.28				-0.2792	-1.0	1919717	CBDivE_010936	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)Sc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C17	compound treatment	1.317	0.0433	0.58				0.5842	1.0	1919718	CBDivE_010937	CC1(C)CC(=O)C(=C(C1)Nc2ccc(N=Nc3ccccc3)cc2)C(=O)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C18	compound treatment	1.271	-0.00269	-0.04				-0.0363	-1.0	1919719	CBDivE_010938	CC(C)(C)c1ccc(cc1)C(=O)Nc2cccc(NC(=O)c3cccc(c3)[N+](=O)[O-])c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C19	compound treatment	1.334	0.0603	0.81				0.8136	1.0	1919720	CBDivE_010939	[O-][N+](=O)c1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	C20	compound treatment	1.242	-0.0317	-0.43				-0.4276	-1.0	1074683	CBDivE_010940	CC1CCC2=C(C1)c3c(O)cc(C)cc3OC2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D01	compound treatment	1.222	-0.0517	-0.7				-0.6974	-1.0	1919721	CBDivE_010941	COc1ccc(Nc2nc(Cl)nc(Cl)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D02	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1919722	CBDivE_010942	CC1(C)CC(=O)C(=CNc2ccccc2NC=C3C(=O)CC(C)(C)CC3=O)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D03	compound treatment	1.117	-0.157	-2.11				-2.1139	-1.0	1919723	CBDivE_010943	CN(C)C(=O)c1cc([N+](=O)[O-])c(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D04	compound treatment	1.25	-0.0237	-0.32				-0.3196	-1.0	1191310	CBDivE_010944	COc1ccc(C=c2[nH]c(=O)c(=Cc3ccc(OC)c(OC)c3)[nH]c2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D05	compound treatment	1.199	-0.0747	-1.01				-1.0077	-1.0	1120821	CBDivE_010945	Cc1nnc(NS(=O)(=O)c2ccc(Cl)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D06	compound treatment	1.309	0.0353	0.48				0.4763	1.0	1919724	CBDivE_010946	COC(=O)Nc1c(O)cc(Cl)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D07	compound treatment	1.274	3.07E-4	0.0				0.0041	1.0	1480197	CBDivE_010947	OC(=O)CCC(=O)Nc1ccc(cc1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D08	compound treatment	1.237	-0.0367	-0.5				-0.495	-1.0	1919725	CBDivE_010948	CC(C)(C)S(=O)(=O)c1ccsc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D09	compound treatment	1.216	-0.0577	-0.78				-0.7783	-1.0	1571929	CBDivE_010949	C(N1CCN(CC1)c2ccccn2)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D10	compound treatment	1.235	-0.0387	-0.52				-0.522	-1.0	1919726	CBDivE_010950	COC(=O)CCS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D11	compound treatment	1.242	-0.0317	-0.43				-0.4276	-1.0	1730341	CBDivE_010951	COc1cc2oc(C(=O)N3CCN(Cc4ccccc4)CC3)c(C)c2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D12	compound treatment	1.306	0.0323	0.44				0.4358	1.0	1919727	CBDivE_010952	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)c4cnc(nc4)c5ccc(cc5)N6C(=O)c7ccc(cc7C6=O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D13	compound treatment	1.342	0.0683	0.92				0.9215	1.0	1280864	CBDivE_010953	CC(C)c1ccc(cc1)C2NCCc3[nH]cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D14	compound treatment	1.269	-0.00469	-0.06				-0.0633	-1.0	1919728	CBDivE_010954	Cc1ccn(n1)S(=O)(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D15	compound treatment	1.251	-0.0227	-0.31				-0.3061	-1.0	1919729	CBDivE_010955	Cc1ccc2nc([nH]c2c1)C(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D16	compound treatment	1.244	-0.0297	-0.4				-0.4006	-1.0	1919730	CBDivE_010956	COC(=O)C1C(=O)/C(=C/Nc2ccccc2)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D17	compound treatment	1.22	-0.0537	-0.72				-0.7244	-1.0	1919731	CBDivE_010957	COC(=O)c1cccc(OC(NC(=O)c2ccc(C)cc2)C(Br)(Br)Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D18	compound treatment	1.249	-0.0247	-0.33				-0.3331	-1.0	1919732	CBDivE_010958	COc1ccc2n(c(C)c(C(=O)C)c2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D19	compound treatment	1.316	0.0423	0.57				0.5708	1.0	1780750	CBDivE_010959	[O-][N+](=O)c1cccc(C=c2[nH]c(=O)c(=Cc3cccc(c3)[N+](=O)[O-])[nH]c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	D20	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1919733	CBDivE_010960	CN(C)c1ccc(/C=N/NC(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E01	compound treatment	1.335	0.0613	0.83				0.8271	1.0	1678759	CBDivE_010961	COc1ccc2c(C)c(oc2c1)C(=O)OCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E02	compound treatment	1.272	-0.00169	-0.02				-0.0228	-1.0	1250822	CBDivE_010962	Nc1ccc(c2nc3ccccc3o2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E03	compound treatment	1.256	-0.0177	-0.24				-0.2387	-1.0	1919734	CBDivE_010963	CC(N/C=C\C(=O)c1ccc(Br)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E04	compound treatment	1.281	0.00731	0.1				0.0986	1.0	1919735	CBDivE_010964	ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)Oc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E05	compound treatment	1.305	0.0313	0.42				0.4224	1.0	1919736	CBDivE_010965	CCN1/C(=C/C(=O)C)/Sc2ccc3ccccc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E06	compound treatment	1.214	-0.0597	-0.81				-0.8053	-1.0	1919737	CBDivE_010966	CCOc1cc(Br)cc(/C=N/c2nc3ccc(OC)cc3s2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E07	compound treatment	1.379	0.105	1.42				1.4207	1.0	1919738	CBDivE_010967	CCOc1c(OCC)c2oc(C(=O)O)c(C)c2cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E08	compound treatment	1.287	0.0133	0.18				0.1795	1.0	1195154	CBDivE_010968	CC(C)(C)C(=O)Nc1cccc(NC(=O)C(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E09	compound treatment	1.44	0.166	2.24				2.2436	1.0	1919739	CBDivE_010969	O=C(CCSCCC(=O)NCCc1ccccc1)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E10	compound treatment	1.291	0.0173	0.23				0.2335	1.0	1919740	CBDivE_010970	COc1ccc(/C=N/CCNC(=O)c2c(O)c3ccccc3oc2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E11	compound treatment	1.373	0.0993	1.34				1.3397	1.0	1919741	CBDivE_010971	C/C(=N\NC(=O)COc1cccc(C)c1C)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E12	compound treatment	1.279	0.00531	0.07				0.0716	1.0	1180930	CBDivE_010972	Cc1nc(cs1)C2CC(=O)OC32CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E13	compound treatment	1.311	0.0373	0.5				0.5033	1.0	1919742	CBDivE_010973	COc1ccc(OCC(=O)N/N=C/2\C(=O)Nc3ccc(cc23)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E14	compound treatment	1.278	0.00431	0.06				0.0581	1.0	1393908	CBDivE_010974	CCOC(=O)c1c(NC(=O)COC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E15	compound treatment	1.359	0.0853	1.15				1.1508	1.0	1919743	CBDivE_010975	C/C(=N\NC(=O)C1COc2ccccc2O1)/c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E16	compound treatment	1.273	-6.93E-4	-0.01				-0.0093	-1.0	1919744	CBDivE_010976	CCOC(=O)c1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(cc2)C(=O)OCC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E17	compound treatment	1.382	0.108	1.46				1.4611	1.0	1919745	CBDivE_010977	CCCCC1(CC)Cc2ccccc2-c3nc([nH]c(=S)c31)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E18	compound treatment	1.314	0.0403	0.54				0.5438	1.0	1919746	CBDivE_010978	COc1cc2ccccc2cc1C(=O)NN=C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E19	compound treatment	1.383	0.109	1.47				1.4746	1.0	1919747	CBDivE_010979	CC(=O)CS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	E20	compound treatment	1.325	0.0513	0.69				0.6922	1.0	1578667	CBDivE_010980	O=C(Nc1cccc(C#C)c1)c2ccc3C(=O)N(C(=O)c3c2)c4cccc(c4)C(=O)Nc5cccc(C#C)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F01	compound treatment	1.217	-0.0567	-0.76				-0.7648	-1.0	1919748	CBDivE_010981	COc1ccccc1Cc2nn[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F02	compound treatment	1.222	-0.0517	-0.7				-0.6974	-1.0	1919749	CBDivE_010982	O=C1C(C(=O)c2ccccc12)C3=NNC(C3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F03	compound treatment	1.187	-0.0867	-1.17				-1.1695	-1.0	1541496	CBDivE_010983	Sc1nnc(o1)C2OCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F04	compound treatment	1.246	-0.0277	-0.37				-0.3736	-1.0	1919750	CBDivE_010984	CC1=CCC(Cc2nc3ccccc3o2)C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F05	compound treatment	1.294	0.0203	0.27				0.274	1.0	1919751	CBDivE_010985	Oc1ccc(Cl)cc1c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F06	compound treatment	1.221	-0.0527	-0.71				-0.7109	-1.0	1693113	CBDivE_010986	Fc1ccc2C(=O)N(C(=O)c2c1)c3cc(Cl)nc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F07	compound treatment	1.277	0.00331	0.04				0.0446	1.0	1472605	CBDivE_010987	CCOC(=O)c1c(NC(=O)c2ccccc2)sc(NC(=O)c3ccccc3)c1C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F08	compound treatment	1.295	0.0213	0.29				0.2874	1.0	1603312	CBDivE_010988	CCC1(O)CC(C)S(=O)(=O)C2CCCCC21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F09	compound treatment	1.194	-0.0797	-1.08				-1.0751	-1.0	1919752	CBDivE_010989	Clc1ccc(Cl)c(c1)S(=O)(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F10	compound treatment	1.238	-0.0357	-0.48				-0.4815	-1.0	1919753	CBDivE_010990	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F11	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1624041	CBDivE_010991	Cn1cc(Br)c(n1)C(=O)NCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F12	compound treatment	1.152	-0.122	-1.64				-1.6417	-1.0	1919754	CBDivE_010992	CNS(=O)(=O)c1ccc(N2CCCC2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F13	compound treatment	1.232	-0.0417	-0.56				-0.5625	-1.0	1919755	CBDivE_010993	CCCCCNc1nc(OCC(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F14	compound treatment	1.23	-0.0437	-0.59				-0.5894	-1.0	1919756	CBDivE_010994	Brc1ccc2n(C(=O)Nc3ccccc3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F15	compound treatment	1.279	0.00531	0.07				0.0716	1.0	1369650	CBDivE_010995	CN(C)Cc1cc(CN(C)C)c(O)c(CCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F16	compound treatment	1.236	-0.0377	-0.51				-0.5085	-1.0	1919757	CBDivE_010996	OC(=O)/C=C/C(=O)Nc1ccc(\C=C\C(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F17	compound treatment	1.213	-0.0607	-0.82				-0.8188	-1.0	1919758	CBDivE_010997	[O-][N+](=O)c1cccc(Oc2ccc3C(=O)N(C(=O)c3c2)c4c[nH]c(=O)[nH]c4=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F18	compound treatment	1.26	-0.0137	-0.18				-0.1847	-1.0	1919759	CBDivE_010998	CCCC(=O)C1=C(CC(C)(C)C(C(=O)OC)C1=O)Nc2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F19	compound treatment	1.197	-0.0767	-1.03				-1.0346	-1.0	1919760	CBDivE_010999	CC1CC/C(=C/NCCCCN\C=C/2\CCC(C)CC2=O)/C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	F20	compound treatment	1.207	-0.0667	-0.9				-0.8997	-1.0	1776979	CBDivE_011000	Cc1c(cc([N+](=O)[O-])c(C)c1N2CCCC2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G01	compound treatment	1.3	0.0263	0.35				0.3549	1.0	1919761	CBDivE_011001	COc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c(c2)[N+](=O)[O-])cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G02	compound treatment	1.232	-0.0417	-0.56				-0.5625	-1.0	1656762	CBDivE_011002	Cc1ccccc1Nc2nc(Cl)nc(n2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G03	compound treatment	1.27	-0.00369	-0.05				-0.0498	-1.0	1919762	CBDivE_011003	Brc1cncc(c1)C(=O)N/N=C/c2ccc(I)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G04	compound treatment	1.298	0.0243	0.33				0.3279	1.0	1919763	CBDivE_011004	COc1ccc2cc(/C=N/NC(=O)Cc3c[nH]c4ccccc34)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G05	compound treatment	1.267	-0.00669	-0.09				-0.0903	-1.0	1919764	CBDivE_011005	CC(C)(C)C(=O)NC(NC(=S)Nc1ccc(O)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G06	compound treatment	1.287	0.0133	0.18				0.1795	1.0	1777303	CBDivE_011006	Cc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])c(C)c(c3)[N+](=O)[O-])sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G07	compound treatment	1.319	0.0453	0.61				0.6112	1.0	1919765	CBDivE_011007	COc1ccc(OCC(=O)N/N=C/2\C(=O)Nc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G08	compound treatment	1.284	0.0103	0.14				0.1391	1.0	1919766	CBDivE_011008	CCOc1ccc(NC(=S)NC(NC(=O)c2ccc(C)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G09	compound treatment	1.322	0.0483	0.65				0.6517	1.0	1919767	CBDivE_011009	[O-][N+](=O)c1ccc(/C=N/NC(=O)COc2ccc(Br)c3ccccc23)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G10	compound treatment	1.268	-0.00569	-0.08				-0.0768	-1.0	1777693	CBDivE_011010	COc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])c(C)c(c3)[N+](=O)[O-])sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G11	compound treatment	1.386	0.112	1.52				1.5151	1.0	1919768	CBDivE_011011	Nc1ccc(cc1)S(=O)(=O)c2ccc(cc2)n3c(=O)c4cc5c(=O)n(c6ccc(cc6)S(=O)(=O)c7ccc(N)cc7)c(=O)c5cc4c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G12	compound treatment	1.222	-0.0517	-0.7				-0.6974	-1.0	1919769	CBDivE_011012	Cc1cccc(c1)C(=O)NC(NC(=S)Nc2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G13	compound treatment	1.317	0.0433	0.58				0.5842	1.0	1919770	CBDivE_011013	N/C(=N/O)/c1cc2ccccc2o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G14	compound treatment	1.27	-0.00369	-0.05				-0.0498	-1.0	1919771	CBDivE_011014	Oc1ccc(/C=N/OC(=O)c2cccc(c2)[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G15	compound treatment	1.338	0.0643	0.87				0.8675	1.0	1919772	CBDivE_011015	O=C(N/N=C/C=C/c1ccccc1)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G16	compound treatment	1.269	-0.00469	-0.06				-0.0633	-1.0	1919773	CBDivE_011016	Cc1c([N+](=O)[O-])c(NC(=O)c2cc3ccccc3oc2=O)nn1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G17	compound treatment	1.333	0.0593	0.8				0.8001	1.0	1919774	CBDivE_011017	COc1ccccc1C2=NC(=O)CS2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G18	compound treatment	1.271	-0.00269	-0.04				-0.0363	-1.0	1919775	CBDivE_011018	Cc1ccccc1C2N(c3ccccc3)C4(C(c5ccccc5C)C26C(=O)c7ccccc7C6=O)C(=O)c8ccccc8C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G19	compound treatment	1.394	0.12	1.62				1.623	1.0	1919776	CBDivE_011019	Oc1ccc(C(=O)OCCCN2CCOCC2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	G20	compound treatment	1.279	0.00531	0.07				0.0716	1.0	1919777	CBDivE_011020	Cl/C(=C(\NC(=O)c1ccccc1)/C(=O)NC2CCS(=O)(=O)C2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H01	compound treatment	1.209	-0.0647	-0.87				-0.8727	-1.0	1919778	CBDivE_011021	COc1ccc(/C=N/NC(=O)Cc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H02	compound treatment	1.25	-0.0237	-0.32				-0.3196	-1.0	1258248	CBDivE_011022	CC(C)(C)C1CCC(CC1)C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H03	compound treatment	1.276	0.00231	0.03				0.0311	1.0	1424822	CBDivE_011023	CC(C)(C)C(=O)Nc1cc(cc(c1)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H04	compound treatment	1.29	0.0163	0.22				0.22	1.0	1348318	CBDivE_011024	Clc1ccc(C=c2[nH]c(=O)c(=Cc3ccc(Cl)cc3Cl)[nH]c2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H05	compound treatment	1.19	-0.0837	-1.13				-1.1291	-1.0	1919779	CBDivE_011025	COc1ccc(/C=N\NC(=O)c2[nH]ncc2I)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H06	compound treatment	1.253	-0.0207	-0.28				-0.2792	-1.0	1195633	CBDivE_011026	COc1ccc(Cc2c(O)[nH]c(SCC(=O)N3CCCCC3)nc2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H07	compound treatment	1.22	-0.0537	-0.72				-0.7244	-1.0	1919780	CBDivE_011027	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2ccc(/C=C/C(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H08	compound treatment	1.284	0.0103	0.14				0.1391	1.0	1144252	CBDivE_011028	Cc1cc(O)c(C2=NCCSC(C2)c3ccccn3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H09	compound treatment	1.206	-0.0677	-0.91				-0.9132	-1.0	1917003	CBDivE_011029	Cc1ccc(O)c(CCc2ccc(O)c(c2)S(=O)(=O)O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H10	compound treatment	1.281	0.00731	0.1				0.0986	1.0	1919781	CBDivE_011030	O=C1N(C(=S)N(C(=O)C1=Cc2c[nH]c3ccccc23)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H11	compound treatment	1.371	0.0973	1.31				1.3127	1.0	1919782	CBDivE_011031	CN(C)c1cc(NC(=O)CN2CCOCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H12	compound treatment	1.291	0.0173	0.23				0.2335	1.0	1919783	CBDivE_011032	O=C(N/N=C/c1ccncc1)C2C[C@@H]2C(=O)N/N=C/c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H13	compound treatment	1.309	0.0353	0.48				0.4763	1.0	1451623	CBDivE_011033	NC(=O)c1c(NC(=O)Cc2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H14	compound treatment	1.264	-0.00969	-0.13				-0.1308	-1.0	1004598	CBDivE_011034	OC(=O)c1ccc(cc1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H15	compound treatment	1.239	-0.0347	-0.47				-0.468	-1.0	1919784	CBDivE_011035	CC(C)c1nnc(NC(=O)CSC(=O)c2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H16	compound treatment	1.189	-0.0847	-1.14				-1.1426	-1.0	1403531	CBDivE_011036	CCS(=O)(=O)C(=C(Nc1ccc(OC)cc1)Nc2ccc(OC)cc2)S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H17	compound treatment	1.233	-0.0407	-0.55				-0.549	-1.0	1919785	CBDivE_011037	CCCOC(=S)NC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H18	compound treatment	1.319	0.0453	0.61				0.6112	1.0	1178111	CBDivE_011038	Clc1ccc2n(C(=O)c3cccnc3)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H19	compound treatment	1.265	-0.00869	-0.12				-0.1173	-1.0	1127735	CBDivE_011039	COc1cc2oc(C(=O)OCCN(C)C)c(C)c2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	H20	compound treatment	1.236	-0.0377	-0.51				-0.5085	-1.0	1919786	CBDivE_011040	Fc1ccc(/C=N/Nc2nc(OCC(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I01	compound treatment	1.278	0.00431	0.06				0.0581	1.0	1919787	CBDivE_011041	COc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c(I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I02	compound treatment	1.267	-0.00669	-0.09				-0.0903	-1.0	1919788	CBDivE_011042	Cc1nc(nc(Nc2ccc(cc2)[N+](=O)[O-])c1CC=C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I03	compound treatment	1.31	0.0363	0.49				0.4898	1.0	1552157	CBDivE_011043	CC(C)(C)Nc1nc(nc(n1)N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I04	compound treatment	1.221	-0.0527	-0.71				-0.7109	-1.0	1919789	CBDivE_011044	COc1cc(c2NC(C)(C)C=C(C)c2c1)C(c3ccccc3)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I05	compound treatment	1.286	0.0123	0.17				0.166	1.0	1919790	CBDivE_011045	Nc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I06	compound treatment	1.252	-0.0217	-0.29				-0.2926	-1.0	1919791	CBDivE_011046	COc1ccccc1C(=O)NC(Sc2ccc(Cl)cc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I07	compound treatment	1.315	0.0413	0.56				0.5573	1.0	1188297	CBDivE_011047	CCc1nc(C)ccc1OC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I08	compound treatment	1.301	0.0273	0.37				0.3684	1.0	1565704	CBDivE_011048	Ic1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I09	compound treatment	1.283	0.00931	0.13				0.1256	1.0	1236044	CBDivE_011049	O=C(N1CCN(Cc2ccccc2)CC1)c3cn(nc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I10	compound treatment	1.296	0.0223	0.3				0.3009	1.0	1919792	CBDivE_011050	[O-][N+](=O)c1cccc(c1)C2C3(OC(c4ccccc4)C25C(=O)c6ccccc6C5=O)C(=O)c7ccccc7C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I11	compound treatment	1.433	0.159	2.15				2.1492	1.0	1919793	CBDivE_011051	CN(C)C(c1nnnn1c2c(C)cccc2C)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I12	compound treatment	1.243	-0.0307	-0.41				-0.4141	-1.0	1919794	CBDivE_011052	COc1ccc(cc1)C(CC(=O)Nc2ccc(Cl)cc2)NC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I13	compound treatment	1.286	0.0123	0.17				0.166	1.0	1633374	CBDivE_011053	C1CC=C(C1)c2ccc3n4CCNC5CCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I14	compound treatment	1.335	0.0613	0.83				0.8271	1.0	1919795	CBDivE_011054	[O-][N+](=O)c1ccc(cc1)C(C2C(=O)c3ccccc3C2=O)C4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I15	compound treatment	1.329	0.0553	0.75				0.7461	1.0	1919796	CBDivE_011055	C/C(=N\NC(=O)c1ccccc1O)/Cn2nnc(n2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I16	compound treatment	1.302	0.0283	0.38				0.3819	1.0	1919797	CBDivE_011056	Cc1c(oc2ccccc12)C(=O)NCCN3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I17	compound treatment	1.316	0.0423	0.57				0.5708	1.0	1919798	CBDivE_011057	Oc1ccc(cc1/C=N/c2cccc3ccccc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I18	compound treatment	1.276	0.00231	0.03				0.0311	1.0	1427482	CBDivE_011058	Cc1c(oc2c3OCCOc3ccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I19	compound treatment	1.375	0.101	1.37				1.3667	1.0	1919799	CBDivE_011059	CCOc1c(OCC)c2oc(C(=O)N3CCOCC3)c(C)c2cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	I20	compound treatment	1.288	0.0143	0.19				0.193	1.0	1919800	CBDivE_011060	COc1ccc2c(C)c(oc2c1OC)C(=O)N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J01	compound treatment	1.224	-0.0497	-0.67				-0.6704	-1.0	1919801	CBDivE_011061	COc1ccc(Br)cc1/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J02	compound treatment	1.229	-0.0447	-0.6				-0.6029	-1.0	1919802	CBDivE_011062	Nc1cc(/C=C/C(=O)O)ccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J03	compound treatment	1.169	-0.105	-1.41				-1.4124	-1.0	1919803	CBDivE_011063	Oc1ccccc1/C=N/NC(=O)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J04	compound treatment	1.224	-0.0497	-0.67				-0.6704	-1.0	3107160	CBDivE_011064	CN1CCCN=C1/C=C/c2ccc(Cl)s2.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J05	compound treatment	1.215	-0.0587	-0.79				-0.7918	-1.0	1919805	CBDivE_011065	Cc1ccccc1NC(=S)NC(NC(=O)c2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J06	compound treatment	1.253	-0.0207	-0.28				-0.2792	-1.0	1299597	CBDivE_011066	O=S(=O)(Nc1ncccn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J07	compound treatment	1.266	-0.00769	-0.1				-0.1038	-1.0	1919806	CBDivE_011067	Clc1ccc(NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J08	compound treatment	1.29	0.0163	0.22				0.22	1.0	1184652	CBDivE_011068	Cc1ccc(cc1C)S(=O)(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J09	compound treatment	1.219	-0.0547	-0.74				-0.7378	-1.0	1919807	CBDivE_011069	[O-][N+](=O)c1ccc(cc1)n2cccc2/C=N/C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J10	compound treatment	1.241	-0.0327	-0.44				-0.441	-1.0	1494430	CBDivE_011070	COc1ccc(CCNC(=O)N2C(=O)CCC2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J11	compound treatment	1.268	-0.00569	-0.08				-0.0768	-1.0	1919808	CBDivE_011071	Oc1c(C(=O)NCCCCCCNC(=O)c2ccccc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J12	compound treatment	1.239	-0.0347	-0.47				-0.468	-1.0	1919809	CBDivE_011072	CN(C)c1ccc(cc1)/C(=N/NC(=O)c2ccncc2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J13	compound treatment	1.294	0.0203	0.27				0.274	1.0	1919810	CBDivE_011073	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J14	compound treatment	1.282	0.00831	0.11				0.1121	1.0	1914449	CBDivE_011074	NCCc1n[nH]c(n1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J15	compound treatment	1.228	-0.0457	-0.62				-0.6164	-1.0	1919811	CBDivE_011075	COc1c(N)cc2c(C)c(oc2c1OC)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J16	compound treatment	1.198	-0.0757	-1.02				-1.0211	-1.0	1919812	CBDivE_011076	OCCCC(=O)N/N=C/c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J17	compound treatment	1.227	-0.0467	-0.63				-0.6299	-1.0	1620463	CBDivE_011077	COc1cc2oc(C(=O)O)c(C)c2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J18	compound treatment	1.203	-0.0707	-0.95				-0.9537	-1.0	1188297	CBDivE_011078	CCc1nc(C)ccc1OC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J19	compound treatment	1.203	-0.0707	-0.95				-0.9537	-1.0	1919813	CBDivE_011079	C1CC2NCCn3c2c(C1)c4cc(ccc34)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	J20	compound treatment	1.297	0.0233	0.31				0.3144	1.0	778	CBDivE_011080	Oc1c(I)cc(I)c2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K01	compound treatment	1.325	0.0513	0.69				0.6922	1.0	1919814	CBDivE_011081	COc1ccc(cc1)C(=O)NCCCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K02	compound treatment	1.268	-0.00569	-0.08				-0.0768	-1.0	1919815	CBDivE_011082	CCCCCN(CCCCC)C(=O)c1ccccc1C(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K03	compound treatment	1.209	-0.0647	-0.87				-0.8727	-1.0	1159022	CBDivE_011083	CC(C)(C)c1ccc(cc1)c2ncccc2OC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K04	compound treatment	1.258	-0.0157	-0.21				-0.2117	-1.0	1919816	CBDivE_011084	COc1c(Br)cc2c(C)c(oc2c1Br)C(=O)OCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K05	compound treatment	1.378	0.104	1.41				1.4072	1.0	1919817	CBDivE_011085	CCN(CC)CCOC(=O)c1oc2cc(OC)c(Br)cc2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K06	compound treatment	1.262	-0.0117	-0.16				-0.1577	-1.0	1919818	CBDivE_011086	COc1ccc(/C=N\NC(=O)c2[nH]ncc2I)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K07	compound treatment	1.282	0.00831	0.11				0.1121	1.0	1628746	CBDivE_011087	CCOc1ccc2c(C)c(oc2c1OCC)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K08	compound treatment	1.279	0.00531	0.07				0.0716	1.0	1414399	CBDivE_011088	C1CCC(CC1)c2ccc3n4CCNC5CCCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K09	compound treatment	1.289	0.0153	0.21				0.2065	1.0	1578228	CBDivE_011089	COc1ccc2c(C)c(oc2c1OC)C(=O)NCC(C)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K10	compound treatment	1.298	0.0243	0.33				0.3279	1.0	1699880	CBDivE_011090	CC(=O)N1c2ccccc2Oc3cc4ccccc4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K11	compound treatment	1.351	0.0773	1.04				1.0429	1.0	1919819	CBDivE_011091	NS(=O)(=O)c1ccc(Cc2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K12	compound treatment	1.279	0.00531	0.07				0.0716	1.0	1463709	CBDivE_011092	COc1ccc(Nc2nc(Cl)nc(n2)N(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K13	compound treatment	1.336	0.0623	0.84				0.8406	1.0	1165417	CBDivE_011093	CC(C)COc1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K14	compound treatment	1.244	-0.0297	-0.4				-0.4006	-1.0	1919820	CBDivE_011094	CC1(C)C2CCC1(C)C(=O)C2/C=N/c3ccccc3\N=C\C4C(=O)C5CCC4(C)C5(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K15	compound treatment	1.335	0.0613	0.83				0.8271	1.0	1919821	CBDivE_011095	C/C(=N\NC(=S)N)/CCS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K16	compound treatment	1.292	0.0183	0.25				0.247	1.0	1919822	CBDivE_011096	[O-][N+](=O)c1cccc(c1)C(=O)NC(NC(=S)Nc2ccc3ccccc3c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K17	compound treatment	1.351	0.0773	1.04				1.0429	1.0	1290159	CBDivE_011097	C(Oc1ccc2n3CCNC4CCCc(c43)c2c1)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K18	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1919823	CBDivE_011098	CCOC(=O)C1=C(SC2(S1)C(=C(SC3=C2c4cc(C)ccc4NC3(C)C)C(=O)OCC)C(=O)OCC)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K19	compound treatment	1.382	0.108	1.46				1.4611	1.0	1919824	CBDivE_011099	Cc1c(oc2cc(OCc3ccccc3)c(OCc4ccccc4)cc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	K20	compound treatment	1.312	0.0383	0.52				0.5168	1.0	1919825	CBDivE_011100	CNC(=O)C1NCCCc2cc(OC)c(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L01	compound treatment	1.212	-0.0617	-0.83				-0.8323	-1.0	1919826	CBDivE_011101	C/C(=N\NC(=O)c1[nH]ncc1Br)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L02	compound treatment	1.245	-0.0287	-0.39				-0.3871	-1.0	1919827	CBDivE_011102	OC1=NOC(c2ccc(O)cc2)(c3ccc(O)cc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L03	compound treatment	1.284	0.0103	0.14				0.1391	1.0	1919828	CBDivE_011103	CC(NC(=O)C(Cl)(Cl)Cl)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L04	compound treatment	1.222	-0.0517	-0.7				-0.6974	-1.0	1919829	CBDivE_011104	O=C(CCCCc1cccs1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L05	compound treatment	1.138	-0.136	-1.83				-1.8306	-1.0	1919830	CBDivE_011105	Cn1c2ccccc2c3n[nH]c(=S)nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L06	compound treatment	1.258	-0.0157	-0.21				-0.2117	-1.0	1919831	CBDivE_011106	Brc1ccc(cc1)S(=O)(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L07	compound treatment	1.229	-0.0447	-0.6				-0.6029	-1.0	1176851	CBDivE_011107	Fc1ccc(cc1)C(=O)Nc2nc(cs2)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L08	compound treatment	1.216	-0.0577	-0.78				-0.7783	-1.0	1919832	CBDivE_011108	COC(=O)C1C(=O)/C(=C/NCCO)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L09	compound treatment	1.253	-0.0207	-0.28				-0.2792	-1.0	1919833	CBDivE_011109	Cc1cc(NC(=O)C2(CC3CC4CC3C2)C4)c(OC(=O)C5(CC6CC7CC6C5)C7)c(C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L10	compound treatment	1.251	-0.0227	-0.31				-0.3061	-1.0	1699586	CBDivE_011110	Cc1cccc(OC(=O)n2c(=S)oc3cc(Cl)ccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L11	compound treatment	1.243	-0.0307	-0.41				-0.4141	-1.0	1436119	CBDivE_011111	CN(C)c1nc(nc(n1)N2CCOCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L12	compound treatment	1.262	-0.0117	-0.16				-0.1577	-1.0	1374950	CBDivE_011112	OCc1ccc(o1)C2N(CCN2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L13	compound treatment	1.296	0.0223	0.3				0.3009	1.0	1919834	CBDivE_011113	[O-][N+](=O)c1ccc(cc1)c2nn3c(=O)c(Br)cnc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L14	compound treatment	1.273	-6.93E-4	-0.01				-0.0093	-1.0	1377894	CBDivE_011114	O=C(Oc1cccc2cccnc12)c3ccc(cc3)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L15	compound treatment	1.265	-0.00869	-0.12				-0.1173	-1.0	1919835	CBDivE_011115	CCCCCC(=O)N/N=C/c1ccc(OCCCC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L16	compound treatment	1.234	-0.0397	-0.54				-0.5355	-1.0	1919836	CBDivE_011116	CCCC(CCC)C(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L17	compound treatment	1.27	-0.00369	-0.05				-0.0498	-1.0	1368649	CBDivE_011117	O=C(Cn1nc(nc1c2ccccc2)c3ccccc3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L18	compound treatment	1.261	-0.0127	-0.17				-0.1712	-1.0	1411533	CBDivE_011118	Cc1ccc(cc1)N(C(=O)c2ccco2)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L19	compound treatment	1.25	-0.0237	-0.32				-0.3196	-1.0	1919837	CBDivE_011119	COc1c(OC)c2oc(C(=O)N3CCN(C)CC3)c(C)c2cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	L20	compound treatment	1.213	-0.0607	-0.82				-0.8188	-1.0	1173064	CBDivE_011120	CCCNc1c2C(=O)CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M01	compound treatment	1.312	0.0383	0.52				0.5168	1.0	1449214	CBDivE_011121	O=C(Nc1ccccc1)c2cc(cc(c2)C(=O)Nc3ccccc3)N4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M02	compound treatment	1.225	-0.0487	-0.66				-0.6569	-1.0	3019974	CBDivE_011122	Cc1cc(N)c2ccccc2n1.OC(=O)c1cncc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M03	compound treatment	1.289	0.0153	0.21				0.2065	1.0	1919838	CBDivE_011123	C1CCc2c(C1)sc3ncnc(N/N=C/c4ccco4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M04	compound treatment	1.226	-0.0477	-0.64				-0.6434	-1.0	1919839	CBDivE_011124	COC(=O)C1=C(SC2(S1)C(=C(SC3=C2c4ccc(OC)cc4NC3(C)C)C(=O)OC)C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M05	compound treatment	1.374	0.1	1.35				1.3532	1.0	1491382	CBDivE_011125	CC(C)Nc1nc(nc(n1)N2CCOCC2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M06	compound treatment	1.238	-0.0357	-0.48				-0.4815	-1.0	1919840	CBDivE_011126	Cc1ccc(NC(NC(=O)c2ccccc2C)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M07	compound treatment	1.317	0.0433	0.58				0.5842	1.0	1919841	CBDivE_011127	COc1cccc(/C=N/NC(=O)Cc2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M08	compound treatment	1.262	-0.0117	-0.16				-0.1577	-1.0	1919842	CBDivE_011128	CN(CCc1ccccc1)CC2OCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M09	compound treatment	1.311	0.0373	0.5				0.5033	1.0	1241726	CBDivE_011129	NC(=O)CSc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M10	compound treatment	1.272	-0.00169	-0.02				-0.0228	-1.0	1919843	CBDivE_011130	Cc1[nH]c2ccccc2c1/C=N/NC(=O)C3COc4ccccc4O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M11	compound treatment	1.308	0.0343	0.46				0.4628	1.0	1185349	CBDivE_011131	Cc1nnc(NC(=O)c2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M12	compound treatment	1.268	-0.00569	-0.08				-0.0768	-1.0	1919844	CBDivE_011132	Cc1cccc(C)c1OCC(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M13	compound treatment	1.314	0.0403	0.54				0.5438	1.0	1213804	CBDivE_011133	Nc1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M14	compound treatment	1.277	0.00331	0.04				0.0446	1.0	1919845	CBDivE_011134	Cc1ccc(C)c(NC(=S)NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M15	compound treatment	1.342	0.0683	0.92				0.9215	1.0	1919846	CBDivE_011135	COc1ccc(/C=C/C(=O)C2=C(CC(C)(C)CC2=O)NCCO)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M16	compound treatment	1.258	-0.0157	-0.21				-0.2117	-1.0	1313383	CBDivE_011136	COc1ccccc1C(=O)Nc2ccc3oc(nc3c2)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M17	compound treatment	1.389	0.115	1.56				1.5556	1.0	1919847	CBDivE_011137	Cc1cccc(C)c1n2nnnc2C(N3CCOCC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M18	compound treatment	1.281	0.00731	0.1				0.0986	1.0	1323665	CBDivE_011138	Cn1c(=O)c2c([nH]c1=S)-c3ccccc3CC42CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M19	compound treatment	1.383	0.109	1.47				1.4746	1.0	1314553	CBDivE_011139	CC(C)(C)C(=O)Nc1ccc(cc1)c2nc3cc(NC(=O)C(C)(C)C)ccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	M20	compound treatment	1.282	0.00831	0.11				0.1121	1.0	1919848	CBDivE_011140	COc1ccccc1[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N01	compound treatment	1.206	-0.0677	-0.91				-0.9132	-1.0	1919849	CBDivE_011141	COC(=O)C1C(=O)C(C(=O)/C=C/c2ccccc2)C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N02	compound treatment	1.182	-0.0917	-1.24				-1.237	-1.0	1919850	CBDivE_011142	Brc1ccc(cc1)C(=O)CSc2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N03	compound treatment	1.249	-0.0247	-0.33				-0.3331	-1.0	1919851	CBDivE_011143	OS(=O)(=O)c1ccc(N2CCCC2=O)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N04	compound treatment	1.206	-0.0677	-0.91				-0.9132	-1.0	1550246	CBDivE_011144	CCCCc1ccc(cc1)C(=O)Oc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N05	compound treatment	1.296	0.0223	0.3				0.3009	1.0	1919852	CBDivE_011145	O/N=C/c1ccsc1S(=O)(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N06	compound treatment	1.274	3.07E-4	0.0				0.0041	1.0	1681828	CBDivE_011146	CCOc1ccc(cc1)N2CCc3c2nc4ccc(Br)cc4c3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N07	compound treatment	1.185	-0.0887	-1.2				-1.1965	-1.0	1577429	CBDivE_011147	Cc1ccc(OC(=O)C2(CC3CC4CC(C3)C2)C4)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N08	compound treatment	1.208	-0.0657	-0.89				-0.8862	-1.0	1172850	CBDivE_011148	CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N09	compound treatment	1.242	-0.0317	-0.43				-0.4276	-1.0	1919853	CBDivE_011149	OS(=O)(=O)c1ccc(N/N=C/c2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N10	compound treatment	1.255	-0.0187	-0.25				-0.2522	-1.0	1555620	CBDivE_011150	Cc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N11	compound treatment	1.25	-0.0237	-0.32				-0.3196	-1.0	1242713	CBDivE_011151	Fc1ccc(cc1)C(=O)c2ccc(cc2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N12	compound treatment	1.217	-0.0567	-0.76				-0.7648	-1.0	1667625	CBDivE_011152	Cc1cc(C)n(c(=O)n1)S(=O)(=O)c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N13	compound treatment	1.272	-0.00169	-0.02				-0.0228	-1.0	1390143	CBDivE_011153	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccccn4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N14	compound treatment	1.251	-0.0227	-0.31				-0.3061	-1.0	1919854	CBDivE_011154	COc1cccc(c1)C(=O)Nc2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N15	compound treatment	1.24	-0.0337	-0.45				-0.4545	-1.0	1919855	CBDivE_011155	Cc1cc2n(n1)c3cc(C)nn3c4c(C=O)c(C)nn24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N16	compound treatment	1.271	-0.00269	-0.04				-0.0363	-1.0	1471426	CBDivE_011156	Cc1nc2-c3ccccc3CC4(CCCCC4)c2c(=S)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N17	compound treatment	1.187	-0.0867	-1.17				-1.1695	-1.0	1919856	CBDivE_011157	COC(=O)C1C(=O)/C(=C/Nc2ccc(C)cc2)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N18	compound treatment	1.278	0.00431	0.06				0.0581	1.0	1919857	CBDivE_011158	COc1c(Cl)cc(Cl)cc1C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N19	compound treatment	1.224	-0.0497	-0.67				-0.6704	-1.0	1199700	CBDivE_011159	COc1cc(OC)c(cc1OC)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	N20	compound treatment	1.245	-0.0287	-0.39				-0.3871	-1.0	1919858	CBDivE_011160	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O01	compound treatment	1.308	0.0343	0.46				0.4628	1.0	1919859	CBDivE_011161	CCCc1nnc(NC(=O)CSC(=O)c2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O02	compound treatment	1.233	-0.0407	-0.55				-0.549	-1.0	1919860	CBDivE_011162	Cc1cc(C)n(CC(=O)c2ccc(F)c(F)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O03	compound treatment	1.179	-0.0947	-1.28				-1.2775	-1.0	1222139	CBDivE_011163	COc1ccc(Nc2nc(Cl)nc(Nc3ccc(C)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O04	compound treatment	1.316	0.0423	0.57				0.5708	1.0	1154260	CBDivE_011164	O=C1CC(NC(C1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O05	compound treatment	1.314	0.0403	0.54				0.5438	1.0	1919861	CBDivE_011165	COc1ccccc1NC(c2nnnn2c3c(C)cccc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O06	compound treatment	1.236	-0.0377	-0.51				-0.5085	-1.0	1643831	CBDivE_011166	CCOc1nc(Nc2ccccc2)nc(Nc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O07	compound treatment	1.326	0.0523	0.71				0.7057	1.0	1743307	CBDivE_011167	CC(C)(C)c1ccc2Oc3cc4=Nc5cc(ccc5Oc4cc3=Nc2c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O08	compound treatment	1.278	0.00431	0.06				0.0581	1.0	1919862	CBDivE_011168	Cc1ccn(n1)S(=O)(=O)c2ccc(N3CCCC3=O)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O09	compound treatment	1.335	0.0613	0.83				0.8271	1.0	1133466	CBDivE_011169	C1CN(CCO1)c2nc(nc(n2)N3CCOCC3)N(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O10	compound treatment	1.209	-0.0647	-0.87				-0.8727	-1.0	1919863	CBDivE_011170	COc1cccc(c1)[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O11	compound treatment	1.35	0.0763	1.03				1.0294	1.0	1309954	CBDivE_011171	O=c1c2ccccc2nc3c4c5CCCCc5sc4ncn13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O12	compound treatment	1.306	0.0323	0.44				0.4358	1.0	1586093	CBDivE_011172	OC1(N(C(=O)Nc2ccccc21)c3ccccc3)C(=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O13	compound treatment	1.295	0.0213	0.29				0.2874	1.0	1919864	CBDivE_011173	Oc1ccc(cc1/C=N/c2ccc(\C=C\c3ccccc3)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O14	compound treatment	1.255	-0.0187	-0.25				-0.2522	-1.0	1919865	CBDivE_011174	CC1(C)CC(=O)c2c(/C=C/c3ccccc3)n[nH]c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O15	compound treatment	1.338	0.0643	0.87				0.8675	1.0	1777887	CBDivE_011175	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc3c(c2)-c4cc(NC(=O)c5ccccc5[N+](=O)[O-])ccc4S3(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O16	compound treatment	1.305	0.0313	0.42				0.4224	1.0	1919866	CBDivE_011176	[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O17	compound treatment	1.341	0.0673	0.91				0.908	1.0	1919867	CBDivE_011177	[O-][N+](=O)c1cccc(/C=N/c2ccc3oc(nc3c2)c4cccc5ccccc45)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O18	compound treatment	1.248	-0.0257	-0.35				-0.3466	-1.0	1241077	CBDivE_011178	O=S(=O)(CCc1nc2ccccc2[nH]1)CCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O19	compound treatment	1.396	0.122	1.65				1.65	1.0	1777288	CBDivE_011179	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(cc2)c3nc4cc(Cl)ccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	O20	compound treatment	1.206	-0.0677	-0.91				-0.9132	-1.0	1710412	CBDivE_011180	O=C(Nc1cccc2ccccc12)N3CCC=CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P01	compound treatment	1.251	-0.0227	-0.31				-0.3061	-1.0	1919868	CBDivE_011181	Cc1ccc(cc1C)S(=O)(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P02	compound treatment	1.246	-0.0277	-0.37				-0.3736	-1.0	1919869	CBDivE_011182	Oc1ccc2ccccc2c1/C=N/NC(=O)COc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P03	compound treatment	1.282	0.00831	0.11				0.1121	1.0	1919870	CBDivE_011183	CNC(=O)NC1CCCCc2sccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P04	compound treatment	1.208	-0.0657	-0.89				-0.8862	-1.0	1565020	CBDivE_011184	Nc1cc(ccc1C(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P05	compound treatment	1.218	-0.0557	-0.75				-0.7513	-1.0	1289631	CBDivE_011185	Clc1ccc(NC(=O)n2c(=O)oc3cc(Br)ccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P06	compound treatment	1.207	-0.0667	-0.9				-0.8997	-1.0	1919871	CBDivE_011186	CCS(=O)(=O)C(=C1Nc2ccccc2N1)S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P07	compound treatment	1.227	-0.0467	-0.63				-0.6299	-1.0	1360029	CBDivE_011187	CCCC(=O)C1=C(CC(C)(C)CC1=O)Nc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P08	compound treatment	1.241	-0.0327	-0.44				-0.441	-1.0	1919872	CBDivE_011188	CCOC(=O)CNNC(=O)Nc1ccccc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P09	compound treatment	1.175	-0.0987	-1.33				-1.3314	-1.0	1919873	CBDivE_011189	Clc1ccccc1OS(=O)(=O)c2ccc(Cc3ccc(cc3)S(=O)(=O)Oc4ccccc4Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P10	compound treatment	0.749	-0.525	-7.08				-7.0784	-1.0	1919874	CBDivE_011190	O=C(Nc1ccc(N=Nc2ccccc2)cc1)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P11	compound treatment	1.246	-0.0277	-0.37				-0.3736	-1.0	1919875	CBDivE_011191	COc1cccc(c1)/C(=N/NC(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P12	compound treatment	1.192	-0.0817	-1.1				-1.1021	-1.0	1385647	CBDivE_011192	O=C(Cc1ccccc1)Nc2ccc(NC(=O)c3ccc(NC(=O)Cc4ccccc4)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P13	compound treatment	1.254	-0.0197	-0.27				-0.2657	-1.0	3020051	CBDivE_011193	CCC(C)(C1CNc2ccccc12)c3ccccc3.CC1(C)C2CCC1(CS(=O)(=O)O)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P14	compound treatment	1.213	-0.0607	-0.82				-0.8188	-1.0	1919876	CBDivE_011194	C1C2COC(OC2c3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P15	compound treatment	1.306	0.0323	0.44				0.4358	1.0	1701394	CBDivE_011195	COc1ccccc1C=c2[nH]c(=O)c(=Cc3ccccc3OC)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P16	compound treatment	1.244	-0.0297	-0.4				-0.4006	-1.0	1919877	CBDivE_011196	CCCCN(CCC(=O)N)S(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P17	compound treatment	1.201	-0.0727	-0.98				-0.9807	-1.0	1134473	CBDivE_011197	C1CCN(CC1)c2nc(nc(n2)N3CCOCC3)N(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P18	compound treatment	1.16	-0.114	-1.53				-1.5338	-1.0	1919878	CBDivE_011198	Cc1ccc(cc1)C(=O)CSc2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P19	compound treatment	1.271	-0.00269	-0.04				-0.0363	-1.0	1919879	CBDivE_011199	OC(=O)CCS(=O)(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.35	P20	compound treatment	1.249	-0.0247	-0.33				-0.3331	-1.0	1919880	CBDivE_011200	[O-][N+](=O)c1ccc(cc1)C(=O)CSc2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A01	compound treatment	1.316	0.032	0.43	1.445	-0.0143	-0.19	0.1672	0.3533	1919881	CBDivE_011201	CN(C)c1ccc(/C=C\2/C(=O)NC(=O)N(C2=O)c3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A02	compound treatment	1.364	0.08	1.08	1.446	-0.0133	-0.18	0.6347	0.5802	1306569	CBDivE_011202	COC(=O)CCNC(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A03	compound treatment	1.32	0.036	0.49	1.476	0.0167	0.23	0.5042	0.9407	1919882	CBDivE_011203	CN1C(=O)N(C(=O)/C(=C/c2ccc3OCOc3c2)/C1=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A04	compound treatment	1.323	0.039	0.53	1.418	-0.0413	-0.56	-0.0264	-0.0343	1919883	CBDivE_011204	Brc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A05	compound treatment	1.361	0.077	1.04	1.509	0.0497	0.68	1.2135	0.9787	1919884	CBDivE_011205	Clc1ccc(cc1)C(=O)CSc2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A06	compound treatment	1.292	0.00796	0.11	1.391	-0.0683	-0.93	-0.5825	-0.6214	1192620	CBDivE_011206	Clc1ccc(OCC(=O)N2CC(CC2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A07	compound treatment	1.402	0.118	1.59	1.523	0.0637	0.87	1.7396	0.9595	1730508	CBDivE_011207	COc1ccc(CCC2=NCCn3cccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A08	compound treatment	1.366	0.082	1.11	1.558	0.0987	1.35	1.7337	0.9952	1919885	CBDivE_011208	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(c4)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A09	compound treatment	1.364	0.08	1.08	1.43	-0.0293	-0.4	0.4804	0.4176	1919886	CBDivE_011209	O=C(NCCCCCCNC(=O)OCCc1ccccc1)OCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A10	compound treatment	1.334	0.05	0.67	1.428	-0.0313	-0.43	0.1749	0.2193	1919887	CBDivE_011210	OS(=O)(=O)c1ccc(N/N=C\2/C(=O)NC(=S)N(CC=C)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A11	compound treatment	1.333	0.049	0.66	1.541	0.0817	1.11	1.255	0.9688	1919888	CBDivE_011211	C/C(=N\NC(=O)c1ccn[nH]1)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A12	compound treatment	1.312	0.028	0.38	1.487	0.0277	0.38	0.534	1.0	1919889	CBDivE_011212	CN1C(=O)C(=C/C=C/c2ccccc2)C(=O)N(C)C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A13	compound treatment	1.373	0.089	1.2	1.502	0.0427	0.58	1.2605	0.9449	1919890	CBDivE_011213	Cc1cc(C)c(NC(=O)C2CCCCN2C3CCCCC3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A14	compound treatment	1.293	0.00896	0.12	1.495	0.0357	0.49	0.4299	0.8566	1919891	CBDivE_011214	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc(NC(=O)c3ccccc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A15	compound treatment	1.29	0.00596	0.08	1.505	0.0457	0.62	0.4977	0.7918	1164455	CBDivE_011215	O=C(N1CCOCC1)c2cn(nc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A16	compound treatment	1.266	-0.018	-0.24	1.463	0.00371	0.05	-0.1362	-0.5482	1919892	CBDivE_011216	CCS(=O)(=O)C(=C(Nc1cccc2ccccc12)Nc3cccc4ccccc34)S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A17	compound treatment	1.45	0.166	2.24	1.51	0.0507	0.69	2.0722	0.8843	1919893	CBDivE_011217	C/C(=N\NC(=O)Cc1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A18	compound treatment	1.333	0.049	0.66	1.408	-0.0513	-0.7	-0.0274	-0.0285	1919894	CBDivE_011218	CCS(=O)(=O)C(=C(Nc1ccccc1)Nc2ccccc2)S(=O)(=O)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A19	compound treatment	1.342	0.058	0.78	1.531	0.0717	0.98	1.2444	0.9939	1616969	CBDivE_011219	O=C(NC1CCCCC1)c2cccc(c2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	A20	compound treatment	1.251	-0.033	-0.45	1.414	-0.0453	-0.62	-0.7518	-0.9872	1776604	CBDivE_011220	[O-][N+](=O)c1ccc(Sc2ccc(cc2)N3C(=O)CCC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B01	compound treatment	1.323	0.039	0.53	1.402	-0.0573	-0.78	-0.1807	-0.1919	1616120	CBDivE_011221	Cc1ccc2sc(NC(=O)CCC(=O)O)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B02	compound treatment	1.342	0.058	0.78	1.471	0.0117	0.16	0.6659	0.8343	1234218	CBDivE_011222	COc1nc(Nc2ccccc2)nc(Nc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B03	compound treatment	1.301	0.017	0.23	1.419	-0.0403	-0.55	-0.2266	-0.3808	1663584	CBDivE_011223	CC(C)c1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B04	compound treatment	1.295	0.011	0.15	1.466	0.00671	0.09	0.1693	0.9734	1587331	CBDivE_011224	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2c(Cl)cc(Cl)c3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B05	compound treatment	1.279	-0.00504	-0.07	1.452	-0.00729	-0.1	-0.1183	-0.9829	1548721	CBDivE_011225	Brc1ccccc1C(=O)Oc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B06	compound treatment	1.244	-0.04	-0.54	1.417	-0.0423	-0.58	-0.7897	-0.9995	1444346	CBDivE_011226	Cc1ccc(cc1)S(=O)(=O)Nc2cccc3ncccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B07	compound treatment	1.333	0.049	0.66	1.449	-0.0103	-0.14	0.3679	0.5448	1666200	CBDivE_011227	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B08	compound treatment	1.389	0.105	1.42	1.401	-0.0583	-0.79	0.4393	0.2705	1426493	CBDivE_011228	CC(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B09	compound treatment	1.231	-0.053	-0.72	1.439	-0.0203	-0.28	-0.7015	-0.9145	1346307	CBDivE_011229	CCN(CC)S(=O)(=O)c1ccc(cc1)c2csc(Nc3ccc(C)c(C)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B10	compound treatment	1.37	0.086	1.16	1.451	-0.00829	-0.11	0.7401	0.6352	1596219	CBDivE_011230	Cc1cc(C)c(NC(=O)c2cccc3ccccc23)c(C)c1NC(=O)c4cccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B11	compound treatment	1.271	-0.013	-0.18	1.409	-0.0503	-0.69	-0.6092	-0.8606	1919895	CBDivE_011231	COc1ccc(cc1)S(=O)(=O)N/N=C(\C)/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B12	compound treatment	1.274	-0.01	-0.14	1.437	-0.0223	-0.3	-0.3106	-0.9337	1504041	CBDivE_011232	COC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC)ccc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B13	compound treatment	1.327	0.043	0.58	1.389	-0.0703	-0.96	-0.2679	-0.2392	1156290	CBDivE_011233	OCCN1C(=O)c2ccc(cc2C1=O)C(=O)c3ccc(cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B14	compound treatment	1.245	-0.039	-0.53	1.464	0.00471	0.06	-0.3269	-0.6162	1919896	CBDivE_011234	CCOc1ccc(NC(c2nnnn2c3c(C)cccc3C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B15	compound treatment	1.318	0.034	0.46	1.427	-0.0323	-0.44	0.0127	0.0199	1919897	CBDivE_011235	Nn1c(CCOC(=O)c2ccccc2)nnc1CCOC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B16	compound treatment	1.271	-0.013	-0.18	1.446	-0.0133	-0.18	-0.2525	-0.9999	1919898	CBDivE_011236	O=C(NNC(=O)c1cccc2ccccc12)c3ccc(NC(=O)c4cccc5ccccc45)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B17	compound treatment	1.289	0.00496	0.07	1.443	-0.0163	-0.22	-0.1097	-0.4729	1776833	CBDivE_011237	Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B18	compound treatment	1.27	-0.014	-0.19	1.473	0.0137	0.19	-0.0017	-0.0063	1626507	CBDivE_011238	CCc1nc2ccccc2c(NC(=O)Cc3ccccc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B19	compound treatment	1.278	-0.00604	-0.08	1.39	-0.0693	-0.94	-0.7257	-0.7652	1919899	CBDivE_011239	[O-][N+](=O)c1ccccc1C=C2C(=O)NC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	B20	compound treatment	1.237	-0.047	-0.63	1.472	0.0127	0.17	-0.3261	-0.4957	1623658	CBDivE_011240	Nc1c(sc2nc(cc(c3ccc(Cl)cc3)c12)C4CC4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C01	compound treatment	1.32	0.036	0.49	1.456	-0.00329	-0.04	0.3114	0.6391	1919900	CBDivE_011241	COc1cc(/C=N/c2ccc(cc2)c3nc4ccc(C)cc4s3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C02	compound treatment	1.273	-0.011	-0.15	1.471	0.0117	0.16	0.0077	0.0351	1919901	CBDivE_011242	Cc1ccn(n1)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C03	compound treatment	1.353	0.069	0.93	1.504	0.0447	0.61	1.089	0.979	1919902	CBDivE_011243	[O-][N+](=O)c1ccc(C(=O)Nc2ccc(Cl)c(c2)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C04	compound treatment	1.281	-0.00304	-0.04	1.414	-0.0453	-0.62	-0.4656	-0.7524	1919903	CBDivE_011244	Fc1ccc(/C=C\2/C(=O)NC(=O)N(C2=O)c3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C05	compound treatment	1.298	0.014	0.19	1.556	0.0967	1.32	1.0658	0.8	1223759	CBDivE_011245	NNc1nc(N)c2c(n1)-c3ccccc3CC42CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C06	compound treatment	1.285	9.62E-4	0.01	1.464	0.00471	0.06	0.0546	0.8331	1919904	CBDivE_011246	O=C1NC(=O)/C(=C/c2ccccc2)/C(=O)N1c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C07	compound treatment	1.357	0.073	0.98	1.49	0.0307	0.42	0.9922	0.9275	1919905	CBDivE_011247	CCCCc1ccc(cc1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C08	compound treatment	1.259	-0.025	-0.34	1.446	-0.0133	-0.18	-0.3669	-0.9574	1369152	CBDivE_011248	CN1C(=O)N(C)C(=O)C(CCc2ccncc2)(CCc3ccncc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C09	compound treatment	1.316	0.032	0.43	1.506	0.0467	0.64	0.7553	0.9819	1774463	CBDivE_011249	[O-][N+](=O)c1cc(NC(=O)c2ccc(cc2)C(=O)Nc3ccc(Cl)c(c3)[N+](=O)[O-])ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C10	compound treatment	1.317	0.033	0.44	1.49	0.0307	0.42	0.6106	0.9996	3020092	CBDivE_011250	CC(C)(C)c1cc(N)c2ccccc2n1.OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C11	compound treatment	1.427	0.143	1.93	1.503	0.0437	0.6	1.7853	0.8844	1526720	CBDivE_011251	Cc1ccc(cc1)S(=O)(=O)NC(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C12	compound treatment	1.296	0.012	0.16	1.44	-0.0193	-0.26	-0.0718	-0.2328	3020093	CBDivE_011252	Cc1cc(C)c2nc3CCCCCc3c(N)c2c1.OC(=O)c1cc(ccc1O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C13	compound treatment	1.326	0.042	0.57	1.512	0.0527	0.72	0.9086	0.993	1919906	CBDivE_011253	COC(=O)C1C(=O)/C(=C/NCCc2ccc(OC)c(OC)c2)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C14	compound treatment	1.357	0.073	0.98	1.501	0.0417	0.57	1.0982	0.966	1919907	CBDivE_011254	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C15	compound treatment	1.384	0.1	1.35	1.509	0.0497	0.68	1.4329	0.9494	1474773	CBDivE_011255	O=C1CCCN1c2ccc(cc2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C16	compound treatment	1.287	0.00296	0.04	1.459	-2.85E-4	0.0	0.0255	0.6353	1919908	CBDivE_011256	Oc1ccc2ccccc2c1/C=N/c3ccc(cc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C17	compound treatment	1.379	0.095	1.28	1.49	0.0307	0.42	1.202	0.8918	1919909	CBDivE_011257	Cc1cc(C)c(NC(=O)c2ccccc2[N+](=O)[O-])c(C)c1NC(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C18	compound treatment	1.289	0.00496	0.07	1.477	0.0177	0.24	0.2182	0.8703	1240844	CBDivE_011258	Clc1ccc(NC(=O)CSC2CC(=O)N(C2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C19	compound treatment	1.269	-0.015	-0.2	1.487	0.0277	0.38	0.1238	0.2886	1919910	CBDivE_011259	COC(=O)C1C(=O)/C(=C/Nc2ccccc2O)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	C20	compound treatment	1.273	-0.011	-0.15	1.459	-2.85E-4	0.0	-0.108	-0.7253	1567503	CBDivE_011260	CS(=O)(=NS(=O)(=O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D01	compound treatment	1.245	-0.039	-0.53	1.392	-0.0673	-0.92	-1.0212	-0.9653	1919911	CBDivE_011261	OS(=O)(=O)c1ccc(N/N=C\2/C(=O)NC(=S)N(C2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D02	compound treatment	1.287	0.00296	0.04	1.406	-0.0533	-0.73	-0.4855	-0.6672	1919912	CBDivE_011262	COc1ccc(/C=N/NC(=O)CCN2CCN(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D03	compound treatment	1.123	-0.161	-2.17	1.437	-0.0223	-0.3	-1.7511	-0.7982	1919913	CBDivE_011263	OS(=O)(=O)c1ccc(NN=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D04	compound treatment	1.253	-0.031	-0.42	1.413	-0.0463	-0.63	-0.7424	-0.9801	1513739	CBDivE_011264	NC(=O)c1sc2nc(cc(c3ccc(Cl)cc3)c2c1N)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D05	compound treatment	1.221	-0.063	-0.85	1.436	-0.0233	-0.32	-0.8259	-0.9098	1919914	CBDivE_011265	C=CCN1C(=O)/C(=C/C=C/c2ccccc2)/C(=O)NC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D06	compound treatment	1.332	0.048	0.65	1.485	0.0257	0.35	0.7055	0.9586	1919915	CBDivE_011266	COc1ccc(/C=N/NC(=O)CSc2ccc3ccccc3n2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D07	compound treatment	1.288	0.00396	0.05	1.443	-0.0163	-0.22	-0.1192	-0.522	1919916	CBDivE_011267	Cc1ccc2nc([nH]c2c1)C(F)OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D08	compound treatment	1.267	-0.017	-0.23	1.393	-0.0663	-0.9	-0.8017	-0.8596	1919917	CBDivE_011268	[O-][N+](=O)c1ccc(cc1)c2nc-3c([nH]2)-c4cccc5cccc3c45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D09	compound treatment	1.286	0.00196	0.03	1.396	-0.0633	-0.86	-0.5915	-0.6851	1361587	CBDivE_011269	Oc1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D10	compound treatment	1.253	-0.031	-0.42	1.457	-0.00229	-0.03	-0.3181	-0.7576	1919918	CBDivE_011270	C(=N/c1nccs1)\c2ccc(C#Cc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D11	compound treatment	1.253	-0.031	-0.42	1.494	0.0347	0.47	0.0387	0.0612	1919919	CBDivE_011271	CC(C)(C)N1C(=O)NC(=O)/C(=C/c2ccccc2Cl)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D12	compound treatment	1.324	0.04	0.54	1.451	-0.00829	-0.11	0.3013	0.547	1919920	CBDivE_011272	CCn1c2ccccc2c3cc(/C=N/Nc4ccc(cc4[N+](=O)[O-])[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D13	compound treatment	1.371	0.087	1.17	1.437	-0.0223	-0.3	0.6147	0.5072	1919921	CBDivE_011273	CC1=C(C(NC(=O)N1)c2cccc(Br)c2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D14	compound treatment	1.269	-0.015	-0.2	1.396	-0.0633	-0.86	-0.7537	-0.8502	1919922	CBDivE_011274	CN(C(=O)C)c1ccc(/N=C/c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D15	compound treatment	1.262	-0.022	-0.3	1.485	0.0257	0.35	0.0377	0.0821	1919923	CBDivE_011275	C[S+](C)c1c(O)[nH]c(=O)n(c2ccccc2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D16	compound treatment	1.268	-0.016	-0.22	1.367	-0.0923	-1.26	-1.0428	-0.8167	1417755	CBDivE_011276	Cc1ccc(CCS(=O)(=O)c2cc(c(F)c(c2)C(C)(C)C)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D17	compound treatment	1.237	-0.047	-0.63	1.454	-0.00529	-0.07	-0.4997	-0.7824	1683148	CBDivE_011277	CCNCC(O)CN1CCC(C)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D18	compound treatment	1.278	-0.00604	-0.08	1.471	0.0117	0.16	0.0554	0.3088	1451537	CBDivE_011278	OC(=O)c1ccc2nc(c3ccc(Cl)cc3)c(nc2c1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D19	compound treatment	1.339	0.055	0.74	1.48	0.0207	0.28	0.724	0.9125	1919924	CBDivE_011279	CC(C)OC(=O)NC(C)(C)/C(=N/C(=O)Nc1cccc(Cl)c1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	D20	compound treatment	1.264	-0.02	-0.27	1.49	0.0307	0.42	0.105	0.2107	1919925	CBDivE_011280	[O-][N+](=O)c1cc(/C=N/c2nc3ccccc3s2)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E01	compound treatment	1.362	0.078	1.05	1.454	-0.00529	-0.07	0.6927	0.6571	1496825	CBDivE_011281	COc1ccc(C2CC(=NCCS2)c3c(O)cc(C)oc3=O)c(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E02	compound treatment	1.29	0.00596	0.08	1.442	-0.0173	-0.24	-0.1098	-0.4408	1919926	CBDivE_011282	Oc1ccc(/C=N/c2ccc(cc2)N3CCOCC3)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E03	compound treatment	1.206	-0.078	-1.05	1.47	0.0107	0.15	-0.6411	-0.6032	1647305	CBDivE_011283	Cc1cc(on1)C2C(CC(=O)CC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E04	compound treatment	1.272	-0.012	-0.16	1.464	0.00471	0.06	-0.0694	-0.3972	1698115	CBDivE_011284	Brc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E05	compound treatment	1.329	0.045	0.61	1.477	0.0177	0.24	0.5997	0.9185	1919927	CBDivE_011285	O=C(CSc1cccc2c(SCC(=O)c3ccccc3)cccc12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E06	compound treatment	1.228	-0.056	-0.76	1.442	-0.0173	-0.24	-0.7012	-0.8855	1325424	CBDivE_011286	NS(=O)(=O)c1ccc(cc1)N2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E07	compound treatment	1.254	-0.03	-0.41	1.555	0.0957	1.31	0.6364	0.4656	1919928	CBDivE_011287	CCOc1ccccc1Nc2nc(c(C)s2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E08	compound treatment	1.293	0.00896	0.12	1.495	0.0357	0.49	0.4299	0.8566	1919929	CBDivE_011288	CCN(CC)C(=S)NC(=O)/C=C/c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E09	compound treatment	1.441	0.157	2.12	1.478	0.0187	0.26	1.6778	0.7866	1919930	CBDivE_011289	O=C(OCCc1n[nH]c(CCOC(=O)c2ccccc2)n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E10	compound treatment	1.305	0.021	0.28	1.474	0.0147	0.2	0.3419	0.9859	1200933	CBDivE_011290	O=C1CCCN1c2ccc(cc2)S(=O)(=O)Nc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E11	compound treatment	1.398	0.114	1.54	1.535	0.0757	1.03	1.8172	0.9812	1403707	CBDivE_011291	CC(C)(C)S(=O)(=O)c1cccc(c1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E12	compound treatment	1.273	-0.011	-0.15	1.47	0.0107	0.15	-0.002	-0.0095	1919931	CBDivE_011292	Sc1nnc(o1)C2(CCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E13	compound treatment	1.316	0.032	0.43	1.457	-0.00229	-0.03	0.2829	0.6543	1779364	CBDivE_011293	CCn1c2ccccc2c3cc(ccc13)C4N(CCN4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E14	compound treatment	1.263	-0.021	-0.28	1.466	0.00671	0.09	-0.1359	-0.4558	1919932	CBDivE_011294	OC(=O)c1ccc(cc1NC(=O)c2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E15	compound treatment	1.378	0.094	1.27	1.435	-0.0243	-0.33	0.6622	0.5054	1919933	CBDivE_011295	CN(C)CCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E16	compound treatment	1.273	-0.011	-0.15	1.449	-0.0103	-0.14	-0.2045	-0.9996	1258545	CBDivE_011296	COc1cc(N)ccc1Cc2ccc(N)cc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E17	compound treatment	1.396	0.112	1.51	1.477	0.0177	0.24	1.2389	0.8099	1919934	CBDivE_011297	[O-][N+](=O)c1cc(NC(=O)c2cccc(c2)C(=O)Nc3ccc(Cl)c(c3)[N+](=O)[O-])ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E18	compound treatment	1.298	0.014	0.19	1.464	0.00471	0.06	0.1787	0.8976	1919935	CBDivE_011298	CCCCOC(=S)SCC(=O)Nc1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E19	compound treatment	1.4	0.116	1.56	1.55	0.0907	1.24	1.9809	0.9932	1340928	CBDivE_011299	O=C(Nc1ccc2ccccc2c1)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	E20	compound treatment	1.324	0.04	0.54	1.507	0.0477	0.65	0.8413	0.9956	3106739	CBDivE_011300	NC1CCCCC1.Oc1c(Cl)cc2oc(=O)sc2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F01	compound treatment	1.25	-0.034	-0.46	1.372	-0.0873	-1.19	-1.1663	-0.9142	1919937	CBDivE_011301	CC(=O)CCS(=O)(=O)c1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F02	compound treatment	1.246	-0.038	-0.51	1.397	-0.0623	-0.85	-0.9634	-0.9709	1919938	CBDivE_011302	Cc1ccc(CCS(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F03	compound treatment	1.208	-0.076	-1.03	1.441	-0.0183	-0.25	-0.9017	-0.8541	1919939	CBDivE_011303	[O-][N+](=O)c1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F04	compound treatment	1.28	-0.00404	-0.05	1.361	-0.0983	-1.34	-0.9862	-0.7352	1613758	CBDivE_011304	CCC(C)c1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F05	compound treatment	1.302	0.018	0.24	1.446	-0.0133	-0.18	0.0432	0.1429	1919940	CBDivE_011305	CCOC(=O)CSc1nc(OC)cc(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F06	compound treatment	1.242	-0.042	-0.57	1.415	-0.0443	-0.6	-0.828	-0.9995	1919941	CBDivE_011306	CCCCc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F07	compound treatment	1.291	0.00696	0.09	1.386	-0.0733	-1.0	-0.6402	-0.6378	1919942	CBDivE_011307	COc1ccccc1N2C(=O)NC(=O)/C(=C\c3ccc(Cl)cc3Cl)/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F08	compound treatment	1.311	0.027	0.36	1.479	0.0197	0.27	0.4473	0.9889	1727928	CBDivE_011308	CC(C)(C)c1cc(SCCc2ccncc2)cc(c1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F09	compound treatment	1.215	-0.069	-0.93	1.452	-0.00729	-0.1	-0.7288	-0.7781	1919943	CBDivE_011309	Cc1ccccc1N2C(=O)/C(=N\Nc3ccc(cc3)S(=O)(=O)O)/C(=O)NC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F10	compound treatment	1.242	-0.042	-0.57	1.443	-0.0163	-0.22	-0.558	-0.9163	1316661	CBDivE_011310	NC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F11	compound treatment	1.276	-0.00804	-0.11	1.488	0.0287	0.39	0.2002	0.4928	1207097	CBDivE_011311	Cc1ccc2nc(oc2c1)c3cc(N)ccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F12	compound treatment	1.165	-0.119	-1.61	1.373	-0.0863	-1.18	-1.9675	-0.9883	1919944	CBDivE_011312	CCCSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F13	compound treatment	1.247	-0.037	-0.5	1.468	0.00871	0.12	-0.2693	-0.5243	1919945	CBDivE_011313	NS(=O)(=O)c1ccc2oc3ccc(cc3c2c1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F14	compound treatment	1.25	-0.034	-0.46	1.434	-0.0253	-0.34	-0.5685	-0.99	1919946	CBDivE_011314	COc1ccc(/C=N/NC(=O)CCN2CCN(C)CC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F15	compound treatment	1.294	0.00996	0.13	1.487	0.0277	0.38	0.3623	0.9032	1919947	CBDivE_011315	COc1ccccc1NC=C2C(=O)N(C)C(=O)N(C)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F16	compound treatment	1.277	-0.00704	-0.09	1.457	-0.00229	-0.03	-0.0892	-0.8924	1919948	CBDivE_011316	CCSCCc1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F17	compound treatment	1.225	-0.059	-0.8	1.513	0.0537	0.73	-0.0452	-0.0418	1919949	CBDivE_011317	c1nc(oc1c2ccc(cc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F18	compound treatment	1.292	0.00796	0.11	1.483	0.0237	0.32	0.3046	0.894	1919950	CBDivE_011318	CCCCCOC(=O)c1ccccc1N2C(=O)c3ccc(cc3C2=O)C(=O)OCC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F19	compound treatment	1.22	-0.064	-0.86	1.489	0.0297	0.41	-0.3244	-0.3399	1472698	CBDivE_011319	COc1ccc(Cc2c(O)[nH]c(SCC(=O)N3CCOCC3)nc2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	F20	compound treatment	1.218	-0.066	-0.89	1.403	-0.0563	-0.77	-1.1727	-0.9972	1557811	CBDivE_011320	Nc1c(sc2nc(c3ccccc3)c4CCCCc4c12)C(=O)c5ccc(Br)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G01	compound treatment	1.226	-0.058	-0.78	1.44	-0.0193	-0.26	-0.7396	-0.8954	1919951	CBDivE_011321	COC(=O)CNS(=O)(=O)Nc1ncccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G02	compound treatment	1.239	-0.045	-0.61	1.446	-0.0133	-0.18	-0.5577	-0.8797	1919952	CBDivE_011322	CN1C(=O)NC(=O)/C(=C/c2ccc(F)cc2)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G03	compound treatment	1.299	0.015	0.2	1.504	0.0447	0.61	0.5739	0.8935	1919953	CBDivE_011323	CC(=O)Nc1ccccc1c2nc3ccccc3c(=O)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G04	compound treatment	1.301	0.017	0.23	1.474	0.0147	0.2	0.3037	0.9979	1919913	CBDivE_011324	OS(=O)(=O)c1ccc(NN=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G05	compound treatment	1.299	0.015	0.2	1.446	-0.0133	-0.18	0.0146	0.0539	1512948	CBDivE_011325	COC(=O)C1=C(C)N(C)C(=O)NC1c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G06	compound treatment	1.288	0.00396	0.05	1.41	-0.0493	-0.67	-0.4374	-0.6488	1919954	CBDivE_011326	Oc1c(C(c2ccncc2)c3c(O)n(c4ccccc4)c(=N)n(c5ccccc5)c3=O)c(=O)n(c6ccccc6)c(=N)n1c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G07	compound treatment	1.342	0.058	0.78	1.501	0.0417	0.57	0.9552	0.9878	1919955	CBDivE_011327	CCn1c2ccccc2c3cc(/C=N/NC(=S)N)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G08	compound treatment	1.319	0.035	0.47	1.465	0.00571	0.08	0.3886	0.8129	1779668	CBDivE_011328	COC(=O)CNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G09	compound treatment	1.326	0.042	0.57	1.527	0.0677	0.92	1.0532	0.9724	1919956	CBDivE_011329	CCn1c2ccccc2c3cc(/C=N/N=C/c4ccc5n(CC)c6ccccc6c5c4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G10	compound treatment	1.294	0.00996	0.13	1.51	0.0507	0.69	0.584	0.829	1919957	CBDivE_011330	OC(CN1CCC(=CC1)/C=C/c2cccc(c2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G11	compound treatment	1.388	0.104	1.4	1.531	0.0717	0.98	1.6832	0.9845	1919958	CBDivE_011331	CC(O)CCC(=O)N/N=C/c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G12	compound treatment	1.221	-0.063	-0.85	1.428	-0.0313	-0.43	-0.903	-0.9491	1919959	CBDivE_011332	O=C1C=C(NS(=O)(=O)c2ccccc2)C(=O)C=C1NS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G13	compound treatment	1.276	-0.00804	-0.11	1.502	0.0427	0.58	0.3352	0.5658	1919960	CBDivE_011333	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G14	compound treatment	1.283	-0.00104	-0.01	1.477	0.0177	0.24	0.1609	0.665	1919961	CBDivE_011334	CC1(C)CC(O)CC(C)(CN/C=C/2\C(=O)NC(=O)N(Cc3ccccc3)C2=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G15	compound treatment	1.362	0.078	1.05	1.564	0.105	1.43	1.7534	0.9887	1563044	CBDivE_011335	CCN(CC)c1ccc(cc1)N2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G16	compound treatment	1.268	-0.016	-0.22	1.528	0.0687	0.94	0.5096	0.5299	1919962	CBDivE_011336	CCN(CC(O)CN1CCC(C)CC1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G17	compound treatment	1.337	0.053	0.71	1.521	0.0617	0.84	1.1003	0.9967	1919963	CBDivE_011337	C/C(=N\NC(=O)CSCc1ccccc1Br)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G18	compound treatment	1.275	-0.00904	-0.12	1.464	0.00471	0.06	-0.0408	-0.2957	1571795	CBDivE_011338	O=C(Nc1nnc(s1)c2ccccc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G19	compound treatment	1.32	0.036	0.49	1.467	0.00771	0.11	0.4174	0.8409	1919964	CBDivE_011339	CC(=O)Nc1ccc(NS(=O)(=O)c2ccc3C(=O)c4ccccc4C(=O)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	G20	compound treatment	1.311	0.027	0.36	1.452	-0.00729	-0.1	0.187	0.4958	1919965	CBDivE_011340	OC(=O)/C=C/C(=O)Nc1ccc(\C=C\c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H01	compound treatment	1.236	-0.048	-0.65	1.316	-0.143	-1.95	-1.8399	-0.8938	1919966	CBDivE_011341	[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H02	compound treatment	1.244	-0.04	-0.54	1.462	0.00271	0.04	-0.3558	-0.6571	1386176	CBDivE_011342	N=c1c2CCCc2n(Cc3ccccc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H03	compound treatment	1.285	9.62E-4	0.01	1.406	-0.0533	-0.73	-0.5046	-0.6944	1919967	CBDivE_011343	CC(=O)c1c(C)n(C)c2ccc(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H04	compound treatment	1.291	0.00696	0.09	1.409	-0.0503	-0.69	-0.4185	-0.6046	1919968	CBDivE_011344	COc1ccc(/C=N/NC(=O)CCN2CCN(C)CC2)c(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H05	compound treatment	1.201	-0.083	-1.12	1.428	-0.0313	-0.43	-1.0938	-0.9125	1919969	CBDivE_011345	CN1CCN(CCc2n[nH]c(=S)n2c3ccc(OCc4ccccc4)cc3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H06	compound treatment	1.279	-0.00504	-0.07	1.4	-0.0593	-0.81	-0.6197	-0.7639	1540532	CBDivE_011346	Cc1ccc(CCSc2cc(cc(c2)C(C)(C)C)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H07	compound treatment	1.238	-0.046	-0.62	1.401	-0.0583	-0.79	-1.0012	-0.9926	1919970	CBDivE_011347	Nc1ccc2oc(nc2c1)c3cccc(I)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H08	compound treatment	1.287	0.00296	0.04	1.404	-0.0553	-0.75	-0.5048	-0.6687	1915572	CBDivE_011348	Clc1ccc(Cl)c(SCCc2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H09	compound treatment	1.219	-0.065	-0.88	1.41	-0.0493	-0.67	-1.0956	-0.9913	1649958	CBDivE_011349	Cc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H10	compound treatment	1.295	0.011	0.15	1.492	0.0327	0.45	0.42	0.8937	1431242	CBDivE_011350	CC(C)(C)c1ccc(SCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H11	compound treatment	1.378	0.094	1.27	1.402	-0.0573	-0.78	0.344	0.231	1919971	CBDivE_011351	CC(=O)N/N=C/c1cc(Br)cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H12	compound treatment	1.279	-0.00504	-0.07	1.447	-0.0123	-0.17	-0.1665	-0.9211	1919972	CBDivE_011352	O=C(Nc1cccc2cccnc12)C(=O)Nc3cccc4cccnc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H13	compound treatment	1.323	0.039	0.53	1.51	0.0507	0.69	0.8607	0.9908	1142656	CBDivE_011353	O=c1n2CCCCCc2nc3scc(c4ccccc4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H14	compound treatment	1.272	-0.012	-0.16	1.441	-0.0183	-0.25	-0.2911	-0.9784	1493196	CBDivE_011354	O=S1(=O)Nc2c(ccc3cccnc23)-c4ccccc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H15	compound treatment	1.242	-0.042	-0.57	1.443	-0.0163	-0.22	-0.558	-0.9163	1919973	CBDivE_011355	CC/C(=N\NC(=O)C1COc2ccccc2O1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H16	compound treatment	1.224	-0.06	-0.81	1.502	0.0427	0.58	-0.1608	-0.1612	1919974	CBDivE_011356	Clc1ccc(cc1Cl)S(=O)(=O)CCC(=O)OCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H17	compound treatment	1.247	-0.037	-0.5	1.479	0.0197	0.27	-0.1632	-0.2877	1919975	CBDivE_011357	CCN1C(=O)C(=NNc2ccc(cc2)S(=O)(=O)O)C(=O)N(CC)C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H18	compound treatment	1.334	0.05	0.67	1.404	-0.0553	-0.75	-0.0565	-0.0558	1919976	CBDivE_011358	Nc1ccc(Oc2ccc3nc(c4ccc(cc4)[N+](=O)[O-])c(nc3c2)c5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H19	compound treatment	1.264	-0.02	-0.27	1.514	0.0547	0.75	0.3364	0.424	1300979	CBDivE_011359	O=S(=O)(N1CCOCC1)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	H20	compound treatment	1.254	-0.03	-0.41	1.452	-0.00729	-0.1	-0.3568	-0.8551	1553322	CBDivE_011360	CC(C)(C)c1cc(cc(c1)C(C)(C)C)S(=O)CCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I01	compound treatment	1.319	0.035	0.47	1.458	-0.00129	-0.02	0.3211	0.6804	1172362	CBDivE_011361	CCn1c2ccccc2c3cc(NC(=O)c4ccc5ccccc5c4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I02	compound treatment	1.251	-0.033	-0.45	1.479	0.0197	0.27	-0.1251	-0.2403	1919977	CBDivE_011362	CN1C(=O)C(=Cc2c[nH]c3ccccc23)C(=O)N(C)C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I03	compound treatment	1.37	0.086	1.16	1.491	0.0317	0.43	1.1258	0.9096	1919978	CBDivE_011363	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(c4)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I04	compound treatment	1.222	-0.062	-0.84	1.452	-0.00729	-0.1	-0.662	-0.7855	1919979	CBDivE_011364	CN1C(=O)N(C)C(=O)C(=Cc2cc(Cl)cc(Cl)c2O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I05	compound treatment	1.311	0.027	0.36	1.49	0.0307	0.42	0.5534	0.9975	1321806	CBDivE_011365	CC(C)N(CC#Cc1ccc(C#CCN(C(C)C)C(C)C)cc1)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I06	compound treatment	1.244	-0.04	-0.54	1.44	-0.0193	-0.26	-0.5679	-0.9453	1919980	CBDivE_011366	O=S(=O)(c1cccc(SCc2ccccc2)c1)c3cccc(SCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I07	compound treatment	1.369	0.085	1.15	1.534	0.0747	1.02	1.5309	0.9983	1919981	CBDivE_011367	COc1ccccc1Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I08	compound treatment	1.304	0.02	0.27	1.506	0.0467	0.64	0.6409	0.9266	1919982	CBDivE_011368	CC(=O)Nc1ccc(NC2(CCCC2)c3nnnn3c4c(C)cccc4C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I09	compound treatment	1.283	-0.00104	-0.01	1.477	0.0177	0.24	0.1609	0.665	1597404	CBDivE_011369	Cc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I10	compound treatment	1.307	0.023	0.31	1.449	-0.0103	-0.14	0.1199	0.3525	1919983	CBDivE_011370	CN1C(=O)N(C(=O)/C(=C\c2ccc(F)cc2)/C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I11	compound treatment	1.244	-0.04	-0.54	1.524	0.0647	0.88	0.2421	0.234	1179956	CBDivE_011371	Clc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I12	compound treatment	1.261	-0.023	-0.31	1.493	0.0337	0.46	0.1053	0.1898	1044406	CBDivE_011372	O=C(Nc1cccc(NC(=O)c2ccccc2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I13	compound treatment	1.303	0.019	0.26	1.487	0.0277	0.38	0.4481	0.9819	1919984	CBDivE_011373	Brc1ccc(NS(=O)(=O)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)Nc4ccc(Br)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I14	compound treatment	1.324	0.04	0.54	1.485	0.0257	0.35	0.6292	0.9783	1919985	CBDivE_011374	[O-][N+](=O)c1ccccc1N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I15	compound treatment	1.343	0.059	0.8	1.551	0.0917	1.25	1.4468	0.9761	1919986	CBDivE_011375	Brc1ccc(/C=N/Nc2ccc3nn(nc3c2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I16	compound treatment	1.321	0.037	0.5	1.468	0.00871	0.12	0.4366	0.8518	1111828	CBDivE_011376	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I17	compound treatment	1.393	0.109	1.47	1.538	0.0787	1.07	1.7984	0.9881	1693025	CBDivE_011377	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(c4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I18	compound treatment	1.262	-0.022	-0.3	1.469	0.00971	0.13	-0.1166	-0.3581	1919987	CBDivE_011378	Cc1sc(NC(=O)c2ccccc2)c(C(=O)NN3C(=O)c4ccccc4C3=O)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I19	compound treatment	1.374	0.09	1.21	1.493	0.0337	0.46	1.1833	0.9117	1734469	CBDivE_011379	Cc1cccc(NC(=O)c2ccc3ccccc3c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	I20	compound treatment	1.297	0.013	0.17	1.472	0.0127	0.17	0.2463	1.0	1210563	CBDivE_011380	Cc1cc(C)c(c(C)c1)n2cccc2CN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J01	compound treatment	1.237	-0.047	-0.63	1.412	-0.0473	-0.64	-0.9047	-1.0	1134931	CBDivE_011381	Cc1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J02	compound treatment	1.234	-0.05	-0.68	1.483	0.0237	0.32	-0.2487	-0.3322	1668612	CBDivE_011382	OC(=O)c1ccc2nc(c3ccccc3)c(nc2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J03	compound treatment	1.192	-0.092	-1.24	1.413	-0.0463	-0.63	-1.3243	-0.9508	1919988	CBDivE_011383	Oc1[nH]c(SCC(=O)N2CCCCC2)nc(=O)c1C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J04	compound treatment	1.235	-0.049	-0.66	1.438	-0.0213	-0.29	-0.673	-0.9316	1919989	CBDivE_011384	O=C(C(=O)c1ccc(cc1)c2nc3ccccc3nc2c4ccc(cc4)C(=O)C(=O)c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J05	compound treatment	1.238	-0.046	-0.62	1.448	-0.0113	-0.15	-0.548	-0.8564	1201546	CBDivE_011385	CCOC(=O)c1c(NC(=O)c2ccccc2C)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J06	compound treatment	1.268	-0.016	-0.22	1.378	-0.0813	-1.11	-0.9368	-0.8295	1919990	CBDivE_011386	C(#Cc1ccc(cc1)c2nc3ccccc3nc2c4ccc(C#Cc5ccccc5)cc4)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J07	compound treatment	1.287	0.00296	0.04	1.446	-0.0133	-0.18	-0.0998	-0.5382	1229593	CBDivE_011387	CC(=O)Nc1ccc(cc1)c2nc3ccc(NC(=O)C)cc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J08	compound treatment	1.274	-0.01	-0.14	1.434	-0.0253	-0.34	-0.3396	-0.9167	1674433	CBDivE_011388	Cc1ccc(cc1)S(=O)(=O)Nc2c(Cl)cc(Cl)c3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J09	compound treatment	1.217	-0.067	-0.9	1.417	-0.0423	-0.58	-1.0472	-0.9764	1041550	CBDivE_011389	Cc1ccc2N3CN(Cc2c1)c4ccc(C)cc4C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J10	compound treatment	1.308	0.024	0.32	1.434	-0.0253	-0.34	-0.0152	-0.0322	1440927	CBDivE_011390	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Br)c3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J11	compound treatment	1.29	0.00596	0.08	1.448	-0.0113	-0.15	-0.0519	-0.2991	1914459	CBDivE_011391	CC(C)c1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J12	compound treatment	1.255	-0.029	-0.39	1.458	-0.00129	-0.02	-0.2894	-0.738	1692260	CBDivE_011392	Cc1ccc(NC(=O)c2ccc(Oc3ccc(cc3)C(=O)Nc4ccc(C)cc4)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J13	compound treatment	1.311	0.027	0.36	1.467	0.00771	0.11	0.3316	0.8757	1919991	CBDivE_011393	CC(=O)Nc1ccc2nc(nc(c3ccccc3)c2c1)c4ccc(cc4)c5nc(c6ccccc6)c7cc(NC(=O)C)ccc7n5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J14	compound treatment	1.244	-0.04	-0.54	1.379	-0.0803	-1.09	-1.1561	-0.947	1570020	CBDivE_011394	Cc1ccc(cc1)S(=O)(=O)Nc2c(Br)cc(Br)c3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J15	compound treatment	1.247	-0.037	-0.5	1.48	0.0207	0.28	-0.1536	-0.2676	1075886	CBDivE_011395	FC(F)(F)c1cccc(NS(=O)(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J16	compound treatment	1.2	-0.084	-1.13	1.455	-0.00429	-0.06	-0.843	-0.7426	1919992	CBDivE_011396	Cc1cccc(C)c1n2nnnc2C(N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J17	compound treatment	1.227	-0.057	-0.77	1.481	0.0217	0.3	-0.3347	-0.406	1919993	CBDivE_011397	Cc1ccc(cc1)N2C(=S)N/C(=N\c3c(C)cccc3C)/C42CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J18	compound treatment	1.185	-0.099	-1.34	1.423	-0.0363	-0.49	-1.2946	-0.9087	1565970	CBDivE_011398	CCCC(=O)Nc1cc(nc2ccccc12)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J19	compound treatment	1.208	-0.076	-1.03	1.504	0.0447	0.61	-0.2942	-0.2465	1137603	CBDivE_011399	CN1CCc2c1nc3c(C)cccc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	J20	compound treatment	1.279	-0.00504	-0.07	1.482	0.0227	0.31	0.171	0.5391	1919994	CBDivE_011400	CN(C)c1ccc(/C=N/NC(=S)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K01	compound treatment	1.32	0.036	0.49	1.498	0.0387	0.53	0.7164	0.9991	1919995	CBDivE_011401	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccc4O)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K02	compound treatment	1.282	-0.00204	-0.03	1.437	-0.0223	-0.3	-0.2343	-0.7679	1919996	CBDivE_011402	CN1C(=O)C(C(=O)C)C(=O)N(C)C1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K03	compound treatment	1.176	-0.108	-1.46	1.501	0.0417	0.57	-0.6284	-0.4016	1641866	CBDivE_011403	Cc1cc(C)c(cc1S(=O)(=O)N)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K04	compound treatment	1.281	-0.00304	-0.04	1.466	0.00671	0.09	0.0358	0.3566	1919997	CBDivE_011404	CSc1cc(ccc1Cl)S(=O)(=O)c2ccc(Cl)c(SC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K05	compound treatment	1.388	0.104	1.4	1.486	0.0267	0.36	1.2493	0.8622	1919998	CBDivE_011405	COc1cccc(c1)C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K06	compound treatment	1.258	-0.026	-0.35	1.472	0.0127	0.17	-0.1258	-0.3211	1286663	CBDivE_011406	O=C1C2C3CC(C=C3)C2C(=O)N1Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K07	compound treatment	1.327	0.043	0.58	1.468	0.00871	0.12	0.4939	0.8347	1919999	CBDivE_011407	Cc1cc(Br)c(c(Br)c1)S(=O)(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K08	compound treatment	1.279	-0.00504	-0.07	1.456	-0.00329	-0.04	-0.0797	-0.9795	1920000	CBDivE_011408	COc1ccccc1N2C(=O)NC(=O)/C(=C\NCC3(C)CC(O)CC(C)(C)C3)/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K09	compound treatment	1.303	0.019	0.26	1.505	0.0457	0.62	0.6217	0.9226	1920001	CBDivE_011409	COc1ccc(NC(=O)c2ccccc2)cc1/N=C/c3ccc(C#Cc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K10	compound treatment	1.296	0.012	0.16	1.503	0.0437	0.6	0.5356	0.8673	1393882	CBDivE_011410	Cc1nnc(NS(=O)(=O)c2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K11	compound treatment	1.361	0.077	1.04	1.485	0.0257	0.35	0.9821	0.8962	1228147	CBDivE_011411	CC(=O)Oc1cccc(c1)N2C(=O)C3CC=C(C)CC3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K12	compound treatment	1.265	-0.019	-0.26	1.474	0.0147	0.2	-0.0397	-0.1219	1920002	CBDivE_011412	Oc1cc2c(coc2c3ccccc13)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K13	compound treatment	1.335	0.051	0.69	1.549	0.0897	1.22	1.3512	0.9629	1920003	CBDivE_011413	CN(C)c1ccc(Sc2ccc(cc2)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K14	compound treatment	1.238	-0.046	-0.62	1.472	0.0127	0.17	-0.3166	-0.4909	1046773	CBDivE_011414	O=C1NC(=O)C(C(=O)N1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K15	compound treatment	1.325	0.041	0.55	1.528	0.0687	0.94	1.0533	0.9683	1295681	CBDivE_011415	CC(C)c1ccc(cc1)S(=O)CCc2ccc(C)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K16	compound treatment	1.291	0.00696	0.09	1.503	0.0437	0.6	0.4879	0.8085	1920004	CBDivE_011416	CN1C(=O)NC(=O)/C(=C\Nc2ccc(Cl)cc2)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K17	compound treatment	1.348	0.064	0.86	1.512	0.0527	0.72	1.1185	0.9959	1142134	CBDivE_011417	CC(C)c1ccc(cc1)S(=O)(=O)CCc2ccc(C)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K18	compound treatment	1.282	-0.00204	-0.03	1.434	-0.0253	-0.34	-0.2632	-0.7611	1920005	CBDivE_011418	Brc1ccc(NS(=O)(=O)c2ccc(Sc3ccc(cc3)S(=O)(=O)Nc4ccc(Br)cc4)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K19	compound treatment	1.353	0.069	0.93	1.563	0.104	1.41	1.6579	0.9794	1920006	CBDivE_011419	CCCCCc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	K20	compound treatment	1.324	0.04	0.54	1.552	0.0927	1.26	1.2752	0.9278	1722647	CBDivE_011420	CNS(=O)(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)NC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L01	compound treatment	1.234	-0.05	-0.68	1.44	-0.0193	-0.26	-0.6633	-0.9156	1920007	CBDivE_011421	COc1ccccc1NC2(CCCCC2)c3nnnn3c4c(C)cccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L02	compound treatment	1.225	-0.059	-0.8	1.393	-0.0663	-0.9	-1.2023	-0.998	1912592	CBDivE_011422	Clc1ccc(CSCCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L03	compound treatment	1.288	0.00396	0.05	1.444	-0.0153	-0.21	-0.1096	-0.5093	1920008	CBDivE_011423	O=C(Nc1ccc2-c3ccc(NC(=O)c4cccc5ccccc45)cc3S(=O)(=O)c2c1)c6cccc7ccccc67
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L04	compound treatment	1.224	-0.06	-0.81	1.39	-0.0693	-0.94	-1.2408	-0.9971	1146604	CBDivE_011424	CCCCC(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L05	compound treatment	1.157	-0.127	-1.71	1.463	0.00371	0.05	-1.176	-0.6859	1920009	CBDivE_011425	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc3nc([nH]c3c2)c4ccc(cc4)c5nc6ccc(NC(=O)c7ccccc7[N+](=O)[O-])cc6[nH]5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L06	compound treatment	1.277	-0.00704	-0.09	1.387	-0.0723	-0.99	-0.7641	-0.7716	1543258	CBDivE_011426	CCCC(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L07	compound treatment	1.224	-0.06	-0.81	1.4	-0.0593	-0.81	-1.1444	-1.0	3019747	CBDivE_011427	Oc1c(Cl)cc2oc(=O)sc2c1[N+](=O)[O-].C(NCc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L08	compound treatment	1.225	-0.059	-0.8	1.444	-0.0153	-0.21	-0.7106	-0.8631	1920010	CBDivE_011428	CC1(C)CC(=O)c2c(N)c3cc(ccc3nc2C1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L09	compound treatment	1.264	-0.02	-0.27	1.423	-0.0363	-0.49	-0.541	-0.9596	1920011	CBDivE_011429	O=C(Cc1ccccc1)Nc2ccc(cc2)c3nc4ccc(cc4[nH]3)c5nc6ccc(NC(=O)Cc7ccccc7)cc6[nH]5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L10	compound treatment	1.255	-0.029	-0.39	1.394	-0.0653	-0.89	-0.9065	-0.932	1920012	CBDivE_011430	Clc1cccc(Cn2c3CCCc3c(=N)c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L11	compound treatment	1.255	-0.029	-0.39	1.439	-0.0203	-0.28	-0.4726	-0.9855	1920013	CBDivE_011431	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc(cc2)C3(NC(=O)c4ccccc43)c5ccc(NC(=O)c6ccccc6[N+](=O)[O-])cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L12	compound treatment	1.254	-0.03	-0.41	1.425	-0.0343	-0.47	-0.6171	-0.9975	1920014	CBDivE_011432	CCCCCNc1c2C(=O)CC(C)(C)Cc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L13	compound treatment	1.293	0.00896	0.12	1.441	-0.0183	-0.25	-0.0908	-0.3277	1249896	CBDivE_011433	CN1CCc2c1nc3ccc(C)cc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L14	compound treatment	1.284	-3.76E-5	0.0	1.418	-0.0413	-0.56	-0.3984	-0.7077	1372930	CBDivE_011434	NC(=O)c1sc2nc(c3ccccc3)c4CCCCc4c2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L15	compound treatment	1.276	-0.00804	-0.11	1.41	-0.0493	-0.67	-0.5519	-0.8107	1920015	CBDivE_011435	Cc1cccc(NC2(CCCCC2)c3nnnn3c4c(C)cccc4C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L16	compound treatment	1.251	-0.033	-0.45	1.425	-0.0343	-0.47	-0.6457	-0.9997	1920016	CBDivE_011436	Cc1cc(NC(=O)CN2CCCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L17	compound treatment	1.269	-0.015	-0.2	1.484	0.0247	0.34	0.0949	0.2412	1920017	CBDivE_011437	Cc1cccc(C)c1n2nnnc2C(N3CCOCC3)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L18	compound treatment	1.254	-0.03	-0.41	1.427	-0.0323	-0.44	-0.5978	-0.9991	1619224	CBDivE_011438	Cc1ccccc1NS(=O)(=O)c2ccc(Sc3ccc(cc3)S(=O)(=O)Nc4ccccc4C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L19	compound treatment	1.256	-0.028	-0.38	1.513	0.0537	0.73	0.2505	0.3038	1920018	CBDivE_011439	Cc1cccc(C)c1/N=C/2\NC(=S)N(c3cccc(O)c3)C42CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	L20	compound treatment	1.232	-0.052	-0.7	1.462	0.00271	0.04	-0.4702	-0.6689	1629602	CBDivE_011440	O=S(=O)(N1CCOCC1)c2ccc(Sc3ccc(cc3)S(=O)(=O)N4CCOCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M01	compound treatment	1.357	0.073	0.98	1.434	-0.0253	-0.34	0.4522	0.4336	1378927	CBDivE_011441	OC(=O)c1ccc2nc(c3ccc(Br)cc3)c(nc2c1)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M02	compound treatment	1.214	-0.07	-0.94	1.454	-0.00529	-0.07	-0.7191	-0.7588	1920019	CBDivE_011442	Cc1cc(O)c(C(=O)O)c(/C=C/c2cccc(Br)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M03	compound treatment	1.312	0.028	0.38	1.504	0.0447	0.61	0.6979	0.9734	1726351	CBDivE_011443	CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M04	compound treatment	1.21	-0.074	-1.0	1.461	0.00171	0.02	-0.6897	-0.6904	1920020	CBDivE_011444	OS(=O)(Nc1cccc2cccnc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M05	compound treatment	1.364	0.08	1.08	1.488	0.0287	0.39	1.0397	0.9059	1920021	CBDivE_011445	CN1C(=O)N(C)C(=O)C(=NNc2ccc(cc2)S(=O)(=O)O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M06	compound treatment	1.221	-0.063	-0.85	1.467	0.00771	0.11	-0.5269	-0.6149	1920022	CBDivE_011446	Fc1ccc(NS(=O)(=O)c2cccc(c2)C(F)(F)F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M07	compound treatment	1.335	0.051	0.69	1.5	0.0407	0.56	0.8787	0.9944	1920023	CBDivE_011447	O=C1NC(=O)/C(=C\C=C\c2ccccc2)/C(=O)N1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M08	compound treatment	1.264	-0.02	-0.27	1.441	-0.0183	-0.25	-0.3675	-0.9992	1260031	CBDivE_011448	Cc1nnc(NS(=O)(=O)c2ccc(C)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M09	compound treatment	1.362	0.078	1.05	1.533	0.0737	1.01	1.4545	0.9997	1920024	CBDivE_011449	OCCSc1ccc(cc1)c2ccc(SCCO)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M10	compound treatment	1.285	9.62E-4	0.01	1.472	0.0127	0.17	0.1318	0.7579	1920025	CBDivE_011450	CN1C(=O)N(C)C(=O)C(=CNc2ccc3nc4c(=O)n(C)c(=O)n(C)c4nc3c2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M11	compound treatment	1.333	0.049	0.66	1.438	-0.0213	-0.29	0.2618	0.3629	1920026	CBDivE_011451	CNCCOC(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M12	compound treatment	1.273	-0.011	-0.15	1.426	-0.0333	-0.45	-0.4262	-0.8923	1918283	CBDivE_011452	OS(=O)(=O)c1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M13	compound treatment	1.319	0.035	0.47	1.547	0.0877	1.2	1.1793	0.9172	1920027	CBDivE_011453	OS(=O)(=O)c1cc(ccc1/C=C/c2ccc(cc2S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M14	compound treatment	1.277	-0.00704	-0.09	1.446	-0.0133	-0.18	-0.1952	-0.9545	1920028	CBDivE_011454	Cc1c(Br)c(=O)oc2c3OCCOc3ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M15	compound treatment	1.342	0.058	0.78	1.467	0.00771	0.11	0.6273	0.7951	1920029	CBDivE_011455	OC(=O)CCCNc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M16	compound treatment	1.272	-0.012	-0.16	1.491	0.0317	0.43	0.191	0.4134	1920030	CBDivE_011456	Cc1cc(O)c(C(=O)/C=C/c2ccsc2)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M17	compound treatment	1.395	0.111	1.5	1.553	0.0937	1.28	1.9621	0.9969	1920031	CBDivE_011457	O=C(N/N=C/c1ccc2OCOc2c1)c3ccn[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M18	compound treatment	1.285	9.62E-4	0.01	1.459	-2.85E-4	0.0	0.0064	0.4744	1920032	CBDivE_011458	CCOC(=O)CSc1ccc2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M19	compound treatment	1.375	0.091	1.23	1.6	0.141	1.92	2.2245	0.9767	1920033	CBDivE_011459	CCOC(=O)Cc1c(C)nn(c1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	M20	compound treatment	1.314	0.03	0.4	1.545	0.0857	1.17	1.1123	0.8994	1920034	CBDivE_011460	ClC1(Cl)C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N01	compound treatment	1.219	-0.065	-0.88	1.407	-0.0523	-0.71	-1.1246	-0.9947	1153702	CBDivE_011461	CCCCC(=O)Nc1cc(nc2ccccc12)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N02	compound treatment	1.193	-0.091	-1.23	1.387	-0.0723	-0.99	-1.5654	-0.9941	1920035	CBDivE_011462	Fc1ccc(NC(=O)Nc2ccccc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N03	compound treatment	1.288	0.00396	0.05	1.383	-0.0763	-1.04	-0.6978	-0.6699	1920036	CBDivE_011463	FC(F)(F)C1CN(C2CCCCC2)C(=S)S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N04	compound treatment	1.229	-0.055	-0.74	1.37	-0.0893	-1.22	-1.3859	-0.9719	1323574	CBDivE_011464	O=S(=O)(NC1CCCCC1)c2ccc(Sc3ccc(cc3)S(=O)(=O)NC4CCCCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N05	compound treatment	1.295	0.011	0.15	1.435	-0.0243	-0.33	-0.1296	-0.3573	1321418	CBDivE_011465	CCCC(=O)Nc1c2CCN(Cc3ccccc3)c2nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N06	compound treatment	1.268	-0.016	-0.22	1.399	-0.0603	-0.82	-0.7343	-0.8638	1387130	CBDivE_011466	OCC1(COCN12)COC32CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N07	compound treatment	1.209	-0.075	-1.01	1.489	0.0297	0.41	-0.4293	-0.3937	1920037	CBDivE_011467	Cc1ccc(CCSc2cc(Cl)ccc2Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N08	compound treatment	1.228	-0.056	-0.76	1.435	-0.0243	-0.33	-0.7687	-0.9314	1920038	CBDivE_011468	[O-][N+](=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N09	compound treatment	1.259	-0.025	-0.34	1.459	-2.85E-4	0.0	-0.2416	-0.7152	1354763	CBDivE_011469	Cc1ccc(cc1)c2nc3ccc(cc3nc2c4ccc(C)cc4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N10	compound treatment	1.231	-0.053	-0.72	1.439	-0.0203	-0.28	-0.7015	-0.9145	1920039	CBDivE_011470	COc1ccc(cc1NC(=O)c2ccc(Cl)cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N11	compound treatment	1.252	-0.032	-0.43	1.429	-0.0303	-0.41	-0.5976	-0.9997	1155441	CBDivE_011471	Cc1cccc(c1)N2CCN(C2c3ccccc3)c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N12	compound treatment	1.222	-0.062	-0.84	1.417	-0.0423	-0.58	-0.9995	-0.9835	1920040	CBDivE_011472	COc1cccc(c1)C(=O)Nc2cc(ccc2C(=O)O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N13	compound treatment	1.277	-0.00704	-0.09	1.428	-0.0313	-0.43	-0.3688	-0.8438	1912566	CBDivE_011473	Fc1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N14	compound treatment	1.243	-0.041	-0.55	1.422	-0.0373	-0.51	-0.751	-0.9991	1486384	CBDivE_011474	O=S(=O)(N1CCCCC1)c2ccc(Sc3ccc(cc3)S(=O)(=O)N4CCCCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N15	compound treatment	1.246	-0.038	-0.51	1.435	-0.0243	-0.33	-0.597	-0.9775	1634414	CBDivE_011475	CCN(CC)S(=O)(=O)c1cc(ccc1C)C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N16	compound treatment	1.292	0.00796	0.11	1.399	-0.0603	-0.82	-0.5053	-0.6095	1920041	CBDivE_011476	CCCCC(CC)CN(CN1C(=O)c2ccccc2C1=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N17	compound treatment	1.192	-0.092	-1.24	1.434	-0.0253	-0.34	-1.1218	-0.8705	1486478	CBDivE_011477	CCOC(=O)c1ccc(NCn2c(=O)oc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N18	compound treatment	1.295	0.011	0.15	1.431	-0.0283	-0.39	-0.1682	-0.4071	1283179	CBDivE_011478	O=S(=O)(NC1CCCCC1)c2ccc(Oc3ccc(cc3)S(=O)(=O)NC4CCCCC4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N19	compound treatment	1.236	-0.048	-0.65	1.536	0.0767	1.05	0.2815	0.2287	1920042	CBDivE_011479	OC(c1ccccc1O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	N20	compound treatment	1.277	-0.00704	-0.09	1.447	-0.0123	-0.17	-0.1856	-0.9638	1208942	CBDivE_011480	CC1(C)CC(C)(c2ccccc2)c3cccc4CC(=O)N1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O01	compound treatment	1.328	0.044	0.59	1.479	0.0197	0.27	0.6095	0.936	1920043	CBDivE_011481	CCCCN1CCCCC1C(=O)Nc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O02	compound treatment	1.236	-0.048	-0.65	1.513	0.0537	0.73	0.0597	0.061	1920044	CBDivE_011482	CCn1c2ccccc2c3cc(/C=N/NC(=O)C4CC4c5ccccc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O03	compound treatment	1.17	-0.114	-1.54	1.534	0.0747	1.02	-0.3674	-0.1991	1920045	CBDivE_011483	Cc1nc2ccccn2c(=O)c1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O04	compound treatment	1.317	0.033	0.44	1.465	0.00571	0.08	0.3695	0.8185	1920046	CBDivE_011484	FC(F)(F)c1cccc(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O05	compound treatment	1.309	0.025	0.34	1.453	-0.00629	-0.09	0.1775	0.5109	1228193	CBDivE_011485	CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2C(=O)CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O06	compound treatment	1.251	-0.033	-0.45	1.429	-0.0303	-0.41	-0.6072	-0.9993	1920047	CBDivE_011486	C=c1n(Sc2ccccc2)c(=C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O07	compound treatment	1.325	0.041	0.55	1.472	0.0127	0.17	0.5134	0.8864	1920048	CBDivE_011487	[O-][N+](=O)c1ccc(/C=N/c2ccc(cc2)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O08	compound treatment	1.285	9.62E-4	0.01	1.512	0.0527	0.72	0.5175	0.7198	1851150	CBDivE_011488	COc1ccc(cc1NC(=O)c2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O09	compound treatment	1.33	0.046	0.62	1.474	0.0147	0.2	0.5803	0.8905	1467114	CBDivE_011489	CN(C)S(=O)(=O)c1ccc2n3CCCc3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O10	compound treatment	1.215	-0.069	-0.93	1.429	-0.0303	-0.41	-0.9506	-0.933	1920049	CBDivE_011490	CC(=O)N/1C(=S)NC(=O)\C1=C/2\C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O11	compound treatment	1.354	0.07	0.94	1.499	0.0397	0.54	1.0503	0.9652	1920050	CBDivE_011491	CC(C)CC(=O)NC(NC(=S)Nc1ccc(C)c(C)c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O12	compound treatment	1.322	0.038	0.51	1.492	0.0327	0.45	0.6776	0.9976	1920051	CBDivE_011492	CCn1c2ccccc2c3cc(/C=N/c4ccc(N=Nc5ccccc5)cc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O13	compound treatment	1.347	0.063	0.85	1.523	0.0637	0.87	1.215	0.9999	1920052	CBDivE_011493	OC(=O)/C=C/C(=O)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O14	compound treatment	1.225	-0.059	-0.8	1.482	0.0227	0.31	-0.3442	-0.4027	1776849	CBDivE_011494	CCOc1ccc(cc1[N+](=O)[O-])c2csc(Nc3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O15	compound treatment	1.36	0.076	1.02	1.492	0.0327	0.45	1.0401	0.9306	1288457	CBDivE_011495	Cc1ccc(Nc2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCCCC4)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O16	compound treatment	1.359	0.075	1.01	1.462	0.00271	0.04	0.7413	0.7325	1920053	CBDivE_011496	Cc1cc(=O)n2nc(sc2n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O17	compound treatment	1.353	0.069	0.93	1.588	0.129	1.76	1.899	0.9559	1393008	CBDivE_011497	Cc1cccc(c1)N2C(=O)CC(SCC(=O)Nc3ccc(Cl)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O18	compound treatment	1.249	-0.035	-0.47	1.5	0.0407	0.56	0.0584	0.08	1920054	CBDivE_011498	CN1C(=O)N(C)C(=O)C(=CNCCOc2ccc(Cl)cc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O19	compound treatment	1.396	0.112	1.51	1.543	0.0837	1.14	1.8753	0.9905	1464343	CBDivE_011499	CCc1ccc(cc1)c2nc3cc(NC(=O)c4ccc(Cl)cc4Cl)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	O20	compound treatment	1.217	-0.067	-0.9	1.493	0.0337	0.46	-0.3144	-0.3099	1742576	CBDivE_011500	Clc1ccc(cc1)N2CCN(Cc3ccccc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P01	compound treatment	1.257	-0.027	-0.36	1.459	-2.85E-4	0.0	-0.2607	-0.7146	1920055	CBDivE_011501	[O-][N+](=O)c1cccc2C(=O)N(C(=O)c21)n3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P02	compound treatment	1.252	-0.032	-0.43	1.44	-0.0193	-0.26	-0.4916	-0.9716	1920056	CBDivE_011502	Cc1cc(NC(=O)CNC2CCCCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P03	compound treatment	1.279	-0.00504	-0.07	1.378	-0.0813	-1.11	-0.8318	-0.7491	1574235	CBDivE_011503	O=C(NCc1ccccc1)c2cccc(c2)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P04	compound treatment	1.182	-0.102	-1.38	1.399	-0.0603	-0.82	-1.5547	-0.9696	1920057	CBDivE_011504	CC(C)(C)NCC(=O)Nc1c2CCCc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P05	compound treatment	1.224	-0.06	-0.81	1.433	-0.0263	-0.36	-0.8262	-0.9328	1591023	CBDivE_011505	CC(=O)Nc1ccc(NS(=O)(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P06	compound treatment	1.211	-0.073	-0.99	1.363	-0.0963	-1.31	-1.6252	-0.99	1920058	CBDivE_011506	Cc1cc(NC(=O)CN2CCOCC2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P07	compound treatment	1.238	-0.046	-0.62	1.435	-0.0243	-0.33	-0.6733	-0.9566	1920059	CBDivE_011507	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P08	compound treatment	1.255	-0.029	-0.39	1.433	-0.0263	-0.36	-0.5305	-0.999	1920060	CBDivE_011508	Cc1sc2ncnc(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P09	compound treatment	1.168	-0.116	-1.57	1.365	-0.0943	-1.29	-2.0161	-0.9952	1614344	CBDivE_011509	CN1CCc2c1nc3c(C)cc(C)cc3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P10	compound treatment	0.714	-0.57	-7.69	0.85	-0.609	-8.31	-11.3128	-0.9993	1920061	CBDivE_011510	O=C(CN1CCCC1)Nc2c3CCCc3nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P11	compound treatment	1.26	-0.024	-0.32	1.365	-0.0943	-1.29	-1.1384	-0.8586	1007070	CBDivE_011511	OS(=O)(=O)c1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P12	compound treatment	1.211	-0.073	-0.99	1.364	-0.0953	-1.3	-1.6155	-0.9907	1920062	CBDivE_011512	Fc1ccc(/C=N/NC(=O)CSc2ccc3ccccc3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P13	compound treatment	1.251	-0.033	-0.45	1.432	-0.0273	-0.37	-0.5783	-0.996	1920063	CBDivE_011513	Oc1ccccc1/C=N/Nc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P14	compound treatment	1.225	-0.059	-0.8	1.438	-0.0213	-0.29	-0.7684	-0.9065	1920064	CBDivE_011514	[O-][N+](=O)c1cc(/C=N/c2ccc3[nH]c(=O)oc3c2)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P15	compound treatment	1.311	0.027	0.36	1.461	0.00171	0.02	0.2737	0.751	1409712	CBDivE_011515	CCCC(CCC)C(=O)Nc1c(C)c(CC)nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P16	compound treatment	1.253	-0.031	-0.42	1.383	-0.0763	-1.04	-1.0317	-0.92	1920065	CBDivE_011516	CCCCOc1cccc(NC(=O)CSc2ccc3ccccc3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P17	compound treatment	1.224	-0.06	-0.81	1.396	-0.0633	-0.86	-1.1829	-0.9995	1920066	CBDivE_011517	O=C(Nc1ccc(cc1)C2(NC(=O)c3ccccc32)c4ccc(NC(=O)c5cccc6ccccc56)cc4)c7cccc8ccccc78
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P18	compound treatment	1.162	-0.122	-1.65	1.492	0.0327	0.45	-0.8487	-0.4976	1920067	CBDivE_011518	O=C(CSc1ccc2ccccc2n1)N/N=C/c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P19	compound treatment	1.275	-0.00904	-0.12	1.474	0.0147	0.2	0.0557	0.2371	1920068	CBDivE_011519	C/C(=N\Nc1cccc2cccnc12)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.36	P20	compound treatment	1.241	-0.043	-0.58	1.398	-0.0613	-0.84	-1.0015	-0.9842	1011014	CBDivE_011520	[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A01	compound treatment	1.355	0.0708	0.96	1.446	-0.0147	-0.2	0.5338	0.5466	1920069	CBDivE_011521	COc1cc(/C=N/NC(=O)CSc2ccc3ccccc3n2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A02	compound treatment	1.353	0.0688	0.93	1.466	0.00527	0.07	0.7075	0.7596	1463660	CBDivE_011522	CC(C)(C)c1ccc(O)c(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A03	compound treatment	1.328	0.0438	0.59	1.43	-0.0307	-0.42	0.1219	0.1682	1920070	CBDivE_011523	Oc1ccc(/C=N/NC(=O)CSc2ccc3ccccc3n2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A04	compound treatment	1.34	0.0558	0.75	1.479	0.0183	0.25	0.7089	0.8934	1594065	CBDivE_011524	O=C(NCc1ccco1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A05	compound treatment	1.362	0.0778	1.05	1.504	0.0433	0.59	1.1598	0.9628	1920071	CBDivE_011525	Brc1cc2OCOc2cc1/C=N/NC(=O)CSc3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A06	compound treatment	1.283	-0.00116	-0.02	1.419	-0.0417	-0.57	-0.4134	-0.7263	1175336	CBDivE_011526	COc1ccc(CCNC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A07	compound treatment	1.448	0.164	2.21	1.572	0.111	1.52	2.6359	0.9832	1920072	CBDivE_011527	Oc1ccc2ccccc2c1/C=N/NC(=O)CSc3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A08	compound treatment	1.354	0.0698	0.94	1.581	0.12	1.64	1.8259	0.9654	1920073	CBDivE_011528	Cc1ccc(NC(=O)c2cccnc2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A09	compound treatment	1.366	0.0818	1.1	1.442	-0.0187	-0.26	0.6001	0.5296	1920074	CBDivE_011529	O=C(CN1CCOCC1)Nc2c3CCCc3nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A10	compound treatment	1.344	0.0598	0.81	1.453	-0.00773	-0.11	0.4963	0.6096	1920075	CBDivE_011530	Cc1ncc([N+](=O)[O-])n1CCOC(NC(=O)c2ccco2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A11	compound treatment	1.364	0.0798	1.08	1.586	0.125	1.71	1.9696	0.9753	1920076	CBDivE_011531	Cc1cc(C)c2ccc(/C=N/O)nc2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A12	compound treatment	1.317	0.0328	0.44	1.513	0.0523	0.71	0.8173	0.9738	1920077	CBDivE_011532	Cn1c(/C=C/c2ccccc2)cc[n+]1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A13	compound treatment	1.383	0.0988	1.33	1.494	0.0333	0.45	1.2637	0.8972	1920078	CBDivE_011533	Cc1cc(Cl)c2ccccc2[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A14	compound treatment	1.274	-0.0102	-0.14	1.507	0.0463	0.63	0.3493	0.5409	1920079	CBDivE_011534	OC1=[N+](CCC1)c2ccc(cc2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A15	compound treatment	1.343	0.0588	0.79	1.517	0.0563	0.77	1.1039	0.9999	1920080	CBDivE_011535	Ic1ccccc1/C=N/NC(=O)CSc2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A16	compound treatment	1.267	-0.0172	-0.23	1.481	0.0203	0.28	0.0318	0.0881	1776802	CBDivE_011536	COc1ccc(OC)c(NC(=O)c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A17	compound treatment	1.455	0.171	2.3	1.524	0.0633	0.86	2.2398	0.9101	1264773	CBDivE_011537	CN(C)CCSC(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A18	compound treatment	1.352	0.0678	0.92	1.442	-0.0187	-0.26	0.4666	0.491	1570537	CBDivE_011538	COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A19	compound treatment	1.354	0.0698	0.94	1.479	0.0183	0.25	0.8424	0.8644	1920081	CBDivE_011539	[O-][N+](=O)c1cccc(/C=N/NC(=O)CSc2ccc3ccccc3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	A20	compound treatment	1.259	-0.0252	-0.34	1.447	-0.0137	-0.19	-0.3724	-0.9607	1920082	CBDivE_011540	OC(C(=O)NCCCN1CCOCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B01	compound treatment	1.296	0.0118	0.16	1.384	-0.0767	-1.05	-0.6269	-0.5923	1084340	CBDivE_011541	Clc1ccc(NC(=O)c2ccco2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B02	compound treatment	1.334	0.0498	0.67	1.474	0.0133	0.18	0.6034	0.8666	1920083	CBDivE_011542	CCC1CCCCN1C(=O)NCCCCCCNC(=O)N2CCCCC2CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B03	compound treatment	1.317	0.0328	0.44	1.459	-0.00173	-0.02	0.2966	0.6686	1920084	CBDivE_011543	Cc1ccc(/N=C/c2cn(nc2c3ccc(F)cc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B04	compound treatment	1.309	0.0248	0.34	1.471	0.0103	0.14	0.336	0.9251	1920085	CBDivE_011544	C/C(=N\NC(=O)c1ccccc1)/c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B05	compound treatment	1.313	0.0288	0.39	1.492	0.0313	0.43	0.5767	0.999	1920086	CBDivE_011545	Fc1ccc(cc1)c2nn(cc2/C=N/c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B06	compound treatment	1.252	-0.0322	-0.43	1.431	-0.0297	-0.41	-0.5934	-0.9994	1920087	CBDivE_011546	CC1(C)CC(=O)C/C(=N/NC(=O)c2ccccc2[N+](=O)[O-])/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B07	compound treatment	1.314	0.0298	0.4	1.48	0.0193	0.26	0.4705	0.9786	1920088	CBDivE_011547	S=c1nc(c2ccco2)n(Cc3ccccc3)c(=S)n1/C(=N/Cc4ccccc4)/c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B08	compound treatment	1.381	0.0968	1.31	1.404	-0.0567	-0.77	0.3768	0.2482	1920089	CBDivE_011548	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)Oc2ccc(cc2)S(=O)(=O)c3ccc(OC(=O)c4cc(cc(c4)C(C)(C)C)C(C)(C)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B09	compound treatment	1.262	-0.0222	-0.3	1.489	0.0283	0.39	0.0612	0.1255	1916388	CBDivE_011549	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NC(N2CCOCC2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B10	compound treatment	1.383	0.0988	1.33	1.48	0.0193	0.26	1.1287	0.8305	1517375	CBDivE_011550	O=C1CSC(N1CCCN2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B11	compound treatment	1.308	0.0238	0.32	1.405	-0.0557	-0.76	-0.3099	-0.3756	1724360	CBDivE_011551	c1c(nc2nc(c3ccccc3)c(nn12)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B12	compound treatment	1.311	0.0268	0.36	1.452	-0.00873	-0.12	0.1719	0.451	1920090	CBDivE_011552	CC(=O)Nc1cc(cc(c1)C(=O)NC(CO)(CO)CO)C(=O)NC(CO)(CO)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B13	compound treatment	1.341	0.0568	0.77	1.401	-0.0597	-0.81	-0.0337	-0.0301	1375576	CBDivE_011553	CC(C)c1ccc(C)cc1OCC(O)CNC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B14	compound treatment	1.253	-0.0312	-0.42	1.468	0.00727	0.1	-0.2271	-0.5258	1920091	CBDivE_011554	CCS(=O)(=O)c1cc([N+](=O)[O-])c(Sc2ccccc2N)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B15	compound treatment	1.318	0.0338	0.46	1.459	-0.00173	-0.02	0.3062	0.6697	1558777	CBDivE_011555	S=C(Cc1ccc2OCCOc2c1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B16	compound treatment	1.252	-0.0322	-0.43	1.444	-0.0167	-0.23	-0.4681	-0.9549	1920092	CBDivE_011556	CCOC(=O)/C=C(\C)/N1N=C2C(CCc3cc(OC)ccc23)C1c4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B17	compound treatment	1.324	0.0398	0.54	1.479	0.0183	0.25	0.5562	0.9389	1920093	CBDivE_011557	CC/1=NN(C(=O)\C1=N\Nc2ccc3OCCOc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B18	compound treatment	1.242	-0.0422	-0.57	1.467	0.00627	0.09	-0.3417	-0.5941	1920094	CBDivE_011558	Nc1ccc-2c(SSc3cc(N)ccc32)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B19	compound treatment	1.285	8.4E-4	0.01	1.401	-0.0597	-0.81	-0.5679	-0.6972	1920095	CBDivE_011559	CC1(C)CC(=O)c2c(c3cccc(c3)[N+](=O)[O-])c4C(=O)CC(C)(C)Cc4nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	B20	compound treatment	1.223	-0.0612	-0.83	1.471	0.0103	0.14	-0.4844	-0.5788	1920096	CBDivE_011560	ClC(Cl)(Cl)C(NC(=O)c1ccco1)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C01	compound treatment	1.308	0.0238	0.32	1.456	-0.00473	-0.06	0.1818	0.5544	1920097	CBDivE_011561	O=C(CSc1ccc2ccccc2n1)N/N=C\c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C02	compound treatment	1.287	0.00284	0.04	1.464	0.00327	0.04	0.0586	0.9971	1920098	CBDivE_011562	Brc1ccc(o1)C(=O)NCCNC(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C03	compound treatment	1.341	0.0568	0.77	1.466	0.00527	0.07	0.5931	0.77	1920099	CBDivE_011563	CC1(CN2CC/3CN(C1)CC2)\C3=N\O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C04	compound treatment	1.301	0.0168	0.23	1.449	-0.0117	-0.16	0.0476	0.1712	872	CBDivE_011564	CCN(CC)CCOC(=O)C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C05	compound treatment	1.29	0.00584	0.08	1.523	0.0623	0.85	0.6562	0.7694	1920100	CBDivE_011565	[O-][N+](=O)c1ccc(N/N=C/c2ccc(C#Cc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C06	compound treatment	1.291	0.00684	0.09	1.516	0.0553	0.75	0.5982	0.7878	1492964	CBDivE_011566	Brc1ccc(NC(=O)c2ccncc2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C07	compound treatment	1.392	0.108	1.45	1.483	0.0223	0.3	1.2435	0.8367	1920101	CBDivE_011567	OC(=O)/C=C/c1ccc(\N=C\c2ccc(Br)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C08	compound treatment	1.292	0.00784	0.11	1.467	0.00627	0.09	0.1353	0.9945	1920102	CBDivE_011568	FC(F)(F)c1cccc(/N=C/2\C(=O)Nc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C09	compound treatment	1.348	0.0638	0.86	1.533	0.0723	0.99	1.3059	0.9977	1920103	CBDivE_011569	[O-][N+](=O)c1cc(Cl)ccc1Sc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C10	compound treatment	1.327	0.0428	0.58	1.52	0.0593	0.81	0.9802	0.9865	1920104	CBDivE_011570	CN(C(=O)C)c1ccc(/N=C/c2ccc[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C11	compound treatment	1.371	0.0868	1.17	1.45	-0.0107	-0.15	0.725	0.614	1920105	CBDivE_011571	CC1=C(C(NC(=O)N1)c2ccc(Cl)c(Cl)c2)C(=O)OCC(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C12	compound treatment	1.305	0.0208	0.28	1.463	0.00227	0.03	0.2207	0.7803	1920106	CBDivE_011572	OC1(C(=O)Nc2ccccc21)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C13	compound treatment	1.358	0.0738	1.0	1.485	0.0243	0.33	0.9384	0.894	1920107	CBDivE_011573	Nc1ccc(Cl)c(c1)c2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C14	compound treatment	1.403	0.119	1.6	1.496	0.0353	0.48	1.4738	0.8805	1649937	CBDivE_011574	C(C#Cc1ccc(C#CCN2CCCCC2)cc1)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C15	compound treatment	1.427	0.143	1.93	1.526	0.0653	0.89	1.992	0.9384	1026368	CBDivE_011575	c1ccc2sc(nc2c1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C16	compound treatment	1.226	-0.0582	-0.78	1.502	0.0413	0.56	-0.1568	-0.1624	1577637	CBDivE_011576	COc1cc(cc(OC)c1OC)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C17	compound treatment	1.361	0.0768	1.04	1.501	0.0403	0.55	1.1213	0.9559	1523100	CBDivE_011577	Nc1cc2cccnc2c3ncccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C18	compound treatment	1.312	0.0278	0.38	1.511	0.0503	0.69	0.7503	0.9599	1920108	CBDivE_011578	COc1ccc(NC(=O)C(Cc2ccccc2)NS(=O)(=O)c3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C19	compound treatment	1.282	-0.00216	-0.03	1.494	0.0333	0.45	0.3002	0.6603	1920109	CBDivE_011579	CCn1c2ccccc2c3cc(/C=N/c4ccc(cc4)c5ccc(\N=C\c6ccc7n(CC)c8ccccc8c7c6)cc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	C20	compound treatment	1.286	0.00184	0.02	1.44	-0.0207	-0.28	-0.1823	-0.6425	1920110	CBDivE_011580	Brc1ccc(cc1)C(=O)Oc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D01	compound treatment	1.25	-0.0342	-0.46	1.389	-0.0717	-0.98	-1.0175	-0.941	1158140	CBDivE_011581	COC(=O)c1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D02	compound treatment	1.277	-0.00716	-0.1	1.4	-0.0607	-0.83	-0.6539	-0.7843	1917814	CBDivE_011582	OS(=O)(=O)c1cc(ccc1/C=C/c2ccccc2)n3nc4ccc5ccccc5c4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D03	compound treatment	1.148	-0.136	-1.84	1.433	-0.0277	-0.38	-1.5662	-0.8351	1160657	CBDivE_011583	COC(=O)c1ccccc1NC(=O)c2cc(OC)c(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D04	compound treatment	1.287	0.00284	0.04	1.413	-0.0477	-0.65	-0.4331	-0.6643	1920111	CBDivE_011584	CC(C)(C)SC1CS(=O)(=O)C1S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D05	compound treatment	1.254	-0.0302	-0.41	1.419	-0.0417	-0.57	-0.6901	-0.9865	1410893	CBDivE_011585	COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(Br)o3)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D06	compound treatment	1.343	0.0588	0.79	1.464	0.00327	0.04	0.5929	0.7457	1920112	CBDivE_011586	[O-][N+](=O)c1ccccc1C(=O)N/N=C/c2cc3OCOc3cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D07	compound treatment	1.302	0.0178	0.24	1.49	0.0293	0.4	0.4524	0.9707	1732464	CBDivE_011587	COC(=O)c1ccc(NC(=O)C(C(C)C)N2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D08	compound treatment	1.259	-0.0252	-0.34	1.443	-0.0177	-0.24	-0.4109	-0.9862	1920113	CBDivE_011588	COc1ccc2/C(=C\Nc3ccccc3OC)/C(=O)N(C(=O)c2c1)c4ccc(C)cc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D09	compound treatment	1.28	-0.00416	-0.06	1.457	-0.00373	-0.05	-0.0756	-0.9988	1651473	CBDivE_011589	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D10	compound treatment	1.223	-0.0612	-0.83	1.429	-0.0317	-0.43	-0.8894	-0.9546	1920114	CBDivE_011590	COc1ccc2/C(=C\Nc3ccccc3C)/C(=O)N(C(=O)c2c1)c4ccc(C)cc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D11	compound treatment	1.271	-0.0132	-0.18	1.522	0.0613	0.84	0.4653	0.5447	1920115	CBDivE_011591	CN1/C(=C\C=N\c2ccc(N=Nc3ccccc3)cc2)/C(C)(C)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D12	compound treatment	1.335	0.0508	0.69	1.489	0.0283	0.39	0.7576	0.9629	3106889	CBDivE_011592	Cc1cccc2c(CCN)c[nH]c12.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D13	compound treatment	1.391	0.107	1.44	1.465	0.00427	0.06	1.0604	0.7351	1920116	CBDivE_011593	Brc1cccc(CSCC(=O)N/N=C/c2ccc3OCOc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D14	compound treatment	1.273	-0.0112	-0.15	1.415	-0.0457	-0.62	-0.5474	-0.8533	1920117	CBDivE_011594	COCC(=C=CCN(C)C)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D15	compound treatment	1.255	-0.0292	-0.39	1.505	0.0443	0.6	0.1487	0.2064	1536931	CBDivE_011595	CCN(CC)S(=O)(=O)c1cc(ccc1C)C(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D16	compound treatment	1.302	0.0178	0.24	1.378	-0.0827	-1.13	-0.6275	-0.544	1149708	CBDivE_011596	OC1CCC(CC1O)C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D17	compound treatment	1.247	-0.0372	-0.5	1.444	-0.0167	-0.23	-0.5158	-0.9365	1641149	CBDivE_011597	Cc1ccccc1NS(=O)(=O)c2ccc(cc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D18	compound treatment	1.259	-0.0252	-0.34	1.427	-0.0337	-0.46	-0.5652	-0.9888	1920118	CBDivE_011598	COc1ccc(OCC(=O)N/N=C/2\C(=O)N(C)c3ccc(Br)cc23)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D19	compound treatment	1.349	0.0648	0.87	1.507	0.0463	0.63	1.0647	0.9872	1920119	CBDivE_011599	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	D20	compound treatment	1.259	-0.0252	-0.34	1.484	0.0233	0.32	-0.0156	-0.0336	1595978	CBDivE_011600	O=C(Nc1nc[nH]n1)c2ccc(cc2)C(=O)Nc3nc[nH]n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E01	compound treatment	1.368	0.0838	1.13	1.427	-0.0337	-0.46	0.4746	0.3887	1920120	CBDivE_011601	Nc1c(Br)cc(Br)c2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E02	compound treatment	1.295	0.0108	0.15	1.432	-0.0287	-0.39	-0.1736	-0.4152	1920121	CBDivE_011602	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc3ccccc3)NS(=O)(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E03	compound treatment	1.176	-0.108	-1.46	1.511	0.0503	0.69	-0.547	-0.3393	1920122	CBDivE_011603	C1CCC(CC1)(NN(c2ccccc2)c3ccccc3)c4nnnn4C(c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E04	compound treatment	1.294	0.00984	0.13	1.506	0.0453	0.62	0.5304	0.84	1541643	CBDivE_011604	COC(=O)c1ccc(NC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E05	compound treatment	1.354	0.0698	0.94	1.464	0.00327	0.04	0.6978	0.7398	1920123	CBDivE_011605	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E06	compound treatment	1.252	-0.0322	-0.43	1.49	0.0293	0.4	-0.0245	-0.0416	1920124	CBDivE_011606	Oc1c(cc(cc1[N+](=O)[O-])C2(CC3CC4CC(C3)C2)C4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E07	compound treatment	1.22	-0.0642	-0.87	1.571	0.11	1.5	0.4513	0.2601	1920125	CBDivE_011607	CC(C)NCCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E08	compound treatment	1.306	0.0218	0.29	1.53	0.0693	0.94	0.8763	0.8856	1920126	CBDivE_011608	COC(=O)c1ccccc1NC(=O)C(Cc2ccccc2)NS(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E09	compound treatment	1.447	0.163	2.2	1.526	0.0653	0.89	2.1828	0.9209	1920127	CBDivE_011609	Cn1c(cc2ccccc12)C(=O)N/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E10	compound treatment	1.315	0.0308	0.42	1.506	0.0453	0.62	0.7307	0.9816	1919518	CBDivE_011610	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NC(Nc2ncccn2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E11	compound treatment	1.377	0.0928	1.25	1.511	0.0503	0.69	1.3704	0.9598	1920128	CBDivE_011611	OS(=O)(=O)c1ccc(cc1)N2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E12	compound treatment	1.256	-0.0282	-0.38	1.481	0.0203	0.28	-0.0731	-0.1557	1920129	CBDivE_011612	C[n+]1cn(/N=C/c2ccco2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E13	compound treatment	1.346	0.0618	0.83	1.476	0.0153	0.21	0.7372	0.8573	1596939	CBDivE_011613	CCCCN(c1ccc2cccc(O)c2n1)c3ccc4cccc(O)c4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E14	compound treatment	1.224	-0.0602	-0.81	1.456	-0.00473	-0.06	-0.6195	-0.7609	1920130	CBDivE_011614	Cc1nc(N/N=C/2\C(=O)Nc3ccccc23)c4c5CCCCc5sc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E15	compound treatment	1.403	0.119	1.6	1.454	-0.00673	-0.09	1.0688	0.6656	1696644	CBDivE_011615	O=C(N1CCN(CC1)c2ccccc2)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E16	compound treatment	1.296	0.0118	0.16	1.447	-0.0137	-0.19	-0.0194	-0.0789	1920131	CBDivE_011616	Cc1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E17	compound treatment	1.352	0.0678	0.92	1.474	0.0133	0.18	0.7751	0.8309	1920132	CBDivE_011617	Cc1ccc(cc1)N2CCN(C2c3cccc4ccccc34)c5ccc(C)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E18	compound treatment	1.29	0.00584	0.08	1.509	0.0483	0.66	0.5212	0.7861	1920133	CBDivE_011618	Cc1cc(C)n2nc(nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E19	compound treatment	1.363	0.0788	1.06	1.56	0.0993	1.35	1.7093	0.9929	1920134	CBDivE_011619	OC(=O)c1ccc(/N=C/c2ccc(Br)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	E20	compound treatment	1.329	0.0448	0.6	1.496	0.0353	0.48	0.7679	0.9936	1920135	CBDivE_011620	Brc1ccc(cc1)C(=O)N/C(=C\c2cn(nc2c3ccccc3)c4ccccc4)/C(=O)N5CCOCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F01	compound treatment	1.24	-0.0442	-0.6	1.375	-0.0857	-1.17	-1.2479	-0.9511	1920136	CBDivE_011621	Cc1ccccc1OCC(=O)N/N=C/2\C(=O)Nc3c2cc(Br)cc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F02	compound treatment	1.241	-0.0432	-0.58	1.379	-0.0817	-1.11	-1.1998	-0.9542	1920137	CBDivE_011622	Cc1ccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F03	compound treatment	1.231	-0.0532	-0.72	1.451	-0.00973	-0.13	-0.6009	-0.8239	1920138	CBDivE_011623	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F04	compound treatment	1.249	-0.0352	-0.47	1.388	-0.0727	-0.99	-1.0367	-0.943	1920139	CBDivE_011624	COc1ccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F05	compound treatment	1.332	0.0478	0.65	1.478	0.0173	0.24	0.6229	0.9067	1386403	CBDivE_011625	CCC1CCCCN1C(=S)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F06	compound treatment	1.267	-0.0172	-0.23	1.411	-0.0497	-0.68	-0.6432	-0.8976	1920140	CBDivE_011626	Clc1ccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F07	compound treatment	1.302	0.0178	0.24	1.411	-0.0497	-0.68	-0.3093	-0.4299	1920141	CBDivE_011627	OC(=O)C1CSC(N1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F08	compound treatment	1.313	0.0288	0.39	1.486	0.0253	0.34	0.5188	0.9982	1920142	CBDivE_011628	Cc1cccc(OCC(=O)N/N=C/c2cc3ccccc3nc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F09	compound treatment	1.202	-0.0822	-1.11	1.457	-0.00373	-0.05	-0.8197	-0.7388	1920143	CBDivE_011629	Sc1n[n+]2c(cc(nc2s1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F10	compound treatment	1.26	-0.0242	-0.33	1.469	0.00827	0.11	-0.1507	-0.4369	1920144	CBDivE_011630	Fc1ccccc1Nc2nc3nonc3nc2N/N=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F11	compound treatment	1.259	-0.0252	-0.34	1.507	0.0463	0.63	0.2062	0.2878	1915717	CBDivE_011631	[O-][N+](=O)c1ccc(Nc2ccccn2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F12	compound treatment	1.161	-0.123	-1.66	1.418	-0.0427	-0.58	-1.5869	-0.9013	1920145	CBDivE_011632	COc1ccc(OCC(=O)N/N=C/2\C(=O)N(C)c3ccc(Br)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F13	compound treatment	1.257	-0.0272	-0.37	1.493	0.0323	0.44	0.0521	0.091	1392936	CBDivE_011633	CN1CCN(CC1)c2cc(c3ccccc3)c4ccccc4n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F14	compound treatment	1.227	-0.0572	-0.77	1.462	0.00127	0.02	-0.533	-0.691	1920146	CBDivE_011634	Cc1cccc(NCC(=O)N/N=C/c2cc3ccccc3nc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F15	compound treatment	1.294	0.00984	0.13	1.469	0.00827	0.11	0.1736	0.9967	1920147	CBDivE_011635	NC1=NN=C(CS1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F16	compound treatment	1.254	-0.0302	-0.41	1.451	-0.00973	-0.13	-0.3815	-0.8915	1920148	CBDivE_011636	Cc1ccc(NCC(=O)N/N=C/c2cc3ccccc3nc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F17	compound treatment	1.214	-0.0702	-0.95	1.508	0.0473	0.64	-0.2135	-0.1864	1920149	CBDivE_011637	COc1ccc(C/C(=N\O)/C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F18	compound treatment	1.297	0.0128	0.17	1.475	0.0143	0.19	0.2601	0.9983	1920150	CBDivE_011638	CN1C(=O)/C(=N\NC(=O)COc2cccc(Br)c2)/c3cc(Br)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F19	compound treatment	1.23	-0.0542	-0.73	1.533	0.0723	0.99	0.1802	0.1469	1576686	CBDivE_011639	CCOC(=O)C1=C(C)NC2=C(C1c3ccccc3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	F20	compound treatment	1.257	-0.0272	-0.37	1.404	-0.0567	-0.77	-0.8061	-0.9417	1920151	CBDivE_011640	CN(C)c1nc(N/N=C/c2ccc3OCOc3c2)nc(Nc4ccc(F)cc4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G01	compound treatment	1.239	-0.0452	-0.61	1.439	-0.0217	-0.3	-0.6403	-0.9451	1920152	CBDivE_011641	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccc(cc4)[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G02	compound treatment	1.24	-0.0442	-0.6	1.428	-0.0327	-0.45	-0.7368	-0.9899	1283295	CBDivE_011642	Oc1ccc(cc1)C2(CCCCC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G03	compound treatment	1.343	0.0588	0.79	1.463	0.00227	0.03	0.5832	0.7342	1920153	CBDivE_011643	CC(=O)SCCN1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G04	compound treatment	1.311	0.0268	0.36	1.465	0.00427	0.06	0.2972	0.8105	1920154	CBDivE_011644	OC(=O)C(OC(=O)c1ccccc1)C(OC(=O)c2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G05	compound treatment	1.303	0.0188	0.25	1.472	0.0113	0.15	0.2884	0.971	3019757	CBDivE_011645	Nc1c2CCCc2nc3CCCCc13.OC(=O)c1cncc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G06	compound treatment	1.286	0.00184	0.02	1.441	-0.0197	-0.27	-0.1727	-0.6391	1451736	CBDivE_011646	CCc1ccc(NC(=O)C(C(C(=O)O)C(=O)Oc2ccccc2)C(=O)Oc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G07	compound treatment	1.288	0.00384	0.05	1.483	0.0223	0.3	0.2514	0.8159	1569583	CBDivE_011647	CN(C)c1ccc(cc1)c2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G08	compound treatment	1.284	-1.6E-4	0.0	1.471	0.0103	0.14	0.0975	0.6961	1920155	CBDivE_011648	NC(=O)CCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G09	compound treatment	1.254	-0.0302	-0.41	1.519	0.0583	0.79	0.2742	0.3071	1021875	CBDivE_011649	OC1=CC(=O)c2cccc3cccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G10	compound treatment	1.292	0.00784	0.11	1.512	0.0513	0.7	0.5692	0.8049	1920156	CBDivE_011650	CCCCOC(=O)C(C)Nc1n[nH]c(=S)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G11	compound treatment	1.39	0.106	1.43	1.515	0.0543	0.74	1.533	0.9532	1115521	CBDivE_011651	Nc1ccc(cc1)c2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G12	compound treatment	1.214	-0.0702	-0.95	1.495	0.0343	0.47	-0.3388	-0.321	1920157	CBDivE_011652	Oc1ccc(/C=C/c2cc([nH]c(=O)n2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G13	compound treatment	1.257	-0.0272	-0.37	1.423	-0.0377	-0.51	-0.6229	-0.9862	1920158	CBDivE_011653	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc(cc3)c4cc(nc(n4)c5ccc(cc5)N6C(=O)c7ccc(cc7C6=O)C(=O)O)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G14	compound treatment	1.271	-0.0132	-0.18	1.459	-0.00173	-0.02	-0.1422	-0.794	1920159	CBDivE_011654	COc1ccc(cc1)c2c3C(=O)c4ccccc4C(=O)c3c(c5ccccc5)n2c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G15	compound treatment	1.356	0.0718	0.97	1.537	0.0763	1.04	1.4208	0.9994	1523229	CBDivE_011655	Brc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G16	compound treatment	1.289	0.00484	0.07	1.537	0.0763	1.04	0.7816	0.75	1920160	CBDivE_011656	[O-][N+](=O)c1ccc(NC(=O)c2cccc(F)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G17	compound treatment	1.342	0.0578	0.78	1.534	0.0733	1.0	1.2583	0.9925	1920161	CBDivE_011657	CCOc1ccc2[nH]c(SCC)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G18	compound treatment	1.264	-0.0202	-0.27	1.468	0.00727	0.1	-0.1222	-0.4221	1305258	CBDivE_011658	Fc1ccccc1C(=O)Nc2ccc(Oc3ccc(NC(=O)c4ccccc4F)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G19	compound treatment	1.267	-0.0172	-0.23	1.533	0.0723	0.99	0.5332	0.5267	1920162	CBDivE_011659	Clc1ccc(NCN2C(=O)C(=O)c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	G20	compound treatment	1.295	0.0108	0.15	1.446	-0.0147	-0.2	-0.0386	-0.1554	1632334	CBDivE_011660	CCOC(=O)c1ccccc1NC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H01	compound treatment	1.24	-0.0442	-0.6	1.35	-0.111	-1.51	-1.4889	-0.9173	1920163	CBDivE_011661	Cc1nc2nc(cc(c3ccccc3)n2n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H02	compound treatment	1.266	-0.0182	-0.24	1.451	-0.00973	-0.13	-0.267	-0.9585	1920164	CBDivE_011662	Oc1c(Br)cc(cc1/C=N/Nc2nc3ccccc3s2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H03	compound treatment	1.297	0.0128	0.17	1.421	-0.0397	-0.54	-0.2606	-0.4582	1359646	CBDivE_011663	CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nnc(CC)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H04	compound treatment	1.311	0.0268	0.36	1.429	-0.0317	-0.43	-0.0499	-0.0884	1465297	CBDivE_011664	Cc1ccc(cc1)S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H05	compound treatment	1.221	-0.0632	-0.85	1.43	-0.0307	-0.42	-0.8988	-0.9466	1920165	CBDivE_011665	Cc1cc(C)[n+]2nc(oc2n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H06	compound treatment	1.268	-0.0162	-0.22	1.416	-0.0447	-0.61	-0.5854	-0.9038	1920166	CBDivE_011666	Fc1c(F)c(F)c(/C=N/NC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H07	compound treatment	1.232	-0.0522	-0.7	1.434	-0.0267	-0.36	-0.7553	-0.9531	1920167	CBDivE_011667	Cc1cc(nc2nnnn12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H08	compound treatment	1.277	-0.00716	-0.1	1.461	2.73E-4	0.0	-0.0657	-0.6794	1920168	CBDivE_011668	CC(C)(C)S(=O)(=O)c1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H09	compound treatment	1.248	-0.0362	-0.49	1.425	-0.0357	-0.49	-0.6894	-1.0	1085397	CBDivE_011669	Clc1ccccc1NC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H10	compound treatment	1.267	-0.0172	-0.23	1.458	-0.00273	-0.04	-0.19	-0.8103	1920169	CBDivE_011670	CN1CCc2c1nc3ccccc3c2/N=C/4\CCCN4c5cccc(Cl)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H11	compound treatment	1.383	0.0988	1.33	1.407	-0.0537	-0.73	0.4248	0.2792	1920170	CBDivE_011671	CCCC(=O)NC(NC(=S)Nc1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H12	compound treatment	1.268	-0.0162	-0.22	1.465	0.00427	0.06	-0.113	-0.5006	1920171	CBDivE_011672	Cc1cc(C)[n+]2cccc(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H13	compound treatment	1.339	0.0548	0.74	1.526	0.0653	0.89	1.1525	0.9958	1920172	CBDivE_011673	Cc1nc2cc3N(C(=O)C(F)(F)F)c4nonc4N(C(=O)C(F)(F)F)c3cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H14	compound treatment	1.296	0.0118	0.16	1.482	0.0213	0.29	0.3181	0.9605	1271756	CBDivE_011674	Cc1ccc(cc1)c2nc(I)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H15	compound treatment	1.223	-0.0612	-0.83	1.435	-0.0257	-0.35	-0.8315	-0.9274	1920173	CBDivE_011675	CC1CC(NNc2ccc(Br)cc2)NC(=S)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H16	compound treatment	1.18	-0.104	-1.41	1.464	0.00327	0.04	-0.9621	-0.6843	1920174	CBDivE_011676	CN(C)/C(=N\c1cc(nc2ccccc12)N(C)C)/Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H17	compound treatment	1.24	-0.0442	-0.6	1.508	0.0473	0.64	0.0346	0.0394	1920175	CBDivE_011677	OC(CN1CCOCC1)Cn2c(=O)n(CC(O)CN3CCOCC3)c(=O)n(CC(O)CN4CCOCC4)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H18	compound treatment	1.293	0.00884	0.12	1.395	-0.0657	-0.9	-0.5494	-0.6077	1920176	CBDivE_011678	CN(C)/C(=N/c1c2CCN(C)c2nc3ccccc13)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H19	compound treatment	1.256	-0.0282	-0.38	1.536	0.0753	1.03	0.4572	0.4177	1920177	CBDivE_011679	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	H20	compound treatment	1.266	-0.0182	-0.24	1.453	-0.00773	-0.11	-0.2477	-0.929	1920178	CBDivE_011680	CCOC(=O)Cc1cc(sc1c2ccc(OC)cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I01	compound treatment	1.313	0.0288	0.39	1.431	-0.0297	-0.41	-0.0115	-0.0205	1920179	CBDivE_011681	COc1ccc(OCC(=O)N/N=C/c2ccc(s2)[N+](=O)[O-])c(I)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I02	compound treatment	1.229	-0.0552	-0.74	1.457	-0.00373	-0.05	-0.5621	-0.7536	1920180	CBDivE_011682	O=C(NN=C1C2CC3CC(C2)CC1C3)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I03	compound treatment	1.315	0.0308	0.42	1.495	0.0343	0.47	0.6247	0.9983	1920181	CBDivE_011683	COc1ccc(N/C=C\2/C(=O)N(C(=O)c3cc(OC)ccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I04	compound treatment	1.233	-0.0512	-0.69	1.455	-0.00573	-0.08	-0.5433	-0.7821	1920182	CBDivE_011684	Brc1ccc(NC(=O)c2ccco2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I05	compound treatment	1.315	0.0308	0.42	1.497	0.0363	0.49	0.644	0.9963	1920183	CBDivE_011685	Cc1nc2c([N+](=O)[O-])c(Cl)c(Cl)cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I06	compound treatment	1.25	-0.0342	-0.46	1.463	0.00227	0.03	-0.3039	-0.6581	1153105	CBDivE_011686	Cc1cc(C)c(OCC(O)CN2CCCCC2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I07	compound treatment	1.385	0.101	1.36	1.51	0.0493	0.67	1.4371	0.9471	1920184	CBDivE_011687	Nc1cnc2ccc3nn(nc3c2n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I08	compound treatment	1.279	-0.00516	-0.07	1.506	0.0453	0.62	0.3873	0.6234	1920185	CBDivE_011688	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I09	compound treatment	1.257	-0.0272	-0.37	1.496	0.0353	0.48	0.081	0.134	1920186	CBDivE_011689	COc1ccc(cc1)N2C(=O)/C(=C/Nc3ccccc3)/c4ccc(OC)cc4C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I10	compound treatment	1.356	0.0718	0.97	1.481	0.0203	0.28	0.8808	0.8739	1920187	CBDivE_011690	CCOC(=O)C(=CNc1cccc(O)c1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I11	compound treatment	1.299	0.0148	0.2	1.542	0.0813	1.11	0.9252	0.8215	1920188	CBDivE_011691	COc1ccc2/C(=C\Nc3ccccc3)/C(=O)N(C(=O)c2c1)c4ccccc4OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I12	compound treatment	1.255	-0.0292	-0.39	1.536	0.0753	1.03	0.4476	0.4072	1920189	CBDivE_011692	Cc1cc(C)[n+]2ncsc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I13	compound treatment	1.307	0.0228	0.31	1.495	0.0343	0.47	0.5484	0.9796	1920190	CBDivE_011693	Cc1ccc(/N=C/2\C(=O)Nc3ccc(cc23)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I14	compound treatment	1.326	0.0418	0.56	1.463	0.00227	0.03	0.421	0.7448	1192059	CBDivE_011694	O=C(NCc1ccccc1)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I15	compound treatment	1.355	0.0708	0.96	1.546	0.0853	1.16	1.498	0.9953	1476398	CBDivE_011695	Fc1ccccc1OC(=O)CCCC(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I16	compound treatment	1.31	0.0258	0.35	1.498	0.0373	0.51	0.6059	0.9831	1721700	CBDivE_011696	COc1cccc(c1)C2(CCCC2)c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I17	compound treatment	1.388	0.104	1.4	1.556	0.0953	1.3	1.9092	0.9993	1920191	CBDivE_011697	OC(c1ccc[nH]1)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I18	compound treatment	1.248	-0.0362	-0.49	1.534	0.0733	1.0	0.3616	0.3252	1920192	CBDivE_011698	CCCNC(=O)NC(C)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I19	compound treatment	1.38	0.0958	1.29	1.462	0.00127	0.02	0.9265	0.7165	1920193	CBDivE_011699	COc1ccc2/C(=C\Nc3ccc(C)cc3)/C(=O)N(C(=O)c2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	I20	compound treatment	1.307	0.0228	0.31	1.515	0.0543	0.74	0.7412	0.9246	1920194	CBDivE_011700	Cc1ccc(NC(=O)c2ccccc2F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J01	compound treatment	1.242	-0.0422	-0.57	1.408	-0.0527	-0.72	-0.9106	-0.9933	1920195	CBDivE_011701	CCCCCC(=O)NC(NC(=S)Nc1cccc(C)c1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J02	compound treatment	1.252	-0.0322	-0.43	1.472	0.0113	0.15	-0.1981	-0.4304	1920196	CBDivE_011702	OC(=O)c1ccccc1c2ccccc2C(=O)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J03	compound treatment	1.207	-0.0772	-1.04	1.41	-0.0507	-0.69	-1.2252	-0.9803	1920197	CBDivE_011703	Cc1cc(C)n(CC(=O)O)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J04	compound treatment	1.248	-0.0362	-0.49	1.463	0.00227	0.03	-0.323	-0.6609	1920198	CBDivE_011704	Oc1ccc(NS(=O)(=O)c2ccccc2)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J05	compound treatment	1.245	-0.0392	-0.53	1.462	0.00127	0.02	-0.3613	-0.6835	1920199	CBDivE_011705	CCCCCC(=O)NC(NC(=S)Nc1ccccc1C(=O)OC)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J06	compound treatment	1.233	-0.0512	-0.69	1.373	-0.0877	-1.2	-1.3339	-0.9658	1630387	CBDivE_011706	OC(=O)CCCC(=O)Nc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J07	compound treatment	1.332	0.0478	0.65	1.435	-0.0257	-0.35	0.2083	0.2835	1533512	CBDivE_011707	Cc1cc(Oc2ccccc2)nc3ccc(O)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J08	compound treatment	1.255	-0.0292	-0.39	1.47	0.00927	0.13	-0.1888	-0.4568	1920200	CBDivE_011708	CCCCCn1nc(C)cc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J09	compound treatment	1.221	-0.0632	-0.85	1.461	2.73E-4	0.0	-0.5999	-0.704	1920201	CBDivE_011709	CC(=O)CC(=O)OC1(CCCCC1)C2(CCCCC2)OC(=O)CC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J10	compound treatment	1.221	-0.0632	-0.85	1.447	-0.0137	-0.19	-0.7349	-0.8424	1633126	CBDivE_011710	Cc1nc2cc(ccc2n1C3CCCCC3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J11	compound treatment	1.277	-0.00716	-0.1	1.452	-0.00873	-0.12	-0.1525	-0.9946	1915507	CBDivE_011711	Cc1nn2cc(nc2s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J12	compound treatment	1.23	-0.0542	-0.73	1.454	-0.00673	-0.09	-0.5815	-0.7897	1462828	CBDivE_011712	CCn1c(C)nc2cc(ccc12)S(=O)(=O)NC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J13	compound treatment	1.28	-0.00416	-0.06	1.427	-0.0337	-0.46	-0.3649	-0.7875	1920202	CBDivE_011713	CCOC(=O)C(Cc1ccccc1)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J14	compound treatment	1.238	-0.0462	-0.62	1.394	-0.0667	-0.91	-1.0837	-0.9829	1593154	CBDivE_011714	Cn1c(NC(=O)Cc2ccc(F)cc2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J15	compound treatment	1.249	-0.0352	-0.47	1.485	0.0243	0.33	-0.1014	-0.1752	1167554	CBDivE_011715	CC(=O)Nn1nc2cc3nn[nH]c3cc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J16	compound treatment	1.187	-0.0972	-1.31	1.467	0.00627	0.09	-0.8664	-0.6596	1920203	CBDivE_011716	Oc1ccc(/C=N\NC(=O)CCC(=O)Nc2ccc(Cl)cc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J17	compound treatment	1.234	-0.0502	-0.68	1.466	0.00527	0.07	-0.4276	-0.6284	1417673	CBDivE_011717	Cc1nc2c(N)c(Cl)c(Cl)c(N)c2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J18	compound treatment	1.189	-0.0952	-1.28	1.425	-0.0357	-0.49	-1.2523	-0.912	1920204	CBDivE_011718	Brc1ccc(/C=C/C=N/c2ccc3oc(nc3c2)c4ccncc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J19	compound treatment	1.244	-0.0402	-0.54	1.524	0.0633	0.86	0.227	0.2228	1777886	CBDivE_011719	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc(cc2)c3nc4cc(NC(=O)c5ccccc5[N+](=O)[O-])ccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	J20	compound treatment	1.308	0.0238	0.32	1.477	0.0163	0.22	0.3843	0.9836	1920205	CBDivE_011720	Brc1ccc(/C=C/C=N/c2cccc(c2)c3nc4ccccc4o3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K01	compound treatment	1.261	-0.0232	-0.31	1.477	0.0163	0.22	-0.064	-0.1671	1920206	CBDivE_011721	Cc1cccc(c1)C(=O)NC(NC(=S)Nc2cc(Cl)ccc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K02	compound treatment	1.263	-0.0212	-0.29	1.407	-0.0537	-0.73	-0.7199	-0.9156	1920207	CBDivE_011722	Cc1nc2cc(Br)c(Br)cc2n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K03	compound treatment	1.221	-0.0632	-0.85	1.466	0.00527	0.07	-0.5517	-0.6451	1455181	CBDivE_011723	Cc1ccccc1NS(=O)(=O)c2ccc(Oc3ccc(cc3)S(=O)(=O)Nc4ccccc4C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K04	compound treatment	1.224	-0.0602	-0.81	1.395	-0.0657	-0.9	-1.2077	-0.9988	1920208	CBDivE_011724	[O-][N+](=O)c1ccc(cc1)C(=O)NCCNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K05	compound treatment	1.364	0.0798	1.08	1.514	0.0533	0.73	1.2753	0.9816	1920209	CBDivE_011725	C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K06	compound treatment	1.254	-0.0302	-0.41	1.452	-0.00873	-0.12	-0.3719	-0.8772	1920210	CBDivE_011726	O=C(NNC(=O)c1ccccc1)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K07	compound treatment	1.3	0.0158	0.21	1.442	-0.0187	-0.26	-0.0295	-0.0885	1920211	CBDivE_011727	CN(C(=O)C)c1ccc(/N=C/c2ccc(O)cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K08	compound treatment	1.255	-0.0292	-0.39	1.455	-0.00573	-0.08	-0.3334	-0.8313	1573264	CBDivE_011728	Clc1ccc(NC(=O)c2ccncc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K09	compound treatment	1.278	-0.00616	-0.08	1.487	0.0263	0.36	0.1946	0.529	1920212	CBDivE_011729	Nc1cccc(/C=C/C(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K10	compound treatment	1.329	0.0448	0.6	1.493	0.0323	0.44	0.7389	0.9878	1920213	CBDivE_011730	Fc1ccc(cc1)C(=O)Nc2cc(ccc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K11	compound treatment	1.379	0.0948	1.28	1.482	0.0213	0.29	1.1098	0.846	1421265	CBDivE_011731	CCN(CC)S(=O)(=O)c1cc(ccc1C)C(=O)Nc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K12	compound treatment	1.274	-0.0102	-0.14	1.443	-0.0177	-0.24	-0.2679	-0.9639	1920214	CBDivE_011732	CC(C)c1ccc(C)cc1Oc2cc(N)cc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K13	compound treatment	1.255	-0.0292	-0.39	1.516	0.0553	0.75	0.2548	0.2997	1510082	CBDivE_011733	OC(=O)CCC(=O)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K14	compound treatment	1.234	-0.0502	-0.68	1.48	0.0193	0.26	-0.2927	-0.4031	1920215	CBDivE_011734	[O-][N+](=O)c1ccc(cc1)C(=O)NC(=S)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K15	compound treatment	1.325	0.0408	0.55	1.507	0.0463	0.63	0.8358	0.9977	1920216	CBDivE_011735	OC(=O)[C@@H]1[C@@H](C2CC1C=C2)C(=O)Nc3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K16	compound treatment	1.338	0.0538	0.73	1.492	0.0313	0.43	0.8151	0.9678	1777060	CBDivE_011736	COc1cccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K17	compound treatment	1.293	0.00884	0.12	1.477	0.0163	0.22	0.2412	0.9576	1920217	CBDivE_011737	Cc1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K18	compound treatment	1.289	0.00484	0.07	1.444	-0.0167	-0.23	-0.1151	-0.4852	1707908	CBDivE_011738	COc1ccc(cc1)c2c3C(=O)c4ccccc4C(=O)c3c(c5ccccc5)n2c6ccccc6N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K19	compound treatment	1.353	0.0688	0.93	1.563	0.102	1.39	1.6428	0.9805	1920218	CBDivE_011739	Clc1c(Cl)c(Cl)c(C(=O)OCC#C)c(C(=O)OCC#C)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	K20	compound treatment	1.326	0.0418	0.56	1.569	0.108	1.48	1.4431	0.913	1920219	CBDivE_011740	CC1(C)CC(=O)C=C(C1)Nc2ccccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L01	compound treatment	1.241	-0.0432	-0.58	1.444	-0.0167	-0.23	-0.573	-0.9163	1920220	CBDivE_011741	Cc1ccc(cc1)C(=O)C2(CN3CN4CN(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L02	compound treatment	1.225	-0.0592	-0.8	1.373	-0.0877	-1.2	-1.4102	-0.9806	1920221	CBDivE_011742	COc1ccc2nc(/N=C/c3cc(cc([N+](=O)[O-])c3O)[N+](=O)[O-])oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L03	compound treatment	1.279	-0.00516	-0.07	1.423	-0.0377	-0.51	-0.413	-0.7955	1920222	CBDivE_011743	CCOC(=O)C1=C(C)NC(=S)NC1c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L04	compound treatment	1.239	-0.0452	-0.61	1.388	-0.0727	-0.99	-1.1321	-0.9726	1920223	CBDivE_011744	COc1ccc(cc1Br)c2nc3cc(/N=C/C=C/c4cccc(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L05	compound treatment	1.166	-0.118	-1.59	1.464	0.00327	0.04	-1.0956	-0.687	1052151	CBDivE_011745	Cn1c(c[n+]2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L06	compound treatment	1.268	-0.0162	-0.22	1.381	-0.0797	-1.09	-0.9229	-0.8323	1920224	CBDivE_011746	[O-][N+](=O)c1cc(NC(=O)Cc2ccc(F)cc2)cc(Sc3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L07	compound treatment	1.227	-0.0572	-0.77	1.449	-0.0117	-0.16	-0.6583	-0.836	1920225	CBDivE_011747	Cc1ccc(/N=C/c2cccc3ccccc23)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L08	compound treatment	1.198	-0.0862	-1.16	1.434	-0.0267	-0.36	-1.0796	-0.8863	1920226	CBDivE_011748	Cc1ccccc1c2nc3cc(/N=C/C=C/c4ccc(Br)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L09	compound treatment	1.278	-0.00616	-0.08	1.449	-0.0117	-0.16	-0.1718	-0.9535	1920227	CBDivE_011749	Clc1cc(Cl)c(N2N=C(CC2=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L10	compound treatment	1.252	-0.0322	-0.43	1.387	-0.0737	-1.01	-1.0177	-0.9294	1920228	CBDivE_011750	COc1ccc(/C=C/C(=O)C2=C(CC(C)(C)CC2=O)Nc3cccc4ccccc34)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L11	compound treatment	1.254	-0.0302	-0.41	1.426	-0.0347	-0.47	-0.6226	-0.9971	1920229	CBDivE_011751	CC(=O)/C(=N/Nc1ccccc1)/N=Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L12	compound treatment	1.264	-0.0202	-0.27	1.44	-0.0207	-0.28	-0.3922	-0.9998	1920230	CBDivE_011752	CC(=O)/C(=N/Nc1ccccc1)/C(=N/CC\N=C(/C)\C(=N/Nc2ccccc2)\C(=O)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L13	compound treatment	1.295	0.0108	0.15	1.443	-0.0177	-0.24	-0.0675	-0.239	1920231	CBDivE_011753	OC1CSc2nc3ccccc3n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L14	compound treatment	1.285	8.4E-4	0.01	1.423	-0.0377	-0.51	-0.3558	-0.6914	1920232	CBDivE_011754	CC1(C)C/2CCC1(C)C(=O)\C2=C/NCc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L15	compound treatment	1.27	-0.0142	-0.19	1.387	-0.0737	-1.01	-0.846	-0.8267	1242485	CBDivE_011755	CCc1ccccc1NC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L16	compound treatment	1.236	-0.0482	-0.65	1.412	-0.0487	-0.66	-0.9293	-0.9999	1920233	CBDivE_011756	CCCCNC(=O)O/N=C/C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L17	compound treatment	1.293	0.00884	0.12	1.501	0.0403	0.55	0.4727	0.8411	1920234	CBDivE_011757	COc1cc(OC)cc(c1)C(=O)N(CCCCN2C(=O)c3ccccc3C2=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L18	compound treatment	1.273	-0.0112	-0.15	1.444	-0.0167	-0.23	-0.2677	-0.9797	1920235	CBDivE_011758	Clc1ccc(NC(=O)n2c(=S)oc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L19	compound treatment	1.278	-0.00616	-0.08	1.529	0.0683	0.93	0.5996	0.6414	1920236	CBDivE_011759	Nc1scc[n+]1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	L20	compound treatment	1.239	-0.0452	-0.61	1.463	0.00227	0.03	-0.4089	-0.6703	1920237	CBDivE_011760	O=C(N/N=C/c1ccncc1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M01	compound treatment	1.344	0.0598	0.81	1.424	-0.0367	-0.5	0.2167	0.2281	1920238	CBDivE_011761	CC1(C)CCC(=O)C2=C1OC3=C(C2C=C(Cl)Cl)C(=O)CCC3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M02	compound treatment	1.221	-0.0632	-0.85	1.422	-0.0387	-0.53	-0.9759	-0.9735	1920239	CBDivE_011762	CC(C)(C)C(=O)NC(=S)Nc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M03	compound treatment	1.326	0.0418	0.56	1.457	-0.00373	-0.05	0.3632	0.6408	1301833	CBDivE_011763	Nc1c(Cl)c(Cl)c(N)c2nccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M04	compound treatment	1.223	-0.0612	-0.83	1.455	-0.00573	-0.08	-0.6386	-0.7706	1920240	CBDivE_011764	O=C(Cc1ccccc1)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M05	compound treatment	1.426	0.142	1.91	1.437	-0.0237	-0.32	1.1243	0.5793	1920241	CBDivE_011765	[O-][N+](=O)c1ccc(NC(=O)CCCCCCC(=O)Nc2ccc(cc2Cl)[N+](=O)[O-])c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M06	compound treatment	1.245	-0.0392	-0.53	1.481	0.0203	0.28	-0.1781	-0.2987	1127622	CBDivE_011766	O=C(Nc1nnn[nH]1)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M07	compound treatment	1.326	0.0418	0.56	1.431	-0.0297	-0.41	0.1125	0.1619	1920242	CBDivE_011767	Cc1ccsc1/C=N/NC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M08	compound treatment	1.276	-0.00816	-0.11	1.412	-0.0487	-0.66	-0.5477	-0.8132	1920243	CBDivE_011768	Clc1ccc(cc1)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M09	compound treatment	1.318	0.0338	0.46	1.489	0.0283	0.39	0.5954	0.9965	1777304	CBDivE_011769	Cc1c(cc(cc1[N+](=O)[O-])C(=O)Nc2ccc(cc2)N3CCOCC3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M10	compound treatment	1.265	-0.0192	-0.26	1.468	0.00727	0.1	-0.1126	-0.4069	1920244	CBDivE_011770	Fc1ccc(cc1)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M11	compound treatment	1.358	0.0738	1.0	1.455	-0.00573	-0.08	0.6492	0.6497	1630278	CBDivE_011771	Clc1ccc(NC(=O)Nc2nc(cs2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M12	compound treatment	1.266	-0.0182	-0.24	1.441	-0.0197	-0.27	-0.3635	-0.9989	1475489	CBDivE_011772	OS(=O)c1ccc(cc1)N2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M13	compound treatment	1.291	0.00684	0.09	1.534	0.0733	1.0	0.7718	0.7691	1870138	CBDivE_011773	COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M14	compound treatment	1.263	-0.0212	-0.29	1.453	-0.00773	-0.11	-0.2764	-0.9082	1920245	CBDivE_011774	CN(C)CCOC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M15	compound treatment	1.293	0.00884	0.12	1.491	0.0303	0.41	0.3762	0.8756	1920246	CBDivE_011775	FC(F)(F)c1cccc(NCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M16	compound treatment	1.271	-0.0132	-0.18	1.485	0.0243	0.33	0.1085	0.2889	1920247	CBDivE_011776	Cc1cccc(c1)C(=O)NC(NC(=S)Nc2ccccc2C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M17	compound treatment	1.371	0.0868	1.17	1.498	0.0373	0.51	1.1878	0.9301	1920248	CBDivE_011777	COC(=O)c1ccc(/C=N\NC(=O)C(=O)NCc2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M18	compound treatment	1.276	-0.00816	-0.11	1.497	0.0363	0.49	0.2719	0.5366	1920249	CBDivE_011778	CC(C)(C)c1cc(Br)cc(C=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M19	compound treatment	1.378	0.0938	1.27	1.567	0.106	1.45	1.9199	0.9977	1661840	CBDivE_011779	Cc1ccc(NS(=O)(=O)c2ccc(cc2)C3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	M20	compound treatment	1.316	0.0318	0.43	1.536	0.0753	1.03	1.0295	0.9253	1240749	CBDivE_011780	COc1ccc(NC(=O)C(C(C)C)N2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N01	compound treatment	1.214	-0.0702	-0.95	1.385	-0.0757	-1.03	-1.3995	-0.9991	1920250	CBDivE_011781	CN(/C=C/C=[N+](\C)/c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N02	compound treatment	1.208	-0.0762	-1.03	1.388	-0.0727	-0.99	-1.4278	-0.9998	1920251	CBDivE_011782	CC1(C)N=C/2C(=N1)\C(=N/O)\CC\C2=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N03	compound treatment	1.286	0.00184	0.02	1.401	-0.0597	-0.81	-0.5584	-0.6852	1920252	CBDivE_011783	COc1ccc2/C(=C\Nc3ccc(C)cc3)/C(=O)N(C(=O)c2c1)c4ccccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N04	compound treatment	1.223	-0.0612	-0.83	1.321	-0.14	-1.91	-1.9307	-0.9299	1920253	CBDivE_011784	O=C1N(C(=O)c2ccccc12)c3cc(cc(c3)c4nc5ccccc5o4)c6nc7ccccc7o6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N05	compound treatment	1.288	0.00384	0.05	1.392	-0.0687	-0.94	-0.6261	-0.667	1320296	CBDivE_011785	O=C1CCC(=O)N1CN(CN2C(=O)CCC2=O)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N06	compound treatment	1.27	-0.0142	-0.19	1.364	-0.0967	-1.32	-1.0678	-0.8012	1920254	CBDivE_011786	Cc1c(/C=N/NC(=O)CNc2ccc(C)cc2)c3ccccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N07	compound treatment	1.205	-0.0792	-1.07	1.449	-0.0117	-0.16	-0.8682	-0.804	1920255	CBDivE_011787	Nc1cnc2c3nn(nc3ccc2n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N08	compound treatment	1.194	-0.0902	-1.22	1.384	-0.0767	-1.05	-1.5999	-0.9972	1920256	CBDivE_011788	Clc1cc(Br)cc2=CC(=C(=O)[O+]=c12)C(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N09	compound treatment	1.204	-0.0802	-1.08	1.392	-0.0687	-0.94	-1.4274	-0.9975	1920257	CBDivE_011789	Fc1ccccc1OC(=O)CCCC(=O)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N10	compound treatment	1.245	-0.0392	-0.53	1.434	-0.0267	-0.36	-0.6313	-0.9836	1920258	CBDivE_011790	Cc1cc([N+](=O)[O-])c(C)c(c1)c2ccc(o2)C3Nc4ccc5ccccc5c4C6=C3C(=O)CC(C)(C)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N11	compound treatment	1.235	-0.0492	-0.66	1.407	-0.0537	-0.73	-0.987	-0.9988	1920259	CBDivE_011791	NC(=S)n1nc2ccc3nn(nc3c2n1)C(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N12	compound treatment	1.213	-0.0712	-0.96	1.381	-0.0797	-1.09	-1.4476	-0.9981	1920260	CBDivE_011792	Cc1ccc(OCC(=O)N/N=C/c2cc3OCOc3cc2Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N13	compound treatment	1.286	0.00184	0.02	1.433	-0.0277	-0.38	-0.2498	-0.6593	1920261	CBDivE_011793	Clc1ccc(/N=C/c2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N14	compound treatment	1.23	-0.0542	-0.73	1.435	-0.0257	-0.35	-0.7647	-0.9435	1920262	CBDivE_011794	CCOc1cc(Br)cc(/C=N/NC(=O)COc2c(Br)cc(Br)cc2Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N15	compound treatment	1.246	-0.0382	-0.51	1.41	-0.0507	-0.69	-0.8532	-0.9894	1920263	CBDivE_011795	Oc1cccc(NC(=S)NC(NC(=O)c2ccco2)C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N16	compound treatment	1.285	8.4E-4	0.01	1.413	-0.0477	-0.65	-0.4522	-0.6947	1920264	CBDivE_011796	Brc1cc2OCOc2cc1/C=N/c3ccc4[nH]c(=O)[nH]c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N17	compound treatment	1.212	-0.0722	-0.97	1.436	-0.0247	-0.34	-0.9268	-0.8996	1774497	CBDivE_011797	[O-][N+](=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)NCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N18	compound treatment	1.321	0.0368	0.5	1.418	-0.0427	-0.58	-0.0606	-0.0791	1920265	CBDivE_011798	Oc1ccc2ccccc2c1/C=N/Nc3nc(NCc4ccccc4)nc(n3)N5CCOCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N19	compound treatment	1.245	-0.0392	-0.53	1.543	0.0823	1.12	0.4197	0.3385	3019800	CBDivE_011799	Cc1c(CCN)c2cccc3CCCn1c32.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	N20	compound treatment	1.253	-0.0312	-0.42	1.434	-0.0267	-0.36	-0.555	-0.9975	1920266	CBDivE_011800	C(Nc1nc(N/N=C/c2ccc3OCOc3c2)nc(n1)N4CCOCC4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O01	compound treatment	1.333	0.0488	0.66	1.516	0.0553	0.75	0.9989	0.9978	1920267	CBDivE_011801	Cc1ccc2nc(sc2c1)c3ccc(/N=C/c4ccc(O)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O02	compound treatment	1.224	-0.0602	-0.81	1.469	0.00827	0.11	-0.4941	-0.603	1920268	CBDivE_011802	C[n+]1cc(O)cc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O03	compound treatment	1.197	-0.0872	-1.18	1.502	0.0413	0.56	-0.4335	-0.3325	1920269	CBDivE_011803	COc1ccccc1NC(=S)NC(NC(=O)C(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O04	compound treatment	1.318	0.0338	0.46	1.469	0.00827	0.11	0.4026	0.8561	1699942	CBDivE_011804	Brc1ccc(cc1)C2NC(=O)c3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O05	compound treatment	1.329	0.0448	0.6	1.447	-0.0137	-0.19	0.2954	0.4665	1920270	CBDivE_011805	Cc1ccc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O06	compound treatment	1.24	-0.0442	-0.6	1.413	-0.0477	-0.65	-0.8815	-0.999	1920271	CBDivE_011806	Oc1cccc(/N=C/c2ccc(\C=N\c3cccc(O)c3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O07	compound treatment	1.215	-0.0692	-0.93	1.446	-0.0147	-0.2	-0.8017	-0.8401	1613282	CBDivE_011807	COc1ccc(cc1)C(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O08	compound treatment	1.293	0.00884	0.12	1.477	0.0163	0.22	0.2412	0.9576	1920272	CBDivE_011808	Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O09	compound treatment	1.32	0.0358	0.48	1.436	-0.0247	-0.34	0.1035	0.1755	1920273	CBDivE_011809	CCN(CC)CC(O)Cn1c(=O)n(CC(O)CN(CC)CC)c(=O)n(CC(O)CN(CC)CC)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O10	compound treatment	1.231	-0.0532	-0.72	1.449	-0.0117	-0.16	-0.6202	-0.8441	1920274	CBDivE_011810	Brc1ccc(o1)C(=O)Nn2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O11	compound treatment	1.38	0.0958	1.29	1.474	0.0133	0.18	1.0422	0.7983	1920275	CBDivE_011811	Cc1ccsc1/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O12	compound treatment	1.3	0.0158	0.21	1.48	0.0193	0.26	0.3369	0.9947	1225752	CBDivE_011812	Clc1ccc(C(=O)Nc2ccccn2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O13	compound treatment	1.385	0.101	1.36	1.432	-0.0287	-0.39	0.6849	0.4838	1920276	CBDivE_011813	CC(=O)N1c2nonc2N(C(=O)C)c3cc4[nH]nnc4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O14	compound treatment	1.23	-0.0542	-0.73	1.449	-0.0117	-0.16	-0.6297	-0.8419	1920277	CBDivE_011814	Cc1ccc(NC(=O)c2ccncc2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O15	compound treatment	1.371	0.0868	1.17	1.512	0.0513	0.7	1.3228	0.9696	1920278	CBDivE_011815	COc1ccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O16	compound treatment	1.311	0.0268	0.36	1.471	0.0103	0.14	0.3551	0.9146	1775156	CBDivE_011816	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O17	compound treatment	1.339	0.0548	0.74	1.606	0.145	1.98	1.9239	0.9098	1920279	CBDivE_011817	Oc1cccc2ccc(nc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O18	compound treatment	1.274	-0.0102	-0.14	1.517	0.0563	0.77	0.4457	0.5718	1363780	CBDivE_011818	Clc1ccc(Cl)c(NC(=O)c2cccnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O19	compound treatment	1.392	0.108	1.45	1.539	0.0783	1.07	1.7835	0.9884	1920280	CBDivE_011819	O=C(NCCOC(=O)c1ccccc1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	O20	compound treatment	1.245	-0.0392	-0.53	1.5	0.0393	0.54	0.0051	0.0068	1920281	CBDivE_011820	FC(F)(F)c1cccc(NC(=O)CCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P01	compound treatment	1.246	-0.0382	-0.51	1.452	-0.00873	-0.12	-0.4482	-0.8482	1788994	CBDivE_011821	CC1(C)OC2C3CC1CCC3(C)Oc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P02	compound treatment	1.245	-0.0392	-0.53	1.409	-0.0517	-0.71	-0.8723	-0.9899	1185060	CBDivE_011822	Nc1cc(NC(=O)c2cn(nc2c3ccccc3)c4ccccc4)cc(Oc5ccccc5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P03	compound treatment	1.301	0.0168	0.23	1.348	-0.113	-1.54	-0.9263	-0.5961	1920282	CBDivE_011823	Brc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P04	compound treatment	1.205	-0.0792	-1.07	1.416	-0.0447	-0.61	-1.1864	-0.9647	1260803	CBDivE_011824	Clc1ccc(cc1)C(=O)Nc2cccc(NC(=O)c3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P05	compound treatment	1.251	-0.0332	-0.45	1.419	-0.0417	-0.57	-0.7187	-0.9929	1920283	CBDivE_011825	Cc1ccc(C)c(NC(=S)NC(NC(=O)c2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P06	compound treatment	1.221	-0.0632	-0.85	1.367	-0.0937	-1.28	-1.5063	-0.9806	1920284	CBDivE_011826	Brc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P07	compound treatment	1.217	-0.0672	-0.91	1.392	-0.0687	-0.94	-1.3034	-0.9999	1920285	CBDivE_011827	Cc1nc2cc(Cl)ccc2n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P08	compound treatment	1.246	-0.0382	-0.51	1.396	-0.0647	-0.88	-0.9881	-0.9671	1920286	CBDivE_011828	CCc1nc2cc(/N=C/c3ccc(cc3)[N+](=O)[O-])ccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P09	compound treatment	1.161	-0.123	-1.66	1.33	-0.131	-1.78	-2.4354	-0.9994	1920287	CBDivE_011829	Fc1c(F)c(c(F)c(F)c1n2nnc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P10	compound treatment	0.629	-0.655	-8.84	0.971	-0.49	-6.68	-10.9719	-0.9904	1920288	CBDivE_011830	Cc1nn(c(Cl)c1/C=N/NC(=O)Cc2cccc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P11	compound treatment	1.25	-0.0342	-0.46	1.373	-0.0877	-1.2	-1.1718	-0.914	1913916	CBDivE_011831	Cc1cc(c2ccccc2)[n+]3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P12	compound treatment	1.193	-0.0912	-1.23	1.357	-0.104	-1.41	-1.8698	-0.9976	1212517	CBDivE_011832	CC1(C)CC(=O)c2cnc(NC(=O)c3cccc(F)c3)nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P13	compound treatment	1.22	-0.0642	-0.87	1.398	-0.0627	-0.86	-1.2169	-1.0	1187333	CBDivE_011833	CN1C(=O)C(Cc2ccc3OCOc3c2)C(=O)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P14	compound treatment	1.224	-0.0602	-0.81	1.428	-0.0327	-0.45	-0.8895	-0.9603	1920289	CBDivE_011834	Fc1ccc(CNC=C2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P15	compound treatment	1.32	0.0358	0.48	1.435	-0.0257	-0.35	0.0938	0.157	1649355	CBDivE_011835	CCC(N)C1(CC2CC3CC(O)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P16	compound treatment	1.259	-0.0252	-0.34	1.394	-0.0667	-0.91	-0.8834	-0.9096	1920290	CBDivE_011836	CCOc1ccc(/C=N/NC(=O)C2CCCCC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P17	compound treatment	1.21	-0.0742	-1.0	1.372	-0.0887	-1.21	-1.563	-0.9955	1920291	CBDivE_011837	CN1CCc2c1nc3ccccc3c2/N=C/4\CCCN4Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P18	compound treatment	1.137	-0.147	-1.99	1.477	0.0163	0.22	-1.2469	-0.6242	1920292	CBDivE_011838	CCOC(=O)c1sc(NC(=O)c2ccc(Cl)s2)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P19	compound treatment	1.289	0.00484	0.07	1.477	0.0163	0.22	0.2031	0.878	1541505	CBDivE_011839	Fc1nc(F)c(F)c(c1F)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.37	P20	compound treatment	1.238	-0.0462	-0.62	1.395	-0.0657	-0.9	-1.0741	-0.9842	1175731	CBDivE_011840	Cc1cc(C)nc(NC(=O)c2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A01	compound treatment	1.307	0.023	0.31	1.375	-0.0947	-1.29	-0.6936	-0.5225	1249469	CBDivE_011841	CCC(=O)N1C(C)CC(N(C(=O)C)c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A02	compound treatment	1.365	0.081	1.09	1.43	-0.0397	-0.54	0.39	0.3199	1443033	CBDivE_011842	Cc1cccc2oc(nc12)c3cccc(NC(=O)c4ccc(Cl)cc4Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A03	compound treatment	1.271	-0.013	-0.18	1.584	0.114	1.56	0.9782	0.6234	1920293	CBDivE_011843	COc1cccc(/C=N/NC(=O)CNc2ccc(I)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A04	compound treatment	1.347	0.063	0.85	1.466	-0.00366	-0.05	0.5654	0.6644	1920294	CBDivE_011844	Oc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A05	compound treatment	1.383	0.099	1.34	1.641	0.171	2.34	2.5962	0.9648	1920295	CBDivE_011845	Cc1nn(c(Cl)c1C(=O)NCc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A06	compound treatment	1.284	-3.13E-5	0.0	1.423	-0.0467	-0.64	-0.4502	-0.7076	1708284	CBDivE_011846	O=C(Nc1ccc(NC(=O)C2CCCCC2)cc1)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A07	compound treatment	1.381	0.097	1.31	1.523	0.0533	0.73	1.4393	0.9616	1920296	CBDivE_011847	COCCCN/C(=C/1\C(=NN(C1=O)c2ccc(cc2)[N+](=O)[O-])C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A08	compound treatment	1.373	0.089	1.2	1.548	0.0783	1.07	1.6041	0.9983	1920297	CBDivE_011848	Cc1nn(c(Cl)c1C(=O)N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A09	compound treatment	1.39	0.106	1.43	1.556	0.0863	1.18	1.8434	0.9954	1105396	CBDivE_011849	C1CCc2c(C1)sc3ncn4ncnc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A10	compound treatment	1.363	0.079	1.07	1.459	-0.0107	-0.15	0.6505	0.605	1379616	CBDivE_011850	O=C(Nc1nc2ccccc2n1CCN3CCOCC3)c4cn(nc4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A11	compound treatment	1.341	0.057	0.77	1.529	0.0593	0.81	1.1156	0.9997	1920298	CBDivE_011851	O=C(NCCCCNC(=O)c1cccs1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A12	compound treatment	1.33	0.046	0.62	1.529	0.0593	0.81	1.0107	0.9914	1920299	CBDivE_011852	COCCNC(=C1C(=O)c2ccccc2C1=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A13	compound treatment	1.384	0.1	1.35	1.502	0.0323	0.44	1.2655	0.8919	1920300	CBDivE_011853	CCCCN(C)C(=O)c1ccc(Br)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A14	compound treatment	1.278	-0.00603	-0.08	1.503	0.0333	0.45	0.2639	0.5715	1286927	CBDivE_011854	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A15	compound treatment	1.309	0.025	0.34	1.507	0.0373	0.51	0.5982	0.9799	1920301	CBDivE_011855	C/C(=C/1\C(=NN(C1=O)c2ccc(Br)cc2Br)C)/NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A16	compound treatment	1.283	-0.00103	-0.01	1.45	-0.0197	-0.27	-0.1994	-0.7428	1655313	CBDivE_011856	Cc1ccccc1OCC(=O)Nc2cc(N)cc(Oc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A17	compound treatment	1.459	0.175	2.36	1.515	0.0453	0.62	2.1063	0.8632	1721939	CBDivE_011857	Cc1cc(C)nc(NC(=O)c2sc3ccccc3c2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A18	compound treatment	1.344	0.06	0.81	1.425	-0.0447	-0.61	0.1414	0.1397	1920302	CBDivE_011858	Cc1sc2ncnc(SCC(=O)O)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A19	compound treatment	1.348	0.064	0.86	1.513	0.0433	0.59	1.0281	0.983	1284741	CBDivE_011859	Fc1ccc(cc1)c2csc(NC(=O)COc3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	A20	compound treatment	1.265	-0.019	-0.26	1.461	-0.00866	-0.12	-0.2651	-0.9379	1920303	CBDivE_011860	COc1ccc(cc1Br)c2nc3cc(/N=C/C=C/c4ccccc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B01	compound treatment	1.3	0.016	0.22	1.367	-0.103	-1.4	-0.8376	-0.5913	1920304	CBDivE_011861	O=C(N/N=C(\c1ccccc1)/c2ccncc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B02	compound treatment	1.349	0.065	0.88	1.555	0.0853	1.16	1.4426	0.9902	1920305	CBDivE_011862	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cc(c(Br)cc2Br)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B03	compound treatment	1.329	0.045	0.61	1.458	-0.0117	-0.16	0.3165	0.5047	1920306	CBDivE_011863	CCn1c2ccccc2c3cc(/C=N/NC(=O)COc4ccccc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B04	compound treatment	1.332	0.048	0.65	1.46	-0.00966	-0.13	0.3644	0.5519	1777708	CBDivE_011864	Cc1ccc(cc1)c2nc3cc(NC(=O)c4cccc(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B05	compound treatment	1.306	0.022	0.3	1.463	-0.00666	-0.09	0.1453	0.4689	1671261	CBDivE_011865	C=CCN1CN(C(=O)c2ccccc2)c3sc4CCCCc4c3C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B06	compound treatment	1.252	-0.032	-0.43	1.435	-0.0347	-0.47	-0.6398	-0.999	1920307	CBDivE_011866	Cc1c(cc(cc1[N+](=O)[O-])C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B07	compound treatment	1.295	0.011	0.15	1.482	0.0123	0.17	0.2236	0.9979	1506163	CBDivE_011867	CCOC(=O)c1c(NC(=O)c2ccccc2)sc3c4OCN(CC=C)Cc4ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B08	compound treatment	1.408	0.124	1.67	1.383	-0.0867	-1.18	0.347	0.1694	1777716	CBDivE_011868	CC(C)(C)c1ccc(cc1)c2nc3cc(NC(=O)c4cccc(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B09	compound treatment	1.256	-0.028	-0.38	1.467	-0.00266	-0.04	-0.293	-0.7714	1321994	CBDivE_011869	CCOC(=O)c1c(NC(=O)c2ccccc2)sc(C)c1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B10	compound treatment	1.387	0.103	1.39	1.492	0.0223	0.3	1.1977	0.8422	1920308	CBDivE_011870	COc1ccc(OC)c(NC(=O)c2cc([N+](=O)[O-])c(C)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B11	compound treatment	1.28	-0.00403	-0.05	1.411	-0.0587	-0.8	-0.6041	-0.7534	1920309	CBDivE_011871	Oc1ccc(/C=N/Nc2ncnc3sc4CCCCc4c23)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B12	compound treatment	1.28	-0.00403	-0.05	1.439	-0.0307	-0.42	-0.3341	-0.7924	1920310	CBDivE_011872	COc1cc(ccc1[N+](=O)[O-])C(=O)Nc2ccc(cc2)c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B13	compound treatment	1.35	0.066	0.89	1.385	-0.0847	-1.15	-0.187	-0.1283	1920311	CBDivE_011873	C/C(=N\NC(=O)c1cccc(Br)c1)/c2ccc(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B14	compound treatment	1.247	-0.037	-0.5	1.461	-0.00866	-0.12	-0.4368	-0.8508	1777701	CBDivE_011874	Cc1ccc(cc1NC(=O)c2cc([N+](=O)[O-])c(C)c(c2)[N+](=O)[O-])c3nc4cc(Cl)ccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B15	compound treatment	1.324	0.04	0.54	1.408	-0.0617	-0.84	-0.2133	-0.2135	1920312	CBDivE_011875	COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B16	compound treatment	1.26	-0.024	-0.32	1.447	-0.0227	-0.31	-0.4477	-0.9997	1920313	CBDivE_011876	Brc1cc(Br)c2ncnc3-c4ccccc4C(=O)c1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B17	compound treatment	1.316	0.032	0.43	1.439	-0.0307	-0.42	0.0093	0.0155	1425319	CBDivE_011877	COc1ccc(cc1)c2ncccc2OC(=O)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B18	compound treatment	1.24	-0.044	-0.59	1.473	0.00334	0.05	-0.3878	-0.651	1920314	CBDivE_011878	O=C1C2C(C3C=CC2C4C3C(=O)N(C4=O)c5nccs5)C(=O)N1c6nccs6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B19	compound treatment	1.29	0.00597	0.08	1.367	-0.103	-1.4	-0.933	-0.6653	1434165	CBDivE_011879	CCOC(=O)c1c(NC(=O)C)sc2cc(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	B20	compound treatment	1.22	-0.064	-0.86	1.447	-0.0227	-0.31	-0.8293	-0.904	1920315	CBDivE_011880	Cc1cc(Br)c2C(=O)c3ccccc3-c4nc(nc1c42)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C01	compound treatment	1.34	0.056	0.76	1.42	-0.0497	-0.68	0.0551	0.0543	1920316	CBDivE_011881	Cn1ncc(Br)c1C(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C02	compound treatment	1.29	0.00597	0.08	1.461	-0.00866	-0.12	-0.0266	-0.1859	1920317	CBDivE_011882	Clc1ccc(NC(=O)CCC(=O)N/N=C\c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C03	compound treatment	1.352	0.068	0.92	1.512	0.0423	0.58	1.0566	0.9751	1281083	CBDivE_011883	CCOC(=O)c1c(NC(=O)c2cc(nc3ccccc23)c4ccccc4)sc5CCCCc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C04	compound treatment	1.309	0.025	0.34	1.522	0.0523	0.71	0.7429	0.9413	1920318	CBDivE_011884	Fc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C05	compound treatment	1.267	-0.017	-0.23	1.55	0.0803	1.1	0.6122	0.5469	1152715	CBDivE_011885	Cc1cccc(c1)C(=O)Nc2cccc(c2)c3nc4c(C)cccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C06	compound treatment	1.31	0.026	0.35	1.497	0.0273	0.37	0.5113	0.9995	1920319	CBDivE_011886	Brc1ccc(o1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C07	compound treatment	1.375	0.091	1.23	1.489	0.0193	0.26	1.0543	0.8399	1920320	CBDivE_011887	CC(C)C/C(=N\NC(=O)c1sc2ccccc2c1Cl)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C08	compound treatment	1.298	0.014	0.19	1.465	-0.00466	-0.06	0.0883	0.4441	1008172	CBDivE_011888	O=C(N(C1CCCCC1)C2CCCCC2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C09	compound treatment	1.284	-3.13E-5	0.0	1.55	0.0803	1.1	0.7744	0.7068	1726656	CBDivE_011889	CCOC(=O)c1c(NC(=O)c2cc(nc3ccccc23)c4ccccc4)sc5CC(C)CCc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C10	compound treatment	1.329	0.045	0.61	0.563	-0.907	-12.36	-8.3134	-0.6716	1715907	CBDivE_011890	O=C(N(C1CCCCC1)C2CCCCC2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C11	compound treatment	1.376	0.092	1.24	1.483	0.0133	0.18	1.0059	0.8022	1920321	CBDivE_011891	Cc1[nH]n(c2ccc(Br)cc2Br)c(=O)c1/C=N/CCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C12	compound treatment	1.307	0.023	0.31	1.436	-0.0337	-0.46	-0.1055	-0.1904	1920322	CBDivE_011892	FC(F)(F)c1ccc(Cl)c(NC(=O)c2cccnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C13	compound treatment	1.362	0.078	1.05	1.521	0.0513	0.7	1.2388	0.9804	1473663	CBDivE_011893	CCOc1ccc(NC(=O)c2nn(C)cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C14	compound treatment	1.346	0.062	0.84	1.485	0.0153	0.21	0.7391	0.8576	1117918	CBDivE_011894	CCOc1ccc(Oc2cc(N)cc(Oc3cccnc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C15	compound treatment	1.376	0.092	1.24	1.537	0.0673	0.92	1.5266	0.989	1648193	CBDivE_011895	Clc1ccc(C(=O)Nc2ccncc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C16	compound treatment	1.293	0.00897	0.12	0.543	-0.927	-12.64	-8.8497	-0.7003	1920323	CBDivE_011896	C/C(=N/NC(=O)c1cccnc1)/Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C17	compound treatment	1.368	0.084	1.13	1.515	0.0453	0.62	1.2382	0.9594	1920324	CBDivE_011897	O=C(N/N=C/c1ccco1)c2ccn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C18	compound treatment	1.286	0.00197	0.03	1.477	0.00734	0.1	0.0896	0.8648	1920325	CBDivE_011898	Clc1ccc(C(=O)Nc2nc3ccccc3n2CCN4CCOCC4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C19	compound treatment	1.259	-0.025	-0.34	1.461	-0.00866	-0.12	-0.3223	-0.9009	1920326	CBDivE_011899	Cc1[nH]n(c2ccc(Br)cc2Br)c(=O)c1/C=N/C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	C20	compound treatment	1.278	-0.00603	-0.08	1.46	-0.00966	-0.13	-0.1507	-0.9732	1920327	CBDivE_011900	Oc1ccc(/C=N/NC(=O)Cc2ccccc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D01	compound treatment	1.262	-0.022	-0.3	1.392	-0.0777	-1.06	-0.959	-0.8719	1920328	CBDivE_011901	Oc1c(CC=C)cccc1/C=N/Nc2ncnc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D02	compound treatment	1.276	-0.00803	-0.11	1.388	-0.0817	-1.11	-0.864	-0.7723	1682996	CBDivE_011902	CN1C2CCC1CC(C2)NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D03	compound treatment	1.139	-0.145	-1.96	1.484	0.0143	0.2	-1.2452	-0.6333	1674876	CBDivE_011903	CCOC(=O)c1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D04	compound treatment	1.274	-0.01	-0.14	1.423	-0.0467	-0.64	-0.5456	-0.8387	1920329	CBDivE_011904	C(N1CCN(CC1)c2ccccn2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D05	compound treatment	1.235	-0.049	-0.66	1.453	-0.0167	-0.23	-0.6284	-0.8985	1512931	CBDivE_011905	COc1ccc(Oc2ccc3n4CCNC5CCCc(c54)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D06	compound treatment	1.334	0.05	0.67	1.493	0.0233	0.32	0.7017	0.9413	1239560	CBDivE_011906	CC(C)(C)c1ccc2oc(nc2c1)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D07	compound treatment	1.3	0.016	0.22	1.458	-0.0117	-0.16	0.0399	0.149	1920330	CBDivE_011907	O=C1CCCc2c1[nH]c3ccc(cc23)C4C5CC6CC(C5)CC4C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D08	compound treatment	1.262	-0.022	-0.3	1.42	-0.0497	-0.68	-0.689	-0.9317	1432081	CBDivE_011908	CN1CCN(CC1)C(=O)N2c3ccccc3CCc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D09	compound treatment	1.269	-0.015	-0.2	0.394	-1.08	-14.67	-10.5153	-0.7168	1777456	CBDivE_011909	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D10	compound treatment	1.241	-0.043	-0.58	0.377	-1.09	-14.9	-10.9464	-0.7341	1776827	CBDivE_011910	COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D11	compound treatment	1.235	-0.049	-0.66	1.506	0.0363	0.5	-0.1173	-0.1419	1920331	CBDivE_011911	[O-][N+](=O)c1cccc(/C=N\Nc2ncnc3sc4CCCCc4c23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D12	compound treatment	1.339	0.055	0.74	1.461	-0.00866	-0.12	0.4409	0.5871	1322671	CBDivE_011912	Cc1nn(c(C)c1Sc2ccccc2)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D13	compound treatment	1.388	0.104	1.4	1.44	-0.0297	-0.4	0.7058	0.4835	1294367	CBDivE_011913	C1CCC(C1)c2ccc3n4CCNC5CCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D14	compound treatment	1.271	-0.013	-0.18	1.419	-0.0507	-0.69	-0.6128	-0.8597	1920332	CBDivE_011914	C/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/Cc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D15	compound treatment	1.259	-0.025	-0.34	0.414	-1.06	-14.4	-10.4179	-0.7235	1430581	CBDivE_011915	C1CCC(CC1)c2ccc3n4CCNC5CCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D16	compound treatment	1.302	0.018	0.24	0.346	-1.12	-15.32	-10.6634	-0.6958	1776940	CBDivE_011916	Cc1cc(n(n1)c2ccccc2)n3c(nc4ccccc34)c5ccc(cc5)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D17	compound treatment	1.263	-0.021	-0.28	1.432	-0.0377	-0.51	-0.5638	-0.9609	1703537	CBDivE_011917	O=C(CN1C(=O)c2ccccc2C1=O)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D18	compound treatment	1.249	-0.035	-0.47	1.416	-0.0537	-0.73	-0.8516	-0.9776	1920333	CBDivE_011918	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D19	compound treatment	1.334	0.05	0.67	1.459	-0.0107	-0.15	0.3739	0.5422	1920334	CBDivE_011919	O=C(NNC(=S)NC(=O)C1(CC2CC3CC(C2)C1)C3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	D20	compound treatment	1.262	-0.022	-0.3	1.463	-0.00666	-0.09	-0.2744	-0.8829	1920335	CBDivE_011920	OC(=O)CCCCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E01	compound treatment	1.35	0.066	0.89	1.451	-0.0187	-0.25	0.4494	0.4855	1607331	CBDivE_011921	Cc1cccc(c1)C(=O)Nc2cccc(c2)c3nc4cc(C)ccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E02	compound treatment	1.277	-0.00703	-0.09	1.207	-0.263	-3.58	-2.5998	-0.7256	1920336	CBDivE_011922	O=C(NCCCNC(=O)c1cccs1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E03	compound treatment	1.204	-0.08	-1.08	1.424	-0.0457	-0.62	-1.2037	-0.9658	1920337	CBDivE_011923	Brc1ccc(/C=C/C=N/c2ccc(cc2)c3nc4ccccc4o3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E04	compound treatment	1.277	-0.00703	-0.09	0.446	-1.02	-13.96	-9.9376	-0.7119	1434143	CBDivE_011924	Clc1ccc(C(=O)Nc2nccs2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E05	compound treatment	1.316	0.032	0.43	1.523	0.0533	0.73	0.8193	0.9689	1920338	CBDivE_011925	Clc1c(sc2ccccc12)C(=O)NNC(=O)C3CC4CCC3C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E06	compound treatment	1.247	-0.037	-0.5	1.482	0.0123	0.17	-0.2343	-0.4444	1920339	CBDivE_011926	FC(F)(F)c1ccccc1NC(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E07	compound treatment	1.21	-0.074	-1.0	1.567	0.0973	1.33	0.2324	0.1399	1172992	CBDivE_011927	O=C(Nc1nc2ccccc2s1)C3CC4CCC3C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E08	compound treatment	1.306	0.022	0.3	1.505	0.0353	0.48	0.5503	0.9727	1920340	CBDivE_011928	COCCN/C(=C/1\C(=NN(C1=O)c2ccc(cc2)[N+](=O)[O-])C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E09	compound treatment	1.436	0.152	2.05	0.818	-0.652	-8.89	-4.8339	-0.53	1920341	CBDivE_011929	Cc1ccc(cc1)c2nnc(/N=C\c3c[nH]c4ccccc34)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E10	compound treatment	1.308	0.024	0.32	1.477	0.00734	0.1	0.2994	0.8846	1920342	CBDivE_011930	Brc1ccc(NC(=O)c2cccc3ccccc23)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E11	compound treatment	1.402	0.118	1.59	1.57	0.1	1.37	2.0929	0.9972	1920343	CBDivE_011931	Ic1ccc(NCC(=O)N/N=C/c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E12	compound treatment	1.288	0.00397	0.05	1.479	0.00934	0.13	0.1279	0.9259	1920344	CBDivE_011932	CCOc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E13	compound treatment	1.295	0.011	0.15	1.472	0.00234	0.03	0.1272	0.8403	1671142	CBDivE_011933	Cc1ccc2oc(nc2c1)c3ccc(Br)c(NC(=O)c4cc(Cl)ccc4Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E14	compound treatment	1.254	-0.03	-0.41	1.467	-0.00266	-0.04	-0.3121	-0.7673	1920345	CBDivE_011934	Brc1ccc(o1)C(=O)NCCCCNC(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E15	compound treatment	1.394	0.11	1.48	1.467	-0.00266	-0.04	1.0234	0.6896	1920346	CBDivE_011935	Clc1nc2ccccc2cc1/C=N/NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E16	compound treatment	1.288	0.00397	0.05	1.472	0.00234	0.03	0.0604	0.9694	1920347	CBDivE_011936	Clc1ncccc1NC(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E17	compound treatment	1.352	0.068	0.92	1.518	0.0483	0.66	1.1145	0.9869	1920348	CBDivE_011937	Brc1ccc(/C=C/C=N/c2ccc3oc(nc3c2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E18	compound treatment	1.299	0.015	0.2	1.456	-0.0137	-0.19	0.0111	0.0403	1920349	CBDivE_011938	Clc1ccc(Cl)c(c1)c2nc3cc(/N=C/C=C/c4ccc(Br)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E19	compound treatment	1.334	0.05	0.67	1.541	0.0713	0.97	1.1646	0.9839	1632724	CBDivE_011939	Fc1nc(F)c(F)c(N2C(=O)c3ccccc3C2=O)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	E20	compound treatment	1.335	0.051	0.69	1.486	0.0163	0.22	0.6438	0.8906	1920350	CBDivE_011940	Brc1ccc(o1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F01	compound treatment	1.24	-0.044	-0.59	1.318	-0.152	-2.07	-1.8824	-0.8748	1920351	CBDivE_011941	COc1ccc(/C=N\NC(=O)c2cc(C)n[nH]2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F02	compound treatment	1.235	-0.049	-0.66	1.413	-0.0567	-0.77	-1.0141	-0.997	1920352	CBDivE_011942	CCCCCOc1ccc2c(C)cc(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F03	compound treatment	1.241	-0.043	-0.58	0.399	-1.07	-14.6	-10.7342	-0.7346	1920353	CBDivE_011943	Clc1ccc(OCC(=O)N/N=C/c2cccs2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F04	compound treatment	1.258	-0.026	-0.35	0.375	-1.09	-14.93	-10.8035	-0.7235	1920354	CBDivE_011944	Clc1ccc(cc1)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F05	compound treatment	1.308	0.024	0.32	1.479	0.00934	0.13	0.3187	0.9171	1920355	CBDivE_011945	COc1ccc(/C=N/NC(=O)c2cc(C)n[nH]2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F06	compound treatment	1.26	-0.024	-0.32	1.445	-0.0247	-0.34	-0.467	-0.9998	1728994	CBDivE_011946	CCOC(=O)c1sc(N)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F07	compound treatment	1.317	0.033	0.44	1.405	-0.0647	-0.88	-0.309	-0.3129	1920356	CBDivE_011947	Oc1ccc(cc1)C(=O)N/N=C/c2cccc(CC=C)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F08	compound treatment	1.296	0.012	0.16	1.483	0.0133	0.18	0.2428	0.9982	1373087	CBDivE_011948	O=S(=O)(Nc1ccc(cc1)N2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F09	compound treatment	1.2	-0.084	-1.13	1.497	0.0273	0.37	-0.538	-0.4508	1920357	CBDivE_011949	Brc1cn[nH]c1C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F10	compound treatment	1.285	9.69E-4	0.01	1.46	-0.00966	-0.13	-0.0839	-0.6338	1212954	CBDivE_011950	O=C(OCC1COc2ccccc2O1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F11	compound treatment	1.267	-0.017	-0.23	1.502	0.0323	0.44	0.1494	0.3004	1920358	CBDivE_011951	C/C(=N/NC(=O)c1ccn[nH]1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F12	compound treatment	1.165	-0.119	-1.61	1.42	-0.0497	-0.68	-1.6143	-0.9263	1920359	CBDivE_011952	Cc1ccccc1N/N=C(/C(=O)NN)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F13	compound treatment	1.25	-0.034	-0.46	1.455	-0.0147	-0.2	-0.466	-0.9306	1920360	CBDivE_011953	Cc1ccc(O)c(/C=N/NC(=O)c2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F14	compound treatment	1.229	-0.055	-0.74	1.467	-0.00266	-0.04	-0.5506	-0.7408	1920361	CBDivE_011954	CCOC(=O)C(CC1=CNC2C=CC=CC21)NC(=O)CN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F15	compound treatment	1.297	0.013	0.17	1.487	0.0173	0.24	0.2909	0.989	1920362	CBDivE_011955	OC(=O)c1ccccc1c2ncc(o2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F16	compound treatment	1.259	-0.025	-0.34	1.412	-0.0577	-0.79	-0.7948	-0.9288	1920363	CBDivE_011956	[O-][N+](=O)c1cccc(c1)C(=O)OC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F17	compound treatment	1.218	-0.066	-0.89	1.471	0.00134	0.02	-0.617	-0.6925	1920364	CBDivE_011957	C1CCc2c(C1)sc3ncnc(N/N=C\c4ccc(cc4)c5ccccc5)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F18	compound treatment	1.287	0.00297	0.04	1.481	0.0113	0.15	0.1377	0.8618	1716257	CBDivE_011958	COc1ccccc1Oc2ccc(Oc3ccccc3OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F19	compound treatment	1.262	-0.022	-0.3	1.488	0.0183	0.25	-0.0333	-0.0858	1920365	CBDivE_011959	CCOc1ccc(/C=N/NC(=O)Cc2cccc3ccccc23)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	F20	compound treatment	1.261	-0.023	-0.31	1.411	-0.0587	-0.8	-0.7853	-0.9152	1295304	CBDivE_011960	Cc1ccc(Nc2nc(cs2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G01	compound treatment	1.209	-0.075	-1.01	1.435	-0.0347	-0.47	-1.05	-0.9399	1920366	CBDivE_011961	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3c(nc4ccccn34)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G02	compound treatment	1.232	-0.052	-0.7	1.502	0.0323	0.44	-0.1845	-0.2226	1920367	CBDivE_011962	CC(=C1C(=O)c2ccccc2C1=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G03	compound treatment	1.323	0.039	0.53	1.603	0.133	1.82	1.6575	0.8757	1920368	CBDivE_011963	FC1(Cl)C2CC(/C=N/NC(=O)c3ccncc3)C(C2)C1(F)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G04	compound treatment	1.304	0.02	0.27	1.55	0.0803	1.1	0.9652	0.8555	1049724	CBDivE_011964	COc1ccc(cc1)C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G05	compound treatment	1.257	-0.027	-0.36	1.435	-0.0347	-0.47	-0.5921	-0.9918	1114184	CBDivE_011965	OC1(CCCCC1)C#CC#CC2(O)CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G06	compound treatment	1.295	0.011	0.15	1.447	-0.0227	-0.31	-0.1139	-0.3323	1483901	CBDivE_011966	Nc1cc(Oc2ccccc2)cc(Oc3cccnc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G07	compound treatment	1.341	0.057	0.77	1.519	0.0493	0.67	1.0192	0.9978	1638777	CBDivE_011967	O=C1C2C3C=CC(C2C(=O)N1c4cccc5ccccc45)C63CC6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G08	compound treatment	1.28	-0.00403	-0.05	1.493	0.0233	0.32	0.1866	0.5779	1920369	CBDivE_011968	C/C(=N/NC(=O)c1ccccc1)/Cc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G09	compound treatment	1.211	-0.073	-0.99	1.657	0.187	2.55	1.1097	0.4053	1920370	CBDivE_011969	COc1cc(/C=N/c2ccc3oc(nc3c2)c4ccc5ccccc5c4)ccc1OC(=O)c6ccc(Cl)cc6Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G10	compound treatment	1.284	-3.13E-5	0.0	1.536	0.0663	0.9	0.6394	0.7068	1313414	CBDivE_011970	O=C(OC(CN1CCOCC1)CN2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G11	compound treatment	1.384	0.1	1.35	1.527	0.0573	0.78	1.5065	0.9664	1603072	CBDivE_011971	Cc1ccccc1OCC(=O)Nc2nc3ccccc3n2CCN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G12	compound treatment	1.198	-0.086	-1.16	1.459	-0.0107	-0.15	-0.9235	-0.7895	1180706	CBDivE_011972	CC1(C)C(CCC1(C)C(=O)O)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G13	compound treatment	1.268	-0.016	-0.22	1.527	0.0573	0.78	0.4	0.493	1354200	CBDivE_011973	COc1ccc(C)cc1NC(=O)c2nn(C)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G14	compound treatment	1.279	-0.00503	-0.07	1.489	0.0193	0.26	0.1385	0.5085	1920371	CBDivE_011974	Clc1ccccc1/C=C/2\SC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G15	compound treatment	1.382	0.098	1.32	1.507	0.0373	0.51	1.2946	0.914	1920372	CBDivE_011975	Cc1ccc(NC(=O)c2ccc(Br)o2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G16	compound treatment	1.283	-0.00103	-0.01	1.515	0.0453	0.62	0.4273	0.691	1920373	CBDivE_011976	COC(=O)c1ccc(NSc2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G17	compound treatment	1.308	0.024	0.32	1.526	0.0563	0.77	0.7719	0.926	1920374	CBDivE_011977	COc1ccc(NC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G18	compound treatment	1.255	-0.029	-0.39	1.474	0.00434	0.06	-0.2351	-0.5935	1014409	CBDivE_011978	Cc1ccc(NSc2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G19	compound treatment	1.264	-0.02	-0.27	1.48	0.0103	0.14	-0.0914	-0.2998	1920375	CBDivE_011979	CC(=O)c1sc(NC(=O)c2ccco2)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	G20	compound treatment	1.32	0.036	0.49	1.459	-0.0107	-0.15	0.2403	0.4744	1460238	CBDivE_011980	Cc1cccc(NC(=O)COc2cccc(C)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H01	compound treatment	1.258	-0.026	-0.35	1.326	-0.144	-1.96	-1.6336	-0.8208	1593696	CBDivE_011981	CN(C)N1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H02	compound treatment	1.265	-0.019	-0.26	1.463	-0.00666	-0.09	-0.2458	-0.9024	1108481	CBDivE_011982	O=C(Nc1ccccc1)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H03	compound treatment	1.308	0.024	0.32	1.49	0.0203	0.28	0.4248	0.9971	1920376	CBDivE_011983	Cc1n[nH]c(C(=O)N/N=C\c2c(O)ccc3ccccc23)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H04	compound treatment	1.298	0.014	0.19	1.402	-0.0677	-0.92	-0.5192	-0.5513	1920377	CBDivE_011984	CCCOC(=O)COc1cc(=O)oc2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H05	compound treatment	1.223	-0.061	-0.82	1.459	-0.0107	-0.15	-0.685	-0.8193	1920378	CBDivE_011985	Clc1c(Cl)c(Cl)c(Sc2c(nc3ccccn23)c4ccccc4)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H06	compound treatment	1.258	-0.026	-0.35	1.43	-0.0397	-0.54	-0.6307	-0.9781	1517376	CBDivE_011986	O=C(CCc1ccccc1)Nc2ccc(cc2)c3ccc(NC(=O)CCc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H07	compound treatment	1.223	-0.061	-0.82	1.44	-0.0297	-0.4	-0.8682	-0.9464	1920379	CBDivE_011987	Cc1ccc(NC(NC(=O)Nc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H08	compound treatment	1.277	-0.00703	-0.09	1.412	-0.0577	-0.79	-0.6231	-0.7867	1579006	CBDivE_011988	O=C(CC1(C(=O)c2ccccc2C1=O)c3ccncc3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H09	compound treatment	1.239	-0.045	-0.61	1.464	-0.00566	-0.08	-0.4841	-0.7906	1920380	CBDivE_011989	CCOc1ccc(NC(NC(=O)Nc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H10	compound treatment	1.284	-3.13E-5	0.0	1.516	0.0463	0.63	0.4465	0.7066	1920381	CBDivE_011990	OC(=O)COc1cc(=O)oc2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H11	compound treatment	1.373	0.089	1.2	1.4	-0.0697	-0.95	0.177	0.1156	1920382	CBDivE_011991	ClC(Cl)(Cl)C(NC(=O)Nc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H12	compound treatment	1.249	-0.035	-0.47	1.472	0.00234	0.03	-0.3116	-0.6579	1920383	CBDivE_011992	NC(=O)COc1cc(=O)oc2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H13	compound treatment	1.347	0.063	0.85	1.518	0.0483	0.66	1.0668	0.9921	1317342	CBDivE_011993	CC(=O)Nc1ccc(NC(=O)C(C(C(=O)O)C(=O)Oc2ccccc2)C(=O)Oc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H14	compound treatment	1.278	-0.00603	-0.08	1.438	-0.0317	-0.43	-0.3628	-0.8258	1920384	CBDivE_011994	CC(=O)Oc1ccccc1C(=O)OCCNC(=O)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H15	compound treatment	1.235	-0.049	-0.66	1.457	-0.0127	-0.17	-0.5898	-0.8628	1920385	CBDivE_011995	CCCCOC(=O)c1ccc(NC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H16	compound treatment	1.247	-0.037	-0.5	1.481	0.0113	0.15	-0.2439	-0.4664	1920386	CBDivE_011996	Cc1ccc(N/N=C(/N=Nc2ccc(C)cc2)\c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H17	compound treatment	1.276	-0.00803	-0.11	1.48	0.0103	0.14	0.0231	0.1298	1597454	CBDivE_011997	OC(=O)C(C(C(=O)Nc1ccc(Cl)cc1)C(=O)Oc2ccccc2)C(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H18	compound treatment	1.32	0.036	0.49	1.4	-0.0697	-0.95	-0.3286	-0.308	1920387	CBDivE_011998	CCC(Oc1ccc(cc1C(C)(C)CC)C(C)(C)CC)C(=O)Nc2ccc(cc2O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H19	compound treatment	1.284	-3.13E-5	0.0	1.504	0.0343	0.47	0.3308	0.7065	1920388	CBDivE_011999	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	H20	compound treatment	1.282	-0.00203	-0.03	1.433	-0.0367	-0.5	-0.3729	-0.7448	1920389	CBDivE_012000	CCOC(=O)c1c(NC(=O)c2ccccc2)sc3/C(=N\OC(=O)C)/CCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I01	compound treatment	1.321	0.037	0.5	1.597	0.127	1.74	1.5805	0.8748	1920390	CBDivE_012001	[O-][N+](=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I02	compound treatment	1.234	-0.05	-0.67	1.592	0.122	1.67	0.7024	0.3903	1920391	CBDivE_012002	CC(C)c1ccc(C)cc1OCC(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I03	compound treatment	1.269	-0.015	-0.2	0.724	-0.746	-10.17	-7.3334	-0.7211	1920392	CBDivE_012003	Clc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I04	compound treatment	1.239	-0.045	-0.61	1.494	0.0243	0.33	-0.1949	-0.2815	1336949	CBDivE_012004	Cn1c2C(=O)CCc2c3cc(ccc13)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I05	compound treatment	1.266	-0.018	-0.24	1.509	0.0393	0.54	0.2073	0.352	1302225	CBDivE_012005	CCOC(=O)c1c(NC(=O)c2ccncc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I06	compound treatment	1.285	9.69E-4	0.01	1.476	0.00634	0.09	0.0704	0.8048	1346624	CBDivE_012006	C1CCC(CC1)c2ccc3n4CCN=C5CCCc(c54)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I07	compound treatment	1.414	0.13	1.75	1.553	0.0833	1.14	2.0434	0.978	1360922	CBDivE_012007	Cc1cc(=O)n2ccc(CN3CCOCC3)c(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I08	compound treatment	1.269	-0.015	-0.2	1.524	0.0543	0.74	0.3806	0.4954	1920393	CBDivE_012008	CCOC(=O)c1oc2ccc(/C=N/CCO)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I09	compound treatment	1.276	-0.00803	-0.11	1.585	0.115	1.57	1.0355	0.6568	1714420	CBDivE_012009	Cc1ccc(NC(=O)c2ccc(Br)o2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I10	compound treatment	1.302	0.018	0.24	1.478	0.00834	0.11	0.2518	0.9405	1353277	CBDivE_012010	CCOC(=O)c1[nH]c2CCC(=C(Sc3ccccc3)c2c1C)C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I11	compound treatment	1.302	0.018	0.24	1.535	0.0653	0.89	0.8014	0.8679	1920394	CBDivE_012011	Ic1ccc(NCC(=O)N/N=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I12	compound treatment	1.264	-0.02	-0.27	1.497	0.0273	0.37	0.0725	0.1575	1920395	CBDivE_012012	CCOC(=O)c1oc2ccc(/C=N\C3CCCCC3)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I13	compound treatment	1.294	0.00997	0.13	1.484	0.0143	0.2	0.2334	0.9833	1226265	CBDivE_012013	O=c1c(coc2ccccc12)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I14	compound treatment	1.322	0.038	0.51	1.48	0.0103	0.14	0.4619	0.8694	1920396	CBDivE_012014	CCOC(=O)c1oc2ccc(/C=N/CC=C)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I15	compound treatment	1.347	0.063	0.85	1.538	0.0683	0.93	1.2596	0.9989	1920397	CBDivE_012015	C/C(=C/1\C(=NN(C1=O)c2ccc(Br)cc2Br)C)/NCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I16	compound treatment	1.299	0.015	0.2	1.476	0.00634	0.09	0.2039	0.9283	1155755	CBDivE_012016	CC(=O)Nc1cccc2c1sc3nc4CCCCCn4c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I17	compound treatment	1.395	0.111	1.5	1.538	0.0683	0.93	1.7175	0.974	1920398	CBDivE_012017	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc(NC(=O)c3cc(OC)c(OC)c(OC)c3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I18	compound treatment	1.259	-0.025	-0.34	1.494	0.0243	0.33	-0.0041	-0.0086	1920399	CBDivE_012018	CCOC(=O)c1oc2ccc(/C=N/C(C)(C)C)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I19	compound treatment	1.398	0.114	1.54	1.464	-0.00566	-0.08	1.0326	0.6708	1920400	CBDivE_012019	Clc1ccccc1/C=N/NC(=O)CNc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	I20	compound treatment	1.331	0.047	0.63	1.474	0.00434	0.06	0.4899	0.7698	1064718	CBDivE_012020	CCOC(=O)c1c(C)c(C)sc1NS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J01	compound treatment	1.258	-0.026	-0.35	1.492	0.0223	0.3	-0.0329	-0.0708	1920401	CBDivE_012021	CC(C)NC(=O)C(OC(=O)c1ccccc1)C(OC(=O)c2ccccc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J02	compound treatment	1.253	-0.031	-0.42	1.476	0.00634	0.09	-0.2349	-0.5495	1208107	CBDivE_012022	CCOC(=O)c1c(NC(=O)c2ccccc2)sc3c(O)cccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J03	compound treatment	1.205	-0.079	-1.07	1.406	-0.0637	-0.87	-1.3677	-0.9948	1920402	CBDivE_012023	CCOC(=O)C1=NN(C(=NN1c2ccc(cc2)[N+](=O)[O-])C(=O)OCC)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J04	compound treatment	1.254	-0.03	-0.41	1.452	-0.0177	-0.24	-0.4568	-0.9691	1393347	CBDivE_012024	CCOC(=O)c1c(NC(=O)c2ccc(Cl)cc2)sc3C(O)CCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J05	compound treatment	1.249	-0.035	-0.47	1.453	-0.0167	-0.23	-0.4948	-0.9437	1920403	CBDivE_012025	CCOC(=O)/C(=N/Nc1ccccc1)/c2csc(Nc3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J06	compound treatment	1.244	-0.04	-0.54	1.394	-0.0757	-1.03	-1.1114	-0.9544	1920404	CBDivE_012026	CCCCNC(=O)c1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J07	compound treatment	1.325	0.041	0.55	1.463	-0.00666	-0.09	0.3266	0.5831	1920405	CBDivE_012027	OC(=O)c1c(nn(c1C(=O)O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J08	compound treatment	1.291	0.00697	0.09	1.458	-0.0117	-0.16	-0.046	-0.2488	1395983	CBDivE_012028	OC(=O)CSc1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J09	compound treatment	1.256	-0.028	-0.38	1.459	-0.0107	-0.15	-0.3702	-0.9137	1586316	CBDivE_012029	Oc1cc2oc(=O)cc(c3ccccc3)c2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J10	compound treatment	1.269	-0.015	-0.2	1.482	0.0123	0.17	-0.0244	-0.0926	1920406	CBDivE_012030	CCOC(=O)c1c(NC(=O)CC)sc2C(=O)C(Br)CCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J11	compound treatment	1.294	0.00997	0.13	1.466	-0.00366	-0.05	0.0598	0.4169	1920407	CBDivE_012031	Oc1ccc(/C=N/NC(=O)c2cccnc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J12	compound treatment	1.233	-0.051	-0.69	1.497	0.0273	0.37	-0.2232	-0.2851	1920408	CBDivE_012032	OCc1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J13	compound treatment	1.281	-0.00303	-0.04	1.453	-0.0167	-0.23	-0.1896	-0.8212	1284839	CBDivE_012033	Clc1ccccc1S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J14	compound treatment	1.237	-0.047	-0.63	1.393	-0.0767	-1.05	-1.1878	-0.9714	1146830	CBDivE_012034	CCOC(=O)c1c(NC(=O)C)sc2C(=O)CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J15	compound treatment	1.256	-0.028	-0.38	1.459	-0.0107	-0.15	-0.3702	-0.9137	1191014	CBDivE_012035	Cc1ccccc1NC(=O)c2nccnc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J16	compound treatment	1.175	-0.109	-1.47	1.443	-0.0267	-0.36	-1.2972	-0.8561	1920409	CBDivE_012036	N=C1N(Cc2ccccc12)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J17	compound treatment	1.238	-0.046	-0.62	1.471	0.00134	0.02	-0.4262	-0.686	1920410	CBDivE_012037	CN(C)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J18	compound treatment	1.19	-0.094	-1.27	1.393	-0.0767	-1.05	-1.6362	-0.9954	1775163	CBDivE_012038	COc1ccc(cc1)N(C(C)C2CC2)C(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J19	compound treatment	1.272	-0.012	-0.16	1.485	0.0153	0.21	0.0331	0.1252	1920411	CBDivE_012039	CCN(Cc1ccccc1)c2ccc(N=Nc3nc4ccc(OC)cc4s3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	J20	compound treatment	1.309	0.025	0.34	1.458	-0.0117	-0.16	0.1258	0.3376	1920412	CBDivE_012040	Fc1c(F)c(Oc2ccc(C=O)cc2)c(F)c(F)c1Oc3ccc(C=O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K01	compound treatment	1.196	-0.088	-1.19	1.462	-0.00766	-0.1	-0.9136	-0.7663	1920413	CBDivE_012041	C/C(=C/1\C(=NN(C1=O)c2ccc(Br)cc2Br)C)/NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K02	compound treatment	1.264	-0.02	-0.27	1.525	0.0553	0.75	0.3425	0.4273	1627987	CBDivE_012042	CCOC(=O)c1c(NC(=O)C)sc2C(=O)NCCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K03	compound treatment	1.232	-0.052	-0.7	1.447	-0.0227	-0.31	-0.7148	-0.9321	1671195	CBDivE_012043	O=C(Nc1cccc(NC(=O)c2ccc3OCOc3c2)n1)c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K04	compound treatment	1.231	-0.053	-0.72	1.469	-6.6E-4	-0.01	-0.5122	-0.7159	1190990	CBDivE_012044	O=C1C(CCc2c1sc3nc4CCCCCn4c(=O)c23)Sc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K05	compound treatment	1.384	0.1	1.35	1.528	0.0583	0.8	1.5162	0.9683	1920414	CBDivE_012045	CC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K06	compound treatment	1.273	-0.011	-0.15	1.462	-0.00766	-0.1	-0.1791	-0.985	1708671	CBDivE_012046	CN(C)Cc1ccc2c(sc3nc4CCCCCn4c(=O)c23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K07	compound treatment	1.304	0.02	0.27	1.511	0.0413	0.56	0.5891	0.9429	1349942	CBDivE_012047	Cc1cccc(NC(=O)c2ccc(Br)o2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K08	compound treatment	1.257	-0.027	-0.36	1.488	0.0183	0.25	-0.081	-0.1832	1429206	CBDivE_012048	O=C1CCc2c1[nH]c3ccc(cc23)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K09	compound treatment	1.26	-0.024	-0.32	1.671	0.201	2.75	1.7122	0.6193	1483303	CBDivE_012049	Clc1ccc(cc1)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K10	compound treatment	1.273	-0.011	-0.15	1.511	0.0413	0.56	0.2934	0.5032	1663584	CBDivE_012050	CC(C)c1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K11	compound treatment	1.366	0.082	1.11	1.493	0.0233	0.32	1.007	0.8751	1634794	CBDivE_012051	Nc1cc(NC(=O)c2cn(nc2c3ccccc3)c4ccccc4)cc(Oc5cccnc5)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K12	compound treatment	1.251	-0.033	-0.45	1.48	0.0103	0.14	-0.2154	-0.4608	1187633	CBDivE_012052	O=C1CCCCc2c1[nH]c3ccc(cc23)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K13	compound treatment	1.201	-0.083	-1.12	1.584	0.114	1.56	0.3104	0.1617	1920415	CBDivE_012053	C/C(=N\NC(=O)c1sc2ccccc2c1Cl)/Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K14	compound treatment	1.217	-0.067	-0.9	1.474	0.00434	0.06	-0.5976	-0.6594	1920416	CBDivE_012054	CCOC(=O)c1oc2ccc(/C=N\O)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K15	compound treatment	1.369	0.085	1.15	1.526	0.0563	0.77	1.3538	0.9811	1427600	CBDivE_012055	O=C(COc1ccccc1)Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K16	compound treatment	1.298	0.014	0.19	1.513	0.0433	0.59	0.5512	0.8885	1920417	CBDivE_012056	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccc(Cl)cc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K17	compound treatment	1.299	0.015	0.2	1.538	0.0683	0.93	0.8018	0.8408	1920418	CBDivE_012057	Brc1ccc(o1)C(=O)Nc2ccc(Br)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K18	compound treatment	1.308	0.024	0.32	1.437	-0.0327	-0.45	-0.0863	-0.1568	1920419	CBDivE_012058	Clc1ccc(cc1)S(=O)(=O)C(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K19	compound treatment	1.334	0.05	0.67	1.558	0.0883	1.2	1.3285	0.9624	1920420	CBDivE_012059	Cc1[nH]n(c2ccc(Br)cc2Br)c(=O)c1/C=N/Cc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	K20	compound treatment	1.331	0.047	0.63	1.526	0.0563	0.77	0.9913	0.9954	1920421	CBDivE_012060	O=C(NNC(=O)c1cccnc1)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L01	compound treatment	1.269	-0.015	-0.2	1.417	-0.0527	-0.72	-0.6512	-0.8727	1662647	CBDivE_012061	CCOC(=O)NC(=S)Nc1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L02	compound treatment	1.246	-0.038	-0.51	1.373	-0.0967	-1.32	-1.2948	-0.9154	1396180	CBDivE_012062	CC(C1CC1)N(C(=O)c2ccccc2O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L03	compound treatment	1.296	0.012	0.16	1.45	-0.0197	-0.27	-0.0754	-0.2409	1529900	CBDivE_012063	CCOc1ccc(NC(=O)c2cc3ccccc3cc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L04	compound treatment	1.222	-0.062	-0.84	1.41	-0.0597	-0.81	-1.167	-0.9999	1704135	CBDivE_012064	CC1(C)C(CCC1(C)C(=O)O)C(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L05	compound treatment	1.174	-0.11	-1.48	1.466	-0.00366	-0.05	-1.0849	-0.7305	1576144	CBDivE_012065	CCc1ccc(cc1)c2nc3cc(NC(=O)c4ccccc4Cl)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L06	compound treatment	1.262	-0.022	-0.3	1.392	-0.0777	-1.06	-0.959	-0.8719	1426728	CBDivE_012066	c1ccc(cc1)c2[nH]c3ccccc3c2c4nc5ccccc5[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L07	compound treatment	1.209	-0.075	-1.01	1.459	-0.0107	-0.15	-0.8185	-0.8004	1920422	CBDivE_012067	Brc1ccc(cc1)c2csc(NN=C3c4ccccc4-c5ccccc35)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L08	compound treatment	1.223	-0.061	-0.82	1.438	-0.0317	-0.43	-0.8875	-0.9546	1310945	CBDivE_012068	CCOC(=O)c1c(NC(=O)C)sc2c(O)c(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L09	compound treatment	1.254	-0.03	-0.41	1.457	-0.0127	-0.17	-0.4086	-0.9277	1180786	CBDivE_012069	Cc1ccc(cc1)S(=O)(=O)NC(=O)Oc2cc(cc(c2)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L10	compound treatment	1.258	-0.026	-0.35	1.417	-0.0527	-0.72	-0.7561	-0.9459	1464490	CBDivE_012070	COc1cc2ccccc2cc1C(=O)Nc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L11	compound treatment	1.246	-0.038	-0.51	1.454	-0.0157	-0.21	-0.5138	-0.9245	1920423	CBDivE_012071	[O-][N+](=O)c1ccc(cc1)c2csc(NN=C3c4ccccc4-c5ccccc35)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L12	compound treatment	1.26	-0.024	-0.32	1.441	-0.0287	-0.39	-0.5056	-0.9957	1920424	CBDivE_012072	C/C(=N\NC(=O)C1COc2ccccc2O1)/c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L13	compound treatment	1.302	0.018	0.24	1.436	-0.0337	-0.46	-0.1532	-0.2951	1671481	CBDivE_012073	O=C(NN1C(=O)C2C3CC(C=C3)C2C1=O)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L14	compound treatment	1.288	0.00397	0.05	1.438	-0.0317	-0.43	-0.2674	-0.6147	1285025	CBDivE_012074	CCOC(=O)c1c(NC(=O)c2ccco2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L15	compound treatment	1.283	-0.00103	-0.01	1.426	-0.0437	-0.6	-0.4308	-0.7234	1920425	CBDivE_012075	COc1ccc(/N=C/c2c(O)ccc3ccccc23)c4ncccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L16	compound treatment	1.25	-0.034	-0.46	1.436	-0.0337	-0.46	-0.6492	-1.0	1607762	CBDivE_012076	COc1cc2ccccc2cc1C(=O)Nc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L17	compound treatment	1.297	0.013	0.17	1.493	0.0233	0.32	0.3488	0.9603	1362099	CBDivE_012077	Cc1ccc(cc1)S(=O)(=O)Nn2cnnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L18	compound treatment	1.274	-0.01	-0.14	1.421	-0.0487	-0.66	-0.5649	-0.8341	1033103	CBDivE_012078	CCOc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L19	compound treatment	1.271	-0.013	-0.18	1.502	0.0323	0.44	0.1875	0.395	1920426	CBDivE_012079	CC(NC(=O)c1ccc(N)c(c1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	L20	compound treatment	1.226	-0.058	-0.78	1.442	-0.0277	-0.38	-0.8203	-0.9439	1920427	CBDivE_012080	COCCCNC(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M01	compound treatment	1.35	0.066	0.89	1.679	0.209	2.85	2.6478	0.8855	1920428	CBDivE_012081	COc1cccc(NC(=O)c2ccc(Br)o2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M02	compound treatment	1.239	-0.045	-0.61	1.549	0.0793	1.08	0.3355	0.2704	1578809	CBDivE_012082	CCOC(=O)c1ccc(NC(=O)COc2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M03	compound treatment	1.192	-0.092	-1.24	1.55	0.0803	1.1	-0.1032	-0.0624	1920429	CBDivE_012083	Clc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M04	compound treatment	1.207	-0.077	-1.04	1.582	0.112	1.53	0.3484	0.1882	1920430	CBDivE_012084	CCC(=O)NC(NC(=O)CC)C(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M05	compound treatment	1.437	0.153	2.06	1.465	-0.00466	-0.06	1.4143	0.685	1920431	CBDivE_012085	Oc1ccc2ccccc2c1/C=N/NC(=O)CNc3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M06	compound treatment	1.24	-0.044	-0.59	1.496	0.0263	0.36	-0.166	-0.2392	1920432	CBDivE_012086	CCCc1ccc(OCC(=O)Nc2cc(ccc2C)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M07	compound treatment	1.359	0.075	1.01	1.5	0.0303	0.41	1.0077	0.9222	1920433	CBDivE_012087	[O-][N+](=O)c1cccc(NC(=O)c2ccc(Br)o2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M08	compound treatment	1.244	-0.04	-0.54	1.45	-0.0197	-0.27	-0.5714	-0.9478	1920434	CBDivE_012088	CCCc1ccc(OCC(=O)Nc2ccc(C)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M09	compound treatment	1.315	0.031	0.42	1.592	0.122	1.67	1.4751	0.8577	1920435	CBDivE_012089	C/C(=N\NC(=O)C1CCCCC1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M10	compound treatment	1.277	-0.00703	-0.09	1.495	0.0253	0.35	0.1773	0.4947	1920436	CBDivE_012090	Cc1ccc(NC(=O)/C=C/c2ccccc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M11	compound treatment	1.383	0.099	1.34	1.462	-0.00766	-0.1	0.8702	0.6498	1920437	CBDivE_012091	OC(C(=O)N1CCCCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M12	compound treatment	1.287	0.00297	0.04	1.432	-0.0377	-0.51	-0.3348	-0.65	1920438	CBDivE_012092	Clc1ccc(cc1)S(=O)(=O)Nc2cc(Br)c(NS(=O)(=O)c3ccc(Cl)cc3)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M13	compound treatment	1.292	0.00797	0.11	1.524	0.0543	0.74	0.6	0.8013	1920439	CBDivE_012093	Clc1ccc(cc1Cl)c2nc3cc(/N=C/C=C/c4ccc(Br)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M14	compound treatment	1.301	0.017	0.23	1.457	-0.0127	-0.17	0.0398	0.1388	1920440	CBDivE_012094	Oc1ccccc1NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M15	compound treatment	1.274	-0.01	-0.14	1.467	-0.00266	-0.04	-0.1213	-0.8661	1920441	CBDivE_012095	CC(=O)c1sc(NC(=O)C2CCCCC2)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M16	compound treatment	1.28	-0.00403	-0.05	1.464	-0.00566	-0.08	-0.093	-0.9853	1920442	CBDivE_012096	Oc1ccccc1NS(=O)(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M17	compound treatment	1.355	0.071	0.96	1.541	0.0713	0.97	1.3649	1.0	1622305	CBDivE_012097	Fc1ccc2c(Cl)c(sc2c1)C(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M18	compound treatment	1.293	0.00897	0.12	1.489	0.0193	0.26	0.272	0.9376	1200352	CBDivE_012098	CCCC(=O)Oc1c(Cl)cc(cc1Cl)N(C(=O)CCC)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M19	compound treatment	1.382	0.098	1.32	1.581	0.111	1.52	2.0081	0.9976	1920443	CBDivE_012099	Clc1ccc(Cl)c(NC(=O)c2ccc(Br)o2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	M20	compound treatment	1.319	0.035	0.47	1.499	0.0293	0.4	0.6165	0.9966	1507808	CBDivE_012100	CCCC(=O)Oc1ccc(cc1Cl)N(C(=O)CCC)S(=O)(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N01	compound treatment	1.21	-0.074	-1.0	1.453	-0.0167	-0.23	-0.8669	-0.8463	1920444	CBDivE_012101	C/C(=N\NC(=O)c1ccccc1)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N02	compound treatment	1.222	-0.062	-0.84	1.398	-0.0717	-0.98	-1.2827	-0.997	1148840	CBDivE_012102	COc1cc2ccccc2cc1C(=O)Nc3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N03	compound treatment	1.275	-0.00903	-0.12	1.418	-0.0517	-0.7	-0.5843	-0.8173	1717501	CBDivE_012103	OC(=O)c1nccnc1C(=O)Nc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N04	compound treatment	1.235	-0.049	-0.66	1.388	-0.0817	-1.11	-1.2551	-0.9691	1920445	CBDivE_012104	COC(=O)c1ccc(C(=O)OC)c2c(C(=O)OC)c(Cl)cc(C(=O)OC)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N05	compound treatment	1.306	0.022	0.3	1.444	-0.0257	-0.35	-0.0379	-0.0826	1920446	CBDivE_012105	CN(C)c1ccc(/C=N\NC(=O)c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N06	compound treatment	1.268	-0.016	-0.22	1.432	-0.0377	-0.51	-0.5161	-0.9261	1920447	CBDivE_012106	OC(=O)CC1S/C(=N\N=C2C3CC4CC(C3)CC2C4)/NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N07	compound treatment	1.205	-0.079	-1.07	1.46	-0.00966	-0.13	-0.8471	-0.7885	1920448	CBDivE_012107	Cc1ccc(cc1)c2nc3cc(NC(=O)c4ccc(C)c(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N08	compound treatment	1.204	-0.08	-1.08	1.398	-0.0717	-0.98	-1.4544	-0.9988	1164989	CBDivE_012108	CC1SC2(NC1=O)C3CC4CC2CC(O)(C4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N09	compound treatment	1.21	-0.074	-1.0	1.448	-0.0217	-0.3	-0.9151	-0.8786	1516935	CBDivE_012109	Clc1ccc2oc(nc2c1)c3ccc(NC(=O)c4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N10	compound treatment	1.24	-0.044	-0.59	1.457	-0.0127	-0.17	-0.5421	-0.8764	1920449	CBDivE_012110	CCN(CN(CC)c1ccc(Br)cc1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N11	compound treatment	1.237	-0.047	-0.63	1.43	-0.0397	-0.54	-0.8311	-0.9968	1776873	CBDivE_012111	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc(c2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N12	compound treatment	1.212	-0.072	-0.97	1.385	-0.0847	-1.15	-1.5035	-0.9963	1920450	CBDivE_012112	Clc1ccc(Cl)c(c1)N2C(=O)CC(SC(=N)N/N=C/c3cccs3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N13	compound treatment	1.29	0.00597	0.08	1.447	-0.0227	-0.31	-0.1616	-0.506	1718146	CBDivE_012113	Cc1cccc(c1)C(=O)Nc2ccc(cc2)c3nc4cc(Cl)ccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N14	compound treatment	1.249	-0.035	-0.47	1.426	-0.0437	-0.6	-0.7552	-0.9935	1412589	CBDivE_012114	Nc1c(sc2nccc(Nc3ccccc3)c12)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N15	compound treatment	1.243	-0.041	-0.55	1.458	-0.0117	-0.16	-0.5038	-0.8748	1920451	CBDivE_012115	Cc1ccc(cc1)c2nc3cc(NC(=O)c4cc([N+](=O)[O-])c(C)c(c4)[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N16	compound treatment	1.289	0.00497	0.07	1.404	-0.0657	-0.9	-0.5857	-0.6523	1012945	CBDivE_012116	CCOc1ccnc(OCC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N17	compound treatment	1.222	-0.062	-0.84	1.449	-0.0207	-0.28	-0.791	-0.8958	1920452	CBDivE_012117	COc1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N18	compound treatment	1.303	0.019	0.26	1.425	-0.0447	-0.61	-0.2497	-0.378	1920453	CBDivE_012118	CN1C(=O)NC(=O)/C(=C(\C)/Nc2cccc3ccccc23)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N19	compound treatment	1.253	-0.031	-0.42	1.509	0.0393	0.54	0.0833	0.1224	1920454	CBDivE_012119	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(Br)c(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	N20	compound treatment	1.252	-0.032	-0.43	1.423	-0.0467	-0.64	-0.7555	-0.9822	1521300	CBDivE_012120	COc1ccccc1NC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O01	compound treatment	1.352	0.068	0.92	1.496	0.0263	0.36	0.9024	0.9163	1920455	CBDivE_012121	Brc1ccc(o1)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O02	compound treatment	1.224	-0.06	-0.81	1.507	0.0373	0.51	-0.2126	-0.2223	1472491	CBDivE_012122	CCCC(=O)Oc1ccc(cc1)N(C(=O)CCC)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O03	compound treatment	1.2	-0.084	-1.13	1.553	0.0833	1.14	0.002	0.0012	1559220	CBDivE_012123	O=C(N(C1CCCCC1)C2CCCCC2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O04	compound treatment	1.342	0.058	0.78	1.473	0.00334	0.05	0.5852	0.747	1729513	CBDivE_012124	CCCC(=O)Oc1c(Br)cc(N(C(=O)CCC)S(=O)(=O)c2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O05	compound treatment	1.28	-0.00403	-0.05	1.445	-0.0247	-0.34	-0.2762	-0.8109	1247022	CBDivE_012125	CC1(C)CC(=O)c2cnc(NC(=O)c3ccc(F)cc3)nc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O06	compound treatment	1.25	-0.034	-0.46	1.441	-0.0287	-0.39	-0.601	-0.9968	1920456	CBDivE_012126	CC(C)c1ccc(C)c(OCCOC2OCCOC2OCCOc3cc(C)ccc3C(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O07	compound treatment	1.287	0.00297	0.04	1.498	0.0283	0.39	0.3016	0.7762	1920457	CBDivE_012127	Clc1ccc(CNC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O08	compound treatment	1.304	0.02	0.27	1.524	0.0543	0.74	0.7145	0.9062	1920458	CBDivE_012128	CC(=O)c1c(C)oc2c1cc(NS(=O)(=O)c3ccc(C)cc3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O09	compound treatment	1.314	0.03	0.4	1.484	0.0143	0.2	0.4242	0.9444	1920459	CBDivE_012129	[O-][N+](=O)c1cc(NC(=O)c2ccc(F)c(F)c2)cc(Sc3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O10	compound treatment	1.244	-0.04	-0.54	1.469	-6.6E-4	-0.01	-0.3882	-0.7188	1920460	CBDivE_012130	COc1cc(OC)c(/C(=N\NC(=O)c2ccccc2O)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O11	compound treatment	1.391	0.107	1.44	1.528	0.0583	0.8	1.5829	0.9606	1920461	CBDivE_012131	Cc1ccc(NC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O12	compound treatment	1.319	0.035	0.47	1.515	0.0453	0.62	0.7708	0.9911	1920462	CBDivE_012132	CC(=O)c1c(C)oc2c1cc(NS(=O)(=O)c3ccccc3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O13	compound treatment	1.296	0.012	0.16	1.521	0.0513	0.7	0.6092	0.8479	1920463	CBDivE_012133	Brc1ccccc1C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O14	compound treatment	1.24	-0.044	-0.59	1.472	0.00234	0.03	-0.3975	-0.6682	1360295	CBDivE_012134	CCCC(=O)Oc1ccc(cc1)N(C(=O)CCC)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O15	compound treatment	1.385	0.101	1.36	1.478	0.00834	0.11	1.0436	0.7635	1920464	CBDivE_012135	O=C(Cc1ccccc1)N/N=C/C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O16	compound treatment	1.33	0.046	0.62	1.489	0.0193	0.26	0.625	0.9274	1920465	CBDivE_012136	Oc1ccc2cc(ccc2c1)c3ccc4cc(O)ccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O17	compound treatment	1.348	0.064	0.86	1.602	0.132	1.8	1.8863	0.943	1920466	CBDivE_012137	Cc1ccc2nc(sc2c1)c3ccc(/N=C/C=C/c4ccc(Br)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O18	compound treatment	1.275	-0.00903	-0.12	1.499	0.0293	0.4	0.1968	0.4704	1920467	CBDivE_012138	[O-][N+](=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O19	compound treatment	1.385	0.101	1.36	1.528	0.0583	0.8	1.5257	0.9672	1920468	CBDivE_012139	O=C(NNC(=O)c1ccccc1)C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	O20	compound treatment	1.242	-0.042	-0.57	1.501	0.0313	0.43	-0.0988	-0.1391	1633574	CBDivE_012140	CC1=C(C)CC(C(C1)C(=O)O)C(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P01	compound treatment	1.257	-0.027	-0.36	1.447	-0.0227	-0.31	-0.4764	-0.9966	1920469	CBDivE_012141	Cc1ccc(cc1)S(=O)(=O)Oc2ccc3c(C)cc(=O)oc3c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P02	compound treatment	1.229	-0.055	-0.74	1.427	-0.0427	-0.58	-0.9363	-0.9927	1575916	CBDivE_012142	Oc1ccccc1Oc2ccc(Oc3ccccc3O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P03	compound treatment	1.293	0.00897	0.12	1.393	-0.0767	-1.05	-0.6536	-0.6211	1920470	CBDivE_012143	CC/1=NN(C(=O)\C1=C/NN(Cc2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P04	compound treatment	1.202	-0.082	-1.11	1.444	-0.0257	-0.35	-1.0299	-0.8874	1920471	CBDivE_012144	FC(F)(F)c1ccccc1NC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P05	compound treatment	1.246	-0.038	-0.51	1.41	-0.0597	-0.81	-0.9381	-0.9753	1920472	CBDivE_012145	CCOC(=O)C=CC(O)C(O)C(O)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P06	compound treatment	1.209	-0.075	-1.01	1.375	-0.0947	-1.29	-1.6285	-0.9928	1308636	CBDivE_012146	CC(C)CN(CC(C)C)C(=O)CN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P07	compound treatment	1.228	-0.056	-0.76	1.429	-0.0407	-0.55	-0.9266	-0.9884	1920473	CBDivE_012147	CCCCN1CCc2c(C1=O)n(Cc3ccccc3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P08	compound treatment	1.229	-0.055	-0.74	1.421	-0.0487	-0.66	-0.9942	-0.9984	1920474	CBDivE_012148	COc1ccc(cc1)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P09	compound treatment	1.159	-0.125	-1.69	1.36	-0.11	-1.5	-2.2501	-0.9982	1920475	CBDivE_012149	Cc1ccc(cc1)S(=O)(=O)N(Cc2ccc(Cl)cc2Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P10	compound treatment	0.639	-0.645	-8.7	1.036	-0.434	-5.91	-10.3347	-0.9823	1920476	CBDivE_012150	CC(C)(C)COC(Br)(Cn1cnc(=O)cn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P11	compound treatment	1.261	-0.023	-0.31	1.397	-0.0727	-0.99	-0.9203	-0.8863	1920477	CBDivE_012151	CNC(=O)n1c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P12	compound treatment	1.218	-0.066	-0.89	1.389	-0.0807	-1.1	-1.4077	-0.9945	1553169	CBDivE_012152	O=S(=O)(NC1CCS(=O)(=O)C1)C2CCS(=O)(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P13	compound treatment	1.245	-0.039	-0.53	1.439	-0.0307	-0.42	-0.668	-0.9935	1920478	CBDivE_012153	O=C1C2C(C3C=CC2NC3=O)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P14	compound treatment	1.223	-0.061	-0.82	1.405	-0.0647	-0.88	-1.2057	-0.9994	1054531	CBDivE_012154	Oc1ccc2c(c1)oc(=O)c3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P15	compound treatment	1.322	0.038	0.51	1.455	-0.0147	-0.2	0.2208	0.4016	1920479	CBDivE_012155	Oc1ccc(/C=N/c2nccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P16	compound treatment	1.263	-0.021	-0.28	1.369	-0.101	-1.37	-1.1712	-0.8356	1920480	CBDivE_012156	CC(=O)Oc1ccccc1C(=O)NCCNC(=O)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P17	compound treatment	1.216	-0.068	-0.92	1.374	-0.0957	-1.3	-1.5714	-0.9852	1920481	CBDivE_012157	O=C1C(CCNc2ccccc2)C=NN1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P18	compound treatment	1.146	-0.138	-1.86	1.468	-0.00166	-0.02	-1.3327	-0.7156	1920482	CBDivE_012158	CCCCCC(=O)NCCNC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P19	compound treatment	1.281	-0.00303	-0.04	1.489	0.0193	0.26	0.1576	0.5904	1685772	CBDivE_012159	COc1ccccc1C(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.38	P20	compound treatment	1.254	-0.03	-0.41	1.401	-0.0687	-0.94	-0.9485	-0.9298	1920483	CBDivE_012160	NC(=O)Oc1c(Br)c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A01	compound treatment	1.342	0.0527	0.71	1.437	-0.019	-0.26	0.3198	0.4229	1920484	CBDivE_012161	CC(=O)Nc1ccc2oc(=O)c(C(=O)C)c(O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A02	compound treatment	1.378	0.0887	1.2	1.442	-0.014	-0.19	0.7114	0.5873	1920485	CBDivE_012162	COCCCNc1cccc2C(=O)c3ccccc3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A03	compound treatment	1.239	-0.0503	-0.68	1.452	-0.00395	-0.05	-0.5181	-0.7609	1920486	CBDivE_012163	CC(=O)Nc1ccc2oc(=O)cc(O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A04	compound treatment	1.345	0.0557	0.75	1.442	-0.014	-0.19	0.3966	0.5118	1920487	CBDivE_012164	OC(=O)c1cccc2c(Cl)ccc(C(=O)O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A05	compound treatment	1.372	0.0827	1.12	1.516	0.06	0.82	1.3677	0.9884	1920488	CBDivE_012165	NNC(=O)CCn1c2CCCc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A06	compound treatment	1.287	-0.00232	-0.03	1.408	-0.048	-0.65	-0.4845	-0.7401	1920489	CBDivE_012166	[O-][N+](=O)c1cc(ccc1NCCc2ccccc2)S(=O)(=O)NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A07	compound treatment	1.41	0.121	1.63	1.549	0.093	1.27	2.0484	0.9924	1920490	CBDivE_012167	Nc1ccccc1Nc2nc(nc(n2)N3CCCCC3)N(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A08	compound treatment	1.377	0.0877	1.18	1.562	0.106	1.45	1.859	0.995	1644249	CBDivE_012168	NC1(CC2CC3C1)CC(CC(=O)O)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A09	compound treatment	1.391	0.102	1.37	1.427	-0.029	-0.39	0.6908	0.4839	1063506	CBDivE_012169	Brc1ccc(NN=Nc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A10	compound treatment	1.369	0.0797	1.07	1.42	-0.036	-0.49	0.4134	0.3499	1920491	CBDivE_012170	COc1ccc2nc(NC(=N)N)nc(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A11	compound treatment	1.363	0.0737	0.99	1.524	0.068	0.93	1.359	0.9994	1920492	CBDivE_012171	CCOC(=O)C(C(=O)OCC)c1ccc(cn1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A12	compound treatment	1.33	0.0407	0.55	1.505	0.049	0.67	0.861	0.9952	1920493	CBDivE_012172	COC(=O)CCNc1ccc(O)c2C(=O)c3ccccc3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A13	compound treatment	1.387	0.0977	1.32	1.488	0.032	0.44	1.2408	0.8937	1920494	CBDivE_012173	Nc1ccc2C3c4ccccc4C(c5ccc(N)cc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A14	compound treatment	1.281	-0.00832	-0.11	1.472	0.016	0.22	0.0754	0.3065	1020224	CBDivE_012174	Clc1cc2C(=O)C(=O)Nc2c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A15	compound treatment	1.32	0.0307	0.41	1.498	0.042	0.57	0.6981	0.9872	1920495	CBDivE_012175	Oc1ccccc1Oc2c(F)c(F)c(Oc3ccccc3O)c(F)c2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A16	compound treatment	1.275	-0.0143	-0.19	1.447	-0.00895	-0.12	-0.2229	-0.9755	1429425	CBDivE_012176	Nc1ccccc1NC(=O)c2ccccc2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A17	compound treatment	1.442	0.153	2.06	1.497	0.041	0.56	1.8523	0.8678	1920496	CBDivE_012177	Cc1ccc(NNS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A18	compound treatment	1.348	0.0587	0.79	1.408	-0.048	-0.65	0.0974	0.0948	1556428	CBDivE_012178	Nc1ccccc1NC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A19	compound treatment	1.333	0.0437	0.59	1.487	0.031	0.42	0.716	0.9868	1920497	CBDivE_012179	Cc1ccc(cc1)S(=O)(=O)Oc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	A20	compound treatment	1.257	-0.0323	-0.44	1.435	-0.021	-0.29	-0.5103	-0.979	1074669	CBDivE_012180	O=c1c2cccc3cccc(c4nc5ccccc5n14)c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B01	compound treatment	1.309	0.0197	0.27	1.367	-0.089	-1.21	-0.67	-0.5396	1920498	CBDivE_012181	FC(F)(F)c1cccc(c1)c2ccc(/C=N/NC(=O)COc3ccccc3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B02	compound treatment	1.343	0.0537	0.72	1.471	0.015	0.21	0.6572	0.8731	1920499	CBDivE_012182	CC(C)C(NCc1c(O)ccc2c(=O)c(coc12)c3ccc4OCCOc4c3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B03	compound treatment	1.314	0.0247	0.33	1.401	-0.055	-0.75	-0.2944	-0.3591	1920500	CBDivE_012183	COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B04	compound treatment	1.303	0.0137	0.18	1.457	0.00105	0.01	0.1406	0.7595	1920501	CBDivE_012184	Cc1ccc(cc1)/C(=N\CS(=O)(=O)c2ccccc2)/NC(=S)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B05	compound treatment	1.305	0.0157	0.21	1.476	0.02	0.27	0.3429	0.992	1399642	CBDivE_012185	CC(C)(C#CC(O)(c1ccccc1)c2ccccc2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B06	compound treatment	1.223	-0.0663	-0.89	1.405	-0.051	-0.69	-1.124	-0.9922	1920502	CBDivE_012186	ClC(Cl)(Cl)C(NC(=O)CCc1ccccc1)NC(=S)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B07	compound treatment	1.332	0.0427	0.58	1.483	0.027	0.37	0.6679	0.9768	1920503	CBDivE_012187	COc1ccccc1C(=O)NCC(=O)N/N=C(\C)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B08	compound treatment	1.403	0.114	1.53	1.402	-0.054	-0.74	0.5642	0.3317	1920504	CBDivE_012188	Oc1ccc(cc1)C2(C(CC(=O)c3ccccc3)c4ccco4)C(=O)c5ccccc5C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B09	compound treatment	1.275	-0.0143	-0.19	1.471	0.015	0.21	0.0085	0.0301	1700055	CBDivE_012189	Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B10	compound treatment	1.369	0.0797	1.07	1.458	0.00205	0.03	0.7798	0.7252	1920505	CBDivE_012190	COC(=O)[C@H](C)NC(=O)/C(=C/c1ccccc1)/NC(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B11	compound treatment	1.295	0.00568	0.08	1.387	-0.069	-0.94	-0.6107	-0.6473	1675421	CBDivE_012191	Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(O)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B12	compound treatment	1.279	-0.0103	-0.14	1.432	-0.024	-0.33	-0.3294	-0.9277	1657016	CBDivE_012192	Cc1cc(C)c2cccc(NC(=O)c3ccccc3F)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B13	compound treatment	1.348	0.0587	0.79	1.361	-0.095	-1.29	-0.3558	-0.2344	1307680	CBDivE_012193	Cc1ccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(N)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B14	compound treatment	1.263	-0.0263	-0.36	1.457	0.00105	0.01	-0.241	-0.6781	1920506	CBDivE_012194	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)Nc2nc[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B15	compound treatment	1.332	0.0427	0.58	1.439	-0.017	-0.23	0.2437	0.3927	1718674	CBDivE_012195	Cc1cccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(N)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B16	compound treatment	1.283	-0.00632	-0.09	1.447	-0.00895	-0.12	-0.1466	-0.9846	1920507	CBDivE_012196	OC(=O)/C=C/c1ccc(o1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B17	compound treatment	1.311	0.0217	0.29	1.434	-0.022	-0.3	-0.0049	-0.0116	1920508	CBDivE_012197	Cc1ccc(cc1)S(=O)(=O)NC2=C(C(=O)c3ccccc3C2=O)[n+]4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B18	compound treatment	1.252	-0.0373	-0.5	1.456	4.7E-5	0.0	-0.3556	-0.7062	1920509	CBDivE_012198	FC(F)(F)c1nc2cc3nc4ccccc4nc3cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B19	compound treatment	1.302	0.0127	0.17	1.37	-0.086	-1.17	-0.7078	-0.5976	1363658	CBDivE_012199	Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	B20	compound treatment	1.237	-0.0523	-0.71	1.431	-0.025	-0.34	-0.7397	-0.944	1920510	CBDivE_012200	CCOC(C(=O)OCCCN1CCCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C01	compound treatment	1.347	0.0577	0.78	1.433	-0.023	-0.31	0.3289	0.3921	1920511	CBDivE_012201	Fc1ccc(cc1)C(=O)c2ccc(NS(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C02	compound treatment	1.285	-0.00432	-0.06	1.459	0.00305	0.04	-0.0118	-0.1652	1042419	CBDivE_012202	O=C1c2ccccc2-c3nc4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C03	compound treatment	1.355	0.0657	0.89	1.452	-0.00395	-0.05	0.5884	0.6629	1267406	CBDivE_012203	Clc1ccc(cc1)c2ccc(cc2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C04	compound treatment	1.296	0.00668	0.09	1.402	-0.054	-0.74	-0.4565	-0.6159	1624146	CBDivE_012204	CCOc1ccc(NC(=O)c2ccccc2)c(N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C05	compound treatment	1.26	-0.0293	-0.4	1.532	0.076	1.04	0.4536	0.4087	1600926	CBDivE_012205	Oc1c(Cl)c(Cl)c(NC(=O)c2ccccc2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C06	compound treatment	1.305	0.0157	0.21	1.494	0.038	0.52	0.5164	0.9217	1920512	CBDivE_012206	COC(=O)c1ccc(cc1)c2nc3cc(Cl)ccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C07	compound treatment	1.346	0.0567	0.76	1.456	4.7E-5	0.0	0.5411	0.7077	1920513	CBDivE_012207	Cc1cc(C)c(N2Cc3ccccc3C2=N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C08	compound treatment	1.298	0.00868	0.12	1.469	0.013	0.18	0.2086	0.9794	1560965	CBDivE_012208	OC(=O)c1ccc2[nH]c(nc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C09	compound treatment	1.276	-0.0133	-0.18	1.547	0.091	1.24	0.7509	0.5985	1920514	CBDivE_012209	CCOC(=O)/C(=N/Nc1ccc(Cl)cc1)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C10	compound treatment	1.327	0.0377	0.51	1.517	0.061	0.83	0.9481	0.972	1920515	CBDivE_012210	Cc1ccc2/C(=C\c3ccc4OCOc4c3)/c5ccccc5-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C11	compound treatment	1.369	0.0797	1.07	1.444	-0.012	-0.16	0.6448	0.5931	1775557	CBDivE_012211	Cc1cccc(N=c2scc(c3ccc(cc3)[N+](=O)[O-])n2c4cccc(C)c4C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C12	compound treatment	1.314	0.0247	0.33	1.441	-0.015	-0.2	0.0913	0.2337	1408257	CBDivE_012212	Cc1ccc(NC(=O)c2ccc(N)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C13	compound treatment	1.311	0.0217	0.29	1.481	0.025	0.34	0.4483	0.997	1415552	CBDivE_012213	Cn1c(nc2ccccc12)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C14	compound treatment	1.355	0.0657	0.89	1.478	0.022	0.3	0.8391	0.8968	1920516	CBDivE_012214	COc1ccc(/C=C\2/c3cc(C)ccc3-c4nc5ccccc5nc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C15	compound treatment	1.389	0.0997	1.34	1.512	0.056	0.76	1.4913	0.9641	1920517	CBDivE_012215	FC(F)(F)C(F)(F)C(F)(F)Sc1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C16	compound treatment	1.29	6.8E-4	0.01	1.485	0.029	0.4	0.2866	0.7233	1920518	CBDivE_012216	[O-][N+](=O)c1ccccc1c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C17	compound treatment	1.382	0.0927	1.25	1.503	0.047	0.64	1.3378	0.9519	3107197	CBDivE_012217	CC(C)Cc1ccc(cc1)C(C)C(=O)O.CC(N)C1CC2CCC1C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C18	compound treatment	1.318	0.0287	0.39	1.466	0.01	0.14	0.3705	0.9026	1646040	CBDivE_012218	CCOC(=O)C1=C(C)NC(=O)NC1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C19	compound treatment	1.254	-0.0353	-0.48	1.451	-0.00495	-0.07	-0.3847	-0.7993	1356078	CBDivE_012219	COC(=O)c1ccccc1NC(=O)COc2ccc3c(C)cc(=O)oc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	C20	compound treatment	1.288	-0.00132	-0.02	1.416	-0.04	-0.54	-0.3978	-0.7298	1920519	CBDivE_012220	CC(C)(C)c1cc(Br)cc(/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D01	compound treatment	1.26	-0.0293	-0.4	1.397	-0.059	-0.8	-0.8481	-0.9466	1920520	CBDivE_012221	O=C1C(=C(NS(=O)(=O)c2ccccc2)C(=O)c3ccccc13)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D02	compound treatment	1.274	-0.0153	-0.21	1.388	-0.068	-0.93	-0.8014	-0.8441	1920521	CBDivE_012222	OC(=O)c1cccc(c1)N2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D03	compound treatment	1.124	-0.165	-2.23	1.427	-0.029	-0.39	-1.8562	-0.8195	1920522	CBDivE_012223	O=C1C(=C(C(=O)c2ccccc12)[n+]3ccc4ccccc4c3)NS(=O)(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D04	compound treatment	1.277	-0.0123	-0.17	1.411	-0.045	-0.61	-0.551	-0.8675	1920523	CBDivE_012224	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Oc2ccccc2c3ccccc3OS(=O)(=O)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D05	compound treatment	1.224	-0.0653	-0.88	1.403	-0.053	-0.72	-1.1337	-0.9951	1639061	CBDivE_012225	CC(C)COc1nc2ccccc2nc1NS(=O)(=O)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D06	compound treatment	1.334	0.0447	0.6	1.472	0.016	0.22	0.581	0.906	1252899	CBDivE_012226	Cc1cc(C)c(NC(=O)CC(=O)Nc2c(C)cc(C)cc2C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D07	compound treatment	1.305	0.0157	0.21	1.467	0.011	0.15	0.2561	0.9862	1920524	CBDivE_012227	CCCCCOc1nc2ccccc2nc1NS(=O)(=O)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D08	compound treatment	1.275	-0.0143	-0.19	1.431	-0.025	-0.34	-0.3772	-0.964	1920525	CBDivE_012228	Oc1ccccc1OCc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D09	compound treatment	1.261	-0.0283	-0.38	1.427	-0.029	-0.39	-0.5493	-0.9999	1920526	CBDivE_012229	Cc1cc(=O)n(c(=O)n1C(=O)c2ccccc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D10	compound treatment	1.256	-0.0333	-0.45	1.445	-0.011	-0.15	-0.4235	-0.894	1920527	CBDivE_012230	[O-][N+](=O)c1ccc(cc1)c2ccc(/C=C(/NC(=O)c3ccccc3)\C(=O)NCc4ccccc4)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D11	compound treatment	1.249	-0.0403	-0.54	1.506	0.05	0.68	0.098	0.1122	1614957	CBDivE_012231	CC(C)Oc1nc2ccccc2nc1NS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D12	compound treatment	1.343	0.0537	0.72	1.482	0.026	0.36	0.7632	0.9462	1003776	CBDivE_012232	CCOC(=O)C1=C(C)NC(=O)NC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D13	compound treatment	1.411	0.122	1.64	1.447	-0.00895	-0.12	1.0744	0.6527	1920528	CBDivE_012233	Cc1nn(c(O)c1/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D14	compound treatment	1.276	-0.0133	-0.18	1.385	-0.071	-0.97	-0.8112	-0.8243	1920529	CBDivE_012234	CC1(C)O[C@H]2CNCCOCCOCCNC[C@@H]2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D15	compound treatment	1.263	-0.0263	-0.36	1.473	0.017	0.23	-0.0867	-0.2043	1920530	CBDivE_012235	C/C(=N\NC(=O)COc1ccc(Cl)cc1[N+](=O)[O-])/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D16	compound treatment	1.321	0.0317	0.43	1.375	-0.081	-1.1	-0.4784	-0.4041	1920531	CBDivE_012236	COc1ccc(/C=C\2/c3ccc(C)cc3-c4nc5ccccc5cc24)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D17	compound treatment	1.257	-0.0323	-0.44	1.449	-0.00695	-0.09	-0.3754	-0.8412	1920532	CBDivE_012237	COc1ccc(/C=N/NC(=O)COc2ccc(Br)c3ccccc23)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D18	compound treatment	1.261	-0.0283	-0.38	1.413	-0.043	-0.59	-0.6843	-0.9786	1920533	CBDivE_012238	CCOC(=O)C1=C(C)NC(=S)NC1c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D19	compound treatment	1.339	0.0497	0.67	1.489	0.033	0.45	0.7926	0.9813	1920534	CBDivE_012239	Cc1ccc(OCC(=O)N/N=C/C=N/NC(=O)COc2ccc(C)cc2C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	D20	compound treatment	1.273	-0.0163	-0.22	1.482	0.026	0.36	0.0955	0.2285	1920535	CBDivE_012240	O1c2ccccc2C=CC13Oc4ccccc4C=C3c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E01	compound treatment	1.283	-0.00632	-0.09	1.476	0.02	0.27	0.133	0.4645	1920536	CBDivE_012241	Cc1cccc(NC(=O)C(OC(=O)c2ccccc2)C(OC(=O)c3ccccc3)C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E02	compound treatment	1.242	-0.0473	-0.64	1.429	-0.027	-0.37	-0.7113	-0.9656	1177346	CBDivE_012242	Cn1c(cn2c1nc3n(C)c(=O)[nH]c(=O)c32)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E03	compound treatment	1.221	-0.0683	-0.92	1.469	0.013	0.18	-0.5259	-0.5603	1920537	CBDivE_012243	CC1CC(=O)NN=C1c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E04	compound treatment	1.294	0.00468	0.06	1.501	0.045	0.61	0.479	0.7757	1539584	CBDivE_012244	Nc1ccn(C2OC(CO)C3OS(=O)OC23)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E05	compound treatment	1.333	0.0437	0.59	1.481	0.025	0.34	0.6582	0.9664	1920538	CBDivE_012245	CN(C)C[C@@H]1Oc2ccccc2O[C@@]1(O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E06	compound treatment	1.249	-0.0403	-0.54	1.472	0.016	0.22	-0.2299	-0.3921	1920539	CBDivE_012246	Oc1c(C(C2C(=O)c3ccccc3C2=O)c4ccc(cc4Br)[N+](=O)[O-])c(=O)sc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E07	compound treatment	1.231	-0.0583	-0.79	1.577	0.121	1.65	0.6109	0.3341	1675897	CBDivE_012247	Brc1ccc2OCCSCCOCCOCCSCCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E08	compound treatment	1.329	0.0397	0.54	1.492	0.036	0.49	0.7261	0.9991	1920540	CBDivE_012248	CC(O)CCC(=O)N/N=C/c1cccc(CC=C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E09	compound treatment	1.391	0.102	1.37	1.495	0.039	0.53	1.3465	0.9151	1920541	CBDivE_012249	CC(=O)Cc1ccccc1OC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E10	compound treatment	1.31	0.0207	0.28	1.458	0.00205	0.03	0.217	0.774	1920542	CBDivE_012250	Brc1ccc(OCC(=O)N/N=C/c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E11	compound treatment	1.405	0.116	1.56	1.514	0.058	0.79	1.6632	0.9505	1125859	CBDivE_012251	Clc1ccc(cc1Cl)S(=O)(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E12	compound treatment	1.299	0.00968	0.13	1.476	0.02	0.27	0.2856	0.9428	1920543	CBDivE_012252	Brc1ccc(OCC(=O)N/N=C/c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E13	compound treatment	1.288	-0.00132	-0.02	1.462	0.00605	0.08	0.0457	0.5419	1920544	CBDivE_012253	CC1CCN(CC1)C(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E14	compound treatment	1.269	-0.0203	-0.27	1.432	-0.024	-0.33	-0.4248	-0.9962	1920545	CBDivE_012254	O=c1cc([nH]c(=S)[nH]1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E15	compound treatment	1.373	0.0837	1.13	1.464	0.00805	0.11	0.8758	0.7722	1565273	CBDivE_012255	Oc1ccc(Oc2ccc(Oc3ccc(O)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E16	compound treatment	1.283	-0.00632	-0.09	1.43	-0.026	-0.35	-0.3105	-0.853	1920546	CBDivE_012256	C/C(=N\c1ccccc1)/C/C(=N/NC(=S)N)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E17	compound treatment	1.381	0.0917	1.24	1.444	-0.012	-0.16	0.7593	0.6087	1283442	CBDivE_012257	O=C(Nc1ccc2OCOc2c1)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E18	compound treatment	1.31	0.0207	0.28	1.484	0.028	0.38	0.4677	0.988	1920547	CBDivE_012258	O=C(COC(=O)c1ccco1)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E19	compound treatment	1.293	0.00368	0.05	1.564	0.108	1.47	1.0769	0.7305	1920548	CBDivE_012259	OC(=O)c1ccc(OS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	E20	compound treatment	1.35	0.0607	0.82	1.465	0.00905	0.12	0.6661	0.8046	1920549	CBDivE_012260	Oc1c(C(C2C(=O)c3ccccc3C2=O)c4ccco4)c(=O)oc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F01	compound treatment	1.241	-0.0483	-0.65	1.389	-0.067	-0.91	-1.1065	-0.9864	1920550	CBDivE_012261	C/C(=N\NC(=O)COc1ccccc1Cl)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F02	compound treatment	1.236	-0.0533	-0.72	1.399	-0.057	-0.78	-1.0578	-0.9993	1920551	CBDivE_012262	Cc1cccc2/C(=N/c3ccccc3)/c4cccnc4-c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F03	compound treatment	1.23	-0.0593	-0.8	1.403	-0.053	-0.72	-1.0765	-0.9987	1920552	CBDivE_012263	C/C(=N\NC(=O)COc1ccc(Cl)cc1C)/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F04	compound treatment	1.265	-0.0243	-0.33	1.401	-0.055	-0.75	-0.7619	-0.9313	1920553	CBDivE_012264	N(=C/1\c2ccccc2-c3nc4ccccc4nc13)/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F05	compound treatment	1.322	0.0327	0.44	1.476	0.02	0.27	0.505	0.9736	1920554	CBDivE_012265	COc1ccc(OCC(=O)N/N=C/2\C(=O)N(C)c3ccccc23)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F06	compound treatment	1.276	-0.0133	-0.18	1.415	-0.041	-0.56	-0.5219	-0.8897	1920555	CBDivE_012266	Cc1ccc-2c(c1)/C(=C/c3ccc(cc3)[N+](=O)[O-])/c4cccnc42
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F07	compound treatment	1.316	0.0267	0.36	1.36	-0.096	-1.31	-0.6707	-0.4942	1920556	CBDivE_012267	COc1ccc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F08	compound treatment	1.303	0.0137	0.18	1.46	0.00405	0.06	0.1695	0.88	1099976	CBDivE_012268	[O-][N+](=O)c1ccc2[nH]c(nc2c1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F09	compound treatment	1.204	-0.0853	-1.15	1.431	-0.025	-0.34	-1.0545	-0.8786	1920557	CBDivE_012269	CN1C(=O)/C(=N\Nc2ccccc2)/c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F10	compound treatment	1.286	-0.00332	-0.04	1.446	-0.00995	-0.14	-0.1276	-0.8931	1920558	CBDivE_012270	C(Cc1ccccc1)/C=N\Nc2nnn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F11	compound treatment	1.282	-0.00732	-0.1	1.492	0.036	0.49	0.2778	0.554	1920559	CBDivE_012271	CN1C(=O)/C(=N\NC(=O)COc2ccc(Cl)cc2Cl)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F12	compound treatment	1.178	-0.111	-1.5	1.425	-0.031	-0.42	-1.3604	-0.8721	1920560	CBDivE_012272	C(=C/1\c2ccccc2-c3ncccc13)/c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F13	compound treatment	1.274	-0.0153	-0.21	1.49	0.034	0.46	0.1822	0.3584	1920561	CBDivE_012273	COc1cc(Br)ccc1OCC(=O)N/N=C/2\C(=O)N(C)c3ccc(Br)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F14	compound treatment	1.251	-0.0383	-0.52	1.465	0.00905	0.12	-0.2783	-0.5237	1920562	CBDivE_012274	OC(=O)c1ccc(NC(=O)CS)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F15	compound treatment	1.315	0.0257	0.35	1.484	0.028	0.38	0.5154	0.9988	1003730	CBDivE_012275	OC(=O)CSc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F16	compound treatment	1.263	-0.0263	-0.36	1.44	-0.016	-0.22	-0.4049	-0.9723	1920563	CBDivE_012276	COC(=O)C(CCSC)NC(=O)COc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F17	compound treatment	1.229	-0.0603	-0.81	1.496	0.04	0.55	-0.1893	-0.1931	1920564	CBDivE_012277	OCCNc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F18	compound treatment	1.314	0.0247	0.33	1.455	-9.53E-4	-0.01	0.2262	0.679	1920565	CBDivE_012278	Cc1cc(C)c(NC(=O)CN2CCCCCC2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F19	compound treatment	1.251	-0.0383	-0.52	1.485	0.029	0.4	-0.0855	-0.1312	1920566	CBDivE_012279	OC(=O)c1ccc(C(=O)O)c2c(cccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	F20	compound treatment	1.273	-0.0163	-0.22	1.405	-0.051	-0.69	-0.647	-0.8877	1920567	CBDivE_012280	COc1ccccc1NC(=S)NC(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G01	compound treatment	1.186	-0.103	-1.39	1.431	-0.025	-0.34	-1.2262	-0.8546	1737872	CBDivE_012281	Cc1nn(c(C)c1Sc2ccccc2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G02	compound treatment	1.234	-0.0553	-0.75	1.397	-0.059	-0.8	-1.0962	-0.9993	1092526	CBDivE_012282	c1cn2cc(nc2s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G03	compound treatment	1.355	0.0657	0.89	1.476	0.02	0.27	0.8198	0.8841	1920568	CBDivE_012283	Clc1ccc(NC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G04	compound treatment	1.318	0.0287	0.39	1.457	0.00105	0.01	0.2837	0.7327	1546076	CBDivE_012284	COc1ccc2n(C)c(C)c(C(=O)CSc3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G05	compound treatment	1.307	0.0177	0.24	1.437	-0.019	-0.26	-0.0141	-0.0401	1920333	CBDivE_012285	CCOC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G06	compound treatment	1.309	0.0197	0.27	1.44	-0.016	-0.22	0.0339	0.0988	1920569	CBDivE_012286	Oc1cccnc1CCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G07	compound treatment	1.251	-0.0383	-0.52	1.488	0.032	0.44	-0.0565	-0.0835	1651241	CBDivE_012287	O=C(CCN1C(=O)c2ccccc2C1=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G08	compound treatment	1.286	-0.00332	-0.04	1.438	-0.018	-0.24	-0.2048	-0.8228	1441089	CBDivE_012288	OC(=O)c1ccc(cc1)C2N(CCN2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G09	compound treatment	1.215	-0.0743	-1.0	1.555	0.099	1.35	0.2461	0.1463	1333050	CBDivE_012289	CCC(C)OC(=O)C(O)(c1ccc(Br)cc1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G10	compound treatment	1.28	-0.00932	-0.13	1.508	0.052	0.71	0.413	0.5729	1920570	CBDivE_012290	COc1ccc(/C=C/2\SC(=S)N(C2=O)c3ccc(cc3)C(=O)O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G11	compound treatment	1.423	0.134	1.8	1.507	0.051	0.7	1.7674	0.9143	1920571	CBDivE_012291	OC(=O)C(OC(=O)c1ccccc1)C(OC(=O)c2ccccc2)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G12	compound treatment	1.248	-0.0413	-0.56	1.476	0.02	0.27	-0.2009	-0.3235	1920572	CBDivE_012292	Oc1ccc(F)cc1C(Nn2cnnc2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G13	compound treatment	1.281	-0.00832	-0.11	1.424	-0.032	-0.44	-0.3875	-0.8611	1920573	CBDivE_012293	Oc1cccc(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G14	compound treatment	1.279	-0.0103	-0.14	1.454	-0.00195	-0.03	-0.1173	-0.8274	1920574	CBDivE_012294	Nc1nonc1NC(=O)NN=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G15	compound treatment	1.308	0.0187	0.25	1.571	0.115	1.57	1.2875	0.8103	1297737	CBDivE_012295	OC(=O)c1ccc(NC(=O)Oc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G16	compound treatment	1.311	0.0217	0.29	1.517	0.061	0.83	0.7955	0.9015	1515406	CBDivE_012296	COc1cccc(NC(=O)c2nn(C)cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G17	compound treatment	1.297	0.00768	0.1	1.515	0.059	0.81	0.6426	0.7916	1920575	CBDivE_012297	Oc1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G18	compound treatment	1.295	0.00568	0.08	1.473	0.017	0.23	0.2186	0.8929	1920576	CBDivE_012298	CCCC1NC(Cc2c1[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G19	compound treatment	1.283	-0.00632	-0.09	1.532	0.076	1.04	0.673	0.6468	1920577	CBDivE_012299	Clc1ccc(cc1)C(=O)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	G20	compound treatment	1.309	0.0197	0.27	1.435	-0.021	-0.29	-0.0143	-0.0367	1920578	CBDivE_012300	COc1cc(/C=N/Nc2nonc2N)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H01	compound treatment	1.23	-0.0593	-0.8	1.334	-0.122	-1.66	-1.7418	-0.9438	1920579	CBDivE_012301	O=C(NC(N1CCCCC1)C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H02	compound treatment	1.251	-0.0383	-0.52	1.429	-0.027	-0.37	-0.6254	-0.986	1920580	CBDivE_012302	COC(=O)C(CC(C)C)NC(=O)COc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H03	compound treatment	1.305	0.0157	0.21	1.395	-0.061	-0.83	-0.4382	-0.5109	1688448	CBDivE_012303	Nc1nc(c(NC(=O)c2ccccc2)s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H04	compound treatment	1.301	0.0117	0.16	1.402	-0.054	-0.74	-0.4088	-0.5433	1920581	CBDivE_012304	COc1ccc2[n+]([O-])c3cc(Cl)ccc3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H05	compound treatment	1.223	-0.0663	-0.89	1.413	-0.043	-0.59	-1.0468	-0.9789	1920582	CBDivE_012305	Fc1ccc(cc1)C2NC(=S)NC(=N2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H06	compound treatment	1.283	-0.00632	-0.09	1.419	-0.037	-0.5	-0.4166	-0.8152	1920583	CBDivE_012306	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(NC(=S)Nc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H07	compound treatment	1.248	-0.0413	-0.56	1.417	-0.039	-0.53	-0.7698	-0.9997	1920584	CBDivE_012307	NC(=O)Nn1c(nc2ccccc2c1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H08	compound treatment	1.296	0.00668	0.09	1.424	-0.032	-0.44	-0.2444	-0.5492	1130159	CBDivE_012308	CC(C(=O)O)c1cc(sc1c2ccccc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H09	compound treatment	1.231	-0.0583	-0.79	1.419	-0.037	-0.5	-0.9126	-0.9768	1920585	CBDivE_012309	O=c1nc(SCc2nc3ccccc3c(=O)n2c4ccccc4)[nH]c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H10	compound treatment	1.297	0.00768	0.1	1.488	0.032	0.44	0.3823	0.8512	1920586	CBDivE_012310	CCCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(NC(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H11	compound treatment	1.4	0.111	1.49	1.424	-0.032	-0.44	0.7477	0.4807	1920587	CBDivE_012311	[O-][N+](=O)c1ccc(/C=C/c2nc3ccccc3c(=O)n2c4ccc(cc4)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H12	compound treatment	1.272	-0.0173	-0.23	1.463	0.00705	0.1	-0.0973	-0.385	1920588	CBDivE_012312	OC(=O)C/1(/C(=N/Nc2ccccc2)/c3ccccc3\C1=N/Nc4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H13	compound treatment	1.348	0.0587	0.79	1.519	0.063	0.86	1.1677	0.9992	1920589	CBDivE_012313	NC(=N)SCc1nc2ccccc2c(=O)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H14	compound treatment	1.31	0.0207	0.28	1.463	0.00705	0.1	0.2652	0.8988	1920590	CBDivE_012314	COC(=O)C(Cc1ccccc1)NCc2c(O)ccc3c(=O)c(c4ccc(F)cc4)c(oc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H15	compound treatment	1.263	-0.0263	-0.36	1.417	-0.039	-0.53	-0.6267	-0.9808	1429789	CBDivE_012315	Clc1cccc(Cl)c1n2c(CSc3nnnn3c4ccccc4)nc5ccccc5c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H16	compound treatment	1.222	-0.0673	-0.91	1.451	-0.00495	-0.07	-0.6899	-0.7576	1920591	CBDivE_012316	Cc1ccc(NC(=O)CC/2(C(=O)c3ccccc3\C2=N/Nc4ccccc4)c5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H17	compound treatment	1.255	-0.0343	-0.46	1.5	0.044	0.6	0.0973	0.1283	1920592	CBDivE_012317	O=c1c(=NNc2nnn[nH]2)c(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H18	compound treatment	1.336	0.0467	0.63	1.416	-0.04	-0.54	0.0601	0.0721	1306802	CBDivE_012318	Cc1cccc(c1)C(=O)Nc2ccc3oc(nc3c2)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H19	compound treatment	1.26	-0.0293	-0.4	1.477	0.021	0.29	-0.0767	-0.157	1676708	CBDivE_012319	O=c1n(c(CN2CCCCC2)nc3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	H20	compound treatment	1.283	-0.00632	-0.09	1.433	-0.023	-0.31	-0.2816	-0.8681	1920593	CBDivE_012320	COc1cccc(c1)C(=O)Nc2ccc(cc2Br)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I01	compound treatment	1.311	0.0217	0.29	1.424	-0.032	-0.44	-0.1013	-0.193	1920594	CBDivE_012321	C(c1ccccc1)[n+]2cccc(c2)C3OC4CCCCC4C5=CCCCC35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I02	compound treatment	1.23	-0.0593	-0.8	1.448	-0.00795	-0.11	-0.6426	-0.7957	1920595	CBDivE_012322	Cc1ccc2[nH]c3nc(=S)[nH]nc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I03	compound treatment	1.26	-0.0293	-0.4	1.507	0.051	0.7	0.2125	0.2654	1920596	CBDivE_012323	COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I04	compound treatment	1.259	-0.0303	-0.41	1.451	-0.00495	-0.07	-0.337	-0.8129	1920597	CBDivE_012324	CC(=O)Cc1ccc2cccc(O)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I05	compound treatment	1.313	0.0237	0.32	1.456	4.7E-5	0.0	0.2263	0.7085	1920598	CBDivE_012325	Cc1ccc2NC(=O)/C(=N\NC(=O)COc3ccc(cc3C)C(C)(C)C)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I06	compound treatment	1.272	-0.0173	-0.23	1.475	0.019	0.26	0.0184	0.0528	1920599	CBDivE_012326	CN(C)c1cc(NC(=O)c2ccccc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I07	compound treatment	1.366	0.0767	1.03	1.517	0.061	0.83	1.3201	0.9942	1213828	CBDivE_012327	CC(C)c1ccc(cc1)C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I08	compound treatment	1.297	0.00768	0.1	1.497	0.041	0.56	0.4691	0.824	1920600	CBDivE_012328	Brc1ccc2C(=O)N(CNc3ccc(OCc4ccccc4)cc3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I09	compound treatment	1.279	-0.0103	-0.14	1.474	0.018	0.25	0.0756	0.2673	1920601	CBDivE_012329	Cc1c(NC(=O)CN2CCN(CC2)C(=O)c3ccco3)n(Cc4ccccc4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I10	compound treatment	1.317	0.0277	0.37	1.462	0.00605	0.08	0.3224	0.8429	1920602	CBDivE_012330	CC/C(=N/c1cc(nc2ccccc12)N(C)C)/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I11	compound treatment	1.32	0.0307	0.41	1.53	0.074	1.01	1.0067	0.9225	1774720	CBDivE_012331	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)NC2c3ccccc3Oc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I12	compound treatment	1.27	-0.0193	-0.26	1.507	0.051	0.7	0.3079	0.4143	1371057	CBDivE_012332	CN1CCc2c1nc3ccccc3c2NC(=O)CCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I13	compound treatment	1.301	0.0117	0.16	1.5	0.044	0.6	0.5361	0.8634	1920603	CBDivE_012333	CC1CCN(CC1)C(=O)Nc2ccccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I14	compound treatment	1.343	0.0537	0.72	1.476	0.02	0.27	0.7054	0.9113	1920604	CBDivE_012334	Oc1ccc(cc1/C=N/NC(=O)/C(=C\c2ccc3OCOc3c2)/NC(=O)c4ccccc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I15	compound treatment	1.353	0.0637	0.86	1.529	0.073	1.0	1.3118	0.9973	1920605	CBDivE_012335	[O-][N+](=O)c1cccc(c1)S(=O)(=O)c2ccc(c(c2)[N+](=O)[O-])n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I16	compound treatment	1.313	0.0237	0.32	1.482	0.026	0.36	0.477	0.9986	1920606	CBDivE_012336	CN(C)c1cc(/N=C(\N2CCCCC2)/c3ccccc3)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I17	compound treatment	1.37	0.0807	1.09	1.551	0.095	1.3	1.6861	0.9962	1920607	CBDivE_012337	CC(C)CN(CC(C)C)C(=O)Nc1ccccc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I18	compound treatment	1.288	-0.00132	-0.02	1.53	0.074	1.01	0.7014	0.6945	1920608	CBDivE_012338	C/C(=N\NC(=O)COc1c(C)ccc(C)c1C)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I19	compound treatment	1.403	0.114	1.53	1.448	-0.00795	-0.11	1.0077	0.6555	1920609	CBDivE_012339	FC(F)(F)c1ccccc1NC(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	I20	compound treatment	1.324	0.0347	0.47	1.481	0.025	0.34	0.5723	0.988	1920610	CBDivE_012340	CCOc1cc(cc(/C=N/NC(=O)COc2cccc3ccccc23)c1O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J01	compound treatment	1.272	-0.0173	-0.23	1.434	-0.022	-0.3	-0.3769	-0.9925	1352712	CBDivE_012341	Clc1cccc(NC(=O)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J02	compound treatment	1.26	-0.0293	-0.4	1.453	-0.00295	-0.04	-0.3082	-0.7751	1920611	CBDivE_012342	C(/C(=N\Nc1ccccc1)/c2ccc(cc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J03	compound treatment	1.213	-0.0763	-1.03	1.388	-0.068	-0.93	-1.3833	-0.9986	1920612	CBDivE_012343	O=C(N/C(=C(\Sc1nc2ccccc2s1)/c3ccccc3)/C(=O)N4CCCCC4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J04	compound treatment	1.279	-0.0103	-0.14	1.453	-0.00295	-0.04	-0.1269	-0.8757	1250457	CBDivE_012344	COc1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J05	compound treatment	1.234	-0.0553	-0.75	1.432	-0.024	-0.33	-0.7587	-0.9313	1254960	CBDivE_012345	OC(=O)C(Cc1ccccc1)NC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J06	compound treatment	1.261	-0.0283	-0.38	1.383	-0.073	-0.99	-0.9736	-0.9136	1920613	CBDivE_012346	Cc1cccc(NC(=O)CC2(C(=O)c3ccccc3C2=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J07	compound treatment	1.291	0.00168	0.02	1.447	-0.00895	-0.12	-0.0703	-0.5661	1920614	CBDivE_012347	O=C(NCc1ccccc1)/C(=C(/Sc2ccccn2)\c3ccccc3)/NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J08	compound treatment	1.316	0.0267	0.36	1.458	0.00205	0.03	0.2742	0.7597	1530237	CBDivE_012348	Cc1ccc(NC(=O)CC2(C(=O)c3ccccc3C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J09	compound treatment	1.254	-0.0353	-0.48	1.466	0.01	0.14	-0.24	-0.4842	1457475	CBDivE_012349	CCOC(=S)SCc1nc2ccccc2c(=O)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J10	compound treatment	1.255	-0.0343	-0.46	1.451	-0.00495	-0.07	-0.3751	-0.8018	1419187	CBDivE_012350	OC1(CCC2(O)CCCC2)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J11	compound treatment	1.286	-0.00332	-0.04	1.481	0.025	0.34	0.2098	0.6092	1013989	CBDivE_012351	Nc1ccc(cc1)C(=O)Nc2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J12	compound treatment	1.257	-0.0323	-0.44	1.457	0.00105	0.01	-0.2982	-0.6836	1920615	CBDivE_012352	CC(CC(=O)O)N[C@H](C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J13	compound treatment	1.282	-0.00732	-0.1	1.42	-0.036	-0.49	-0.4165	-0.8328	1723866	CBDivE_012353	Nc1ccc(cc1)c2nc3cc(N)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J14	compound treatment	1.258	-0.0313	-0.42	1.389	-0.067	-0.91	-0.9444	-0.9387	1920616	CBDivE_012354	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J15	compound treatment	1.274	-0.0153	-0.21	1.491	0.035	0.48	0.1918	0.3684	1085589	CBDivE_012355	Oc1ccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J16	compound treatment	1.189	-0.1	-1.35	1.439	-0.017	-0.23	-1.1205	-0.8161	1920617	CBDivE_012356	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)c2cncc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J17	compound treatment	1.261	-0.0283	-0.38	1.491	0.035	0.48	0.0678	0.1108	1920618	CBDivE_012357	Cn1cc(/N=C/c2c[nH]c3ccccc23)c(n1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J18	compound treatment	1.219	-0.0703	-0.95	1.422	-0.034	-0.46	-0.9982	-0.9456	1093078	CBDivE_012358	CN(C)CCCC1(O)c2ccccc2CCc3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J19	compound treatment	1.272	-0.0173	-0.23	1.515	0.059	0.81	0.4041	0.482	1920619	CBDivE_012359	CCc1ccccc1OCC(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	J20	compound treatment	1.309	0.0197	0.27	1.474	0.018	0.25	0.3618	0.9993	1730478	CBDivE_012360	COC(=O)c1ccc(CO)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K01	compound treatment	1.207	-0.0823	-1.11	1.503	0.047	0.64	-0.3316	-0.2586	1567628	CBDivE_012361	O=c1c(=Cc2ccccc2)sc3nc4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K02	compound treatment	1.262	-0.0273	-0.37	1.426	-0.03	-0.41	-0.5494	-0.9987	1920620	CBDivE_012362	[O-][N+](=O)c1cc(/C=N\NC(=O)COc2ccccc2Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K03	compound treatment	1.265	-0.0243	-0.33	1.468	0.012	0.16	-0.1158	-0.3157	1291698	CBDivE_012363	Fc1ccc(NC(=S)NC(=O)C2(CC3CC4CC(C3)C2)C4)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K04	compound treatment	1.238	-0.0513	-0.69	1.432	-0.024	-0.33	-0.7205	-0.9412	1920621	CBDivE_012364	COc1cc(/C=N/NC(=O)COc2ccccc2Cl)ccc1OC(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K05	compound treatment	1.384	0.0947	1.28	1.484	0.028	0.38	1.1736	0.8802	1307239	CBDivE_012365	CCOC(=O)C1CCN(CC1)C(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K06	compound treatment	1.287	-0.00232	-0.03	1.487	0.031	0.42	0.2772	0.6531	1146991	CBDivE_012366	NCC1(CC2CC3C1)CC(CC(=O)O)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K07	compound treatment	1.289	-3.2E-4	0.0	1.495	0.039	0.53	0.3735	0.7014	1920622	CBDivE_012367	CCOc1cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc(I)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K08	compound treatment	1.282	-0.00732	-0.1	1.462	0.00605	0.08	-0.0115	-0.0895	1920623	CBDivE_012368	NCCC1(CC2CC3C1)CC(CC(=O)O)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K09	compound treatment	1.238	-0.0513	-0.69	1.504	0.048	0.66	-0.0263	-0.0276	1920624	CBDivE_012369	COc1ccc2ccccc2c1/C=N/Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K10	compound treatment	1.3	0.0107	0.14	1.49	0.034	0.46	0.4302	0.8849	1469954	CBDivE_012370	NCCC1(CC2CC3C1)CC(C2)(C3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K11	compound treatment	1.385	0.0957	1.29	1.504	0.048	0.66	1.376	0.9506	1060631	CBDivE_012371	COC(=O)C1=NNC(C1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K12	compound treatment	1.281	-0.00832	-0.11	1.455	-9.53E-4	-0.01	-0.0886	-0.7837	1920625	CBDivE_012372	Cc1cc(OCC(=O)N/N=C/c2ccc(s2)[N+](=O)[O-])cc(C)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K13	compound treatment	1.221	-0.0683	-0.92	1.557	0.101	1.38	0.3226	0.1946	1920626	CBDivE_012373	COC(=O)c1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K14	compound treatment	1.275	-0.0143	-0.19	1.481	0.025	0.34	0.1049	0.2674	1920627	CBDivE_012374	COc1cc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K15	compound treatment	1.365	0.0757	1.02	1.509	0.053	0.72	1.2334	0.9858	1920628	CBDivE_012375	CN1/C(=C/C(=O)c2ccco2)/Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K16	compound treatment	1.303	0.0137	0.18	1.514	0.058	0.79	0.6902	0.8492	1920629	CBDivE_012376	Fc1cccc(c1)C(=O)Oc2cccc(/C=N/NC(=O)COc3ccccc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K17	compound treatment	1.283	-0.00632	-0.09	1.538	0.082	1.12	0.7308	0.6513	1299749	CBDivE_012377	CCN(CC)C(=O)COc1ccc2c(C)cc(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K18	compound treatment	1.32	0.0307	0.41	1.455	-9.53E-4	-0.01	0.2835	0.6846	1920630	CBDivE_012378	CN1C(=O)N(C)C(=O)C(=C(C)Nc2cccc3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K19	compound treatment	1.353	0.0637	0.86	1.574	0.118	1.61	1.7457	0.9568	1920631	CBDivE_012379	Cc1ccc(NNS(=O)(=O)c2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	K20	compound treatment	1.344	0.0547	0.74	1.53	0.074	1.01	1.2356	0.9881	1920632	CBDivE_012380	Cc1cc(C)cc(OCC(=O)N/N=C/2\C(=O)Nc3c2cc(Br)cc3Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L01	compound treatment	1.258	-0.0313	-0.42	1.415	-0.041	-0.56	-0.6937	-0.9905	1920633	CBDivE_012381	COc1cc(/C=N/c2cn(C)nc2C(=O)N)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L02	compound treatment	1.246	-0.0433	-0.58	1.384	-0.072	-0.98	-1.107	-0.9694	1920634	CBDivE_012382	[O-][N+](=O)c1ccc(/C=C/C=N/NC(=O)c2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L03	compound treatment	1.3	0.0107	0.14	1.431	-0.025	-0.34	-0.1387	-0.3754	1920635	CBDivE_012383	CCc1ccccc1OCC(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L04	compound treatment	1.24	-0.0493	-0.67	1.399	-0.057	-0.78	-1.0196	-0.997	1920636	CBDivE_012384	COc1cc(/C=N/c2ccc3oc(nc3c2)c4ccc(cc4)C(C)(C)C)ccc1OC(=O)c5ccc(Cl)cc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L05	compound treatment	1.184	-0.105	-1.42	1.48	0.024	0.33	-0.7728	-0.53	1920637	CBDivE_012385	O/N=C(\Sc1nnnn1c2ccccc2)/C(=N\O)/Sc3nnnn3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L06	compound treatment	1.288	-0.00132	-0.02	1.396	-0.06	-0.82	-0.5907	-0.7223	1920638	CBDivE_012386	Cc1ccccc1OCC(=O)N/N=C/c2cc3ccccc3nc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L07	compound treatment	1.244	-0.0453	-0.61	1.447	-0.00895	-0.12	-0.5186	-0.8319	1920639	CBDivE_012387	CC(=O)Nc1cc2OCCOCCOCCOCCOCCOc2cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L08	compound treatment	1.249	-0.0403	-0.54	1.455	-9.53E-4	-0.01	-0.3938	-0.7238	1920640	CBDivE_012388	O=C(Cc1ccccc1)SSC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L09	compound treatment	1.276	-0.0133	-0.18	1.459	0.00305	0.04	-0.0977	-0.5296	1920641	CBDivE_012389	Nc1nonc1NC(=O)N/N=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L10	compound treatment	1.285	-0.00432	-0.06	1.409	-0.047	-0.64	-0.4939	-0.7683	1920642	CBDivE_012390	O=C(CCCCC(=O)Nc1cccc2ccccc12)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L11	compound treatment	1.244	-0.0453	-0.61	1.409	-0.047	-0.64	-0.8851	-0.9997	1403000	CBDivE_012391	O=c1n(c(CNc2ccccc2)nc3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L12	compound treatment	1.277	-0.0123	-0.17	1.432	-0.024	-0.33	-0.3485	-0.9509	1545799	CBDivE_012392	Cn1c2C(=O)CCCc2c3cc(Oc4ccccc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L13	compound treatment	1.343	0.0537	0.72	1.441	-0.015	-0.2	0.3679	0.489	1418265	CBDivE_012393	O=c1n(c(CN2CCOCC2)nc3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L14	compound treatment	1.32	0.0307	0.41	1.423	-0.033	-0.45	-0.0251	-0.041	1920643	CBDivE_012394	COc1ccc2nc(/N=C/c3cc(Cl)cc([N+](=O)[O-])c3O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L15	compound treatment	1.288	-0.00132	-0.02	1.388	-0.068	-0.93	-0.6678	-0.7206	1774966	CBDivE_012395	[O-][N+](=O)c1ccc(/C=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L16	compound treatment	1.265	-0.0243	-0.33	1.463	0.00705	0.1	-0.164	-0.4798	1920644	CBDivE_012396	CCOC(=O)CN(C(=O)c1ccccc1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L17	compound treatment	1.312	0.0227	0.31	1.457	0.00105	0.01	0.2265	0.7393	537	CBDivE_012397	ONC(=O)Cc1ccsc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L18	compound treatment	1.277	-0.0123	-0.17	1.422	-0.034	-0.46	-0.4449	-0.9044	1777728	CBDivE_012398	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc3oc(nc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L19	compound treatment	1.273	-0.0163	-0.22	1.521	0.065	0.89	0.4715	0.5159	1591520	CBDivE_012399	CC(=O)N1CCOCCOCCN(CCOCC1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	L20	compound treatment	1.234	-0.0553	-0.75	1.458	0.00205	0.03	-0.508	-0.6802	1920645	CBDivE_012400	CCOc1ccc2N(Cc3cccc(CN4c5ccc(OCC)cc5C(=CC4(C)C)C)c3)C(C)(C)C=C(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M01	compound treatment	1.358	0.0687	0.93	1.439	-0.017	-0.23	0.4917	0.5149	1920646	CBDivE_012401	NC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M02	compound treatment	1.244	-0.0453	-0.61	1.425	-0.031	-0.42	-0.7308	-0.9836	1111768	CBDivE_012402	COc1ccc(cc1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M03	compound treatment	1.299	0.00968	0.13	1.48	0.024	0.33	0.3242	0.9185	1142071	CBDivE_012403	Fc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M04	compound treatment	1.225	-0.0643	-0.87	1.476	0.02	0.27	-0.4203	-0.462	1920647	CBDivE_012404	Cc1cc(C)cc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M05	compound treatment	1.429	0.14	1.88	1.445	-0.011	-0.15	1.2268	0.649	1037834	CBDivE_012405	O=C(NCc1ccccc1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M06	compound treatment	1.239	-0.0503	-0.68	1.474	0.018	0.25	-0.306	-0.4238	1920648	CBDivE_012406	[O-][N+](=O)c1cccc(c1)c2nc3ccccc3n2c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M07	compound treatment	1.298	0.00868	0.12	1.477	0.021	0.29	0.2857	0.9218	3020892	CBDivE_012407	C/C=C(\C=C)/C(=O)O.CC(C)NC(=O)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M08	compound treatment	1.279	-0.0103	-0.14	1.441	-0.015	-0.2	-0.2426	-0.9827	1920650	CBDivE_012408	Cc1cc(C)cc(OCC(=O)N/N=C/c2ccc(s2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M09	compound treatment	1.398	0.109	1.47	1.528	0.072	0.98	1.7314	0.981	1162603	CBDivE_012409	CCCc1ccc(OCC(=O)Nc2nccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M10	compound treatment	1.287	-0.00232	-0.03	1.466	0.01	0.14	0.0747	0.5319	1222877	CBDivE_012410	Nc1nc(cs1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M11	compound treatment	1.375	0.0857	1.16	1.492	0.036	0.49	1.1649	0.9274	1592555	CBDivE_012411	COC(=O)c1ccc(NC(=O)COc2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M12	compound treatment	1.291	0.00168	0.02	1.413	-0.043	-0.59	-0.3981	-0.6792	1920651	CBDivE_012412	Cc1ccc(cc1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M13	compound treatment	1.292	0.00268	0.04	1.553	0.097	1.32	0.9613	0.7262	1920652	CBDivE_012413	[O-][N+](=O)c1cccc(c1)N(Cc2ccccc2)C(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M14	compound treatment	1.306	0.0167	0.23	1.492	0.036	0.49	0.5067	0.9373	1222077	CBDivE_012414	O=C1N(CCSC(=S)N2CCOCC2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M15	compound treatment	1.265	-0.0243	-0.33	1.473	0.017	0.23	-0.0676	-0.1682	1920653	CBDivE_012415	Clc1ccc(/C=C\2/N=C(OC2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M16	compound treatment	1.286	-0.00332	-0.04	1.458	0.00205	0.03	-0.0119	-0.2261	1558924	CBDivE_012416	OC(=O)CCSC(=S)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M17	compound treatment	1.392	0.103	1.39	1.505	0.049	0.67	1.4524	0.9442	1236314	CBDivE_012417	Clc1ccc(Sc2c(nc3ccccn23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M18	compound treatment	1.291	0.00168	0.02	1.496	0.04	0.55	0.4022	0.7358	1048622	CBDivE_012418	Oc1ccc(CN2CCOCC2)c(O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M19	compound treatment	1.388	0.0987	1.33	1.569	0.113	1.54	2.0314	0.9973	1920654	CBDivE_012419	[O-][N+](=O)c1ccc(/C=N/c2cccc3c(\N=C\c4ccc(s4)[N+](=O)[O-])cccc23)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	M20	compound treatment	1.324	0.0347	0.47	1.49	0.034	0.46	0.6591	1.0	1314298	CBDivE_012420	NNc1nc(cs1)c2ccc(O)c(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N01	compound treatment	1.223	-0.0663	-0.89	1.392	-0.064	-0.87	-1.2493	-0.9999	1920655	CBDivE_012421	c1ccc2nc3nc4c5ccccc5c6ccccc6c4nc3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N02	compound treatment	1.214	-0.0753	-1.02	1.388	-0.068	-0.93	-1.3737	-0.9989	1920656	CBDivE_012422	OC(CC#CCN1CCCC1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N03	compound treatment	1.297	0.00768	0.1	1.389	-0.067	-0.91	-0.5723	-0.6229	1920657	CBDivE_012423	Clc1ccc(cc1)S(=O)(=O)CCS(=O)(=O)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N04	compound treatment	1.245	-0.0443	-0.6	1.318	-0.138	-1.88	-1.753	-0.8881	1920658	CBDivE_012424	CCN(CC)P1(=S)OCc2ccccc2CO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N05	compound treatment	1.304	0.0147	0.2	1.404	-0.052	-0.71	-0.3609	-0.4906	1920659	CBDivE_012425	Clc1ccc(Oc2ccc(NC(=O)NC(=O)COc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N06	compound treatment	1.275	-0.0143	-0.19	1.399	-0.057	-0.78	-0.6858	-0.8569	1920660	CBDivE_012426	Cn1c(=O)n(C)c2cccc3cccc1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N07	compound treatment	1.2	-0.0893	-1.2	1.45	-0.00595	-0.08	-0.9095	-0.753	1920661	CBDivE_012427	C(c1nc2nc(cc(c3ccccc3)n2n1)c4ccccc4)c5nc6nc(cc(c7ccccc7)n6n5)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N08	compound treatment	1.214	-0.0753	-1.02	1.386	-0.07	-0.95	-1.393	-0.9995	1920662	CBDivE_012428	Cc1cc(C)c(/C=N/O)c(C)c1CCCCCCc2c(C)cc(C)c(\C=N/O)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N09	compound treatment	1.232	-0.0573	-0.77	1.419	-0.037	-0.5	-0.9031	-0.9785	1736131	CBDivE_012429	Cc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N10	compound treatment	1.254	-0.0353	-0.48	1.449	-0.00695	-0.09	-0.404	-0.8315	1920663	CBDivE_012430	ClC(Cl)(Cl)C(=O)Nc1cnn(c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N11	compound treatment	1.244	-0.0453	-0.61	1.429	-0.027	-0.37	-0.6922	-0.9703	1920664	CBDivE_012431	COc1ccc(cc1)N2C(=O)C3C(C2=O)C4(C(=O)C3(C(=C4c5ccccc5)c6ccccc6)c7ccccc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N12	compound treatment	1.226	-0.0633	-0.85	1.401	-0.055	-0.75	-1.1339	-0.9979	1920665	CBDivE_012432	COC(=O)c1ccc2nc(/N=C/c3cccc(OC)c3)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N13	compound treatment	1.295	0.00568	0.08	1.42	-0.036	-0.49	-0.2925	-0.5894	1538843	CBDivE_012433	Oc1ccc2c(CN3CCCC3)c(O)ccc2c1CN4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N14	compound treatment	1.257	-0.0323	-0.44	1.434	-0.022	-0.3	-0.52	-0.9832	1920666	CBDivE_012434	Cc1cc(ccc1OCC(=O)N/N=C/2\C(=O)Nc3ccccc23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N15	compound treatment	1.242	-0.0473	-0.64	1.419	-0.037	-0.5	-0.8077	-0.9931	1920667	CBDivE_012435	COC(=O)C(CCSC)NC(=O)COc1ccc2c(C)cc(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N16	compound treatment	1.298	0.00868	0.12	1.442	-0.014	-0.19	-0.0517	-0.2316	1920668	CBDivE_012436	[O-][N+](=O)c1ccc(cc1)c2ccc(/C=N/c3ccc4oc(nc4c3)c5ccc(Cl)cc5)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N17	compound treatment	1.226	-0.0633	-0.85	1.438	-0.018	-0.24	-0.7771	-0.8746	1920669	CBDivE_012437	FC(F)(F)c1oc2cc(OC(=O)C(Cc3c[nH]c4ccccc34)NC(=O)OCc5ccccc5)ccc2c(=O)c1Oc6ccc(Cl)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N18	compound treatment	1.326	0.0367	0.49	1.415	-0.041	-0.56	-0.045	-0.0603	1696772	CBDivE_012438	CCOc1ccc(cc1)C(CN)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N19	compound treatment	1.256	-0.0333	-0.45	1.502	0.046	0.63	0.1262	0.1634	1920670	CBDivE_012439	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)COc3ccc4c(C)cc(=O)oc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	N20	compound treatment	1.244	-0.0453	-0.61	1.402	-0.054	-0.74	-0.9526	-0.9958	1280449	CBDivE_012440	COc1ccc(cc1)c2nc(CN3CCCCC3)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O01	compound treatment	1.359	0.0697	0.94	1.501	0.045	0.61	1.0991	0.9787	1920671	CBDivE_012441	[O-][N+](=O)c1cccc(/C=C\C=N\NC(=O)c2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O02	compound treatment	1.238	-0.0513	-0.69	1.48	0.024	0.33	-0.2577	-0.3364	1048616	CBDivE_012442	Oc1c(O)c(CN2CCOCC2)cc(CN3CCOCC3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O03	compound treatment	1.227	-0.0623	-0.84	1.508	0.052	0.71	-0.0926	-0.0842	1920672	CBDivE_012443	Oc1ccc(cc1Br)C(=O)N/N=C/2\C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O04	compound treatment	1.338	0.0487	0.66	1.445	-0.011	-0.15	0.3588	0.5327	1483338	CBDivE_012444	O=C1N(CCSC(=S)N2CCOCC2)Cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O05	compound treatment	1.223	-0.0663	-0.89	1.464	0.00805	0.11	-0.5551	-0.6158	1920673	CBDivE_012445	Cc1[nH]c2ccccc2c1/C=C/3\SC(=S)NC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O06	compound treatment	1.253	-0.0363	-0.49	1.434	-0.022	-0.3	-0.5581	-0.9721	1920674	CBDivE_012446	CN(C)c1cc(N)c2cc(C)cc(C)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O07	compound treatment	1.252	-0.0373	-0.5	1.464	0.00805	0.11	-0.2784	-0.5403	1693425	CBDivE_012447	C1CN(C(N1c2ccccc2)c3cccc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O08	compound treatment	1.3	0.0107	0.14	1.483	0.027	0.37	0.3627	0.9159	1920675	CBDivE_012448	C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O09	compound treatment	1.33	0.0407	0.55	1.482	0.026	0.36	0.6392	0.9778	1920676	CBDivE_012449	[O-][N+](=O)c1ccc2NC(=O)/C(=N\NC(=O)c3ccc(Cl)cc3)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O10	compound treatment	1.249	-0.0403	-0.54	1.468	0.012	0.16	-0.2685	-0.4725	1920677	CBDivE_012450	CCC1=[N+](CC)CCn2c(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O11	compound treatment	1.397	0.108	1.45	1.482	0.026	0.36	1.2784	0.8548	1920678	CBDivE_012451	[O-][N+](=O)c1cccc(/C=N/c2ccc(\N=C\c3cccc(c3)[N+](=O)[O-])c(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O12	compound treatment	1.305	0.0157	0.21	1.477	0.021	0.29	0.3525	0.9887	1397602	CBDivE_012452	CC(=O)NN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O13	compound treatment	1.298	0.00868	0.12	1.473	0.017	0.23	0.2472	0.9496	1920679	CBDivE_012453	CN1C(=O)/C(=N\NC(=O)c2cccc(c2)[N+](=O)[O-])/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O14	compound treatment	1.249	-0.0403	-0.54	1.458	0.00205	0.03	-0.3649	-0.6699	1920680	CBDivE_012454	Clc1ccc(NC(=O)Nc2cccc3c(=O)[nH][nH]c(=O)c23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O15	compound treatment	1.396	0.107	1.44	1.503	0.047	0.64	1.4713	0.9337	1920681	CBDivE_012455	O=C(NN1C(=O)c2ccccc2C1=O)c3ccc(cc3)C(=O)NN4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O16	compound treatment	1.333	0.0437	0.59	1.477	0.021	0.29	0.6196	0.9453	1920682	CBDivE_012456	Clc1ccccc1C(=O)N/N=C/2\C(=O)Nc3c2cc(Br)cc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O17	compound treatment	1.343	0.0537	0.72	1.57	0.114	1.56	1.6118	0.9395	1457336	CBDivE_012457	O=C1N(C(=O)c2cc(ccc12)c3nc4ccccc4o3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O18	compound treatment	1.287	-0.00232	-0.03	1.504	0.048	0.66	0.4412	0.6726	1920683	CBDivE_012458	C/C(=N\NC(=O)COc1ccc(Cl)c(C)c1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O19	compound treatment	1.406	0.117	1.57	1.54	0.084	1.15	1.9235	0.9878	1920684	CBDivE_012459	Nc1cc(ccc1C(=O)O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	O20	compound treatment	1.234	-0.0553	-0.75	1.494	0.038	0.52	-0.1608	-0.177	1068272	CBDivE_012460	Cc1ccc2c(C)nc(NC(=N)N)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P01	compound treatment	1.254	-0.0353	-0.48	1.454	-0.00195	-0.03	-0.3558	-0.7455	1920685	CBDivE_012461	Cc1oc2c(CN3CCCC3C(=O)O)c(O)ccc2c(=O)c1Oc4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P02	compound treatment	1.227	-0.0623	-0.84	1.407	-0.049	-0.67	-1.0665	-0.9935	1053984	CBDivE_012462	CC1=Nc2ccccc2N=C(C)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P03	compound treatment	1.287	-0.00232	-0.03	1.353	-0.103	-1.4	-1.0148	-0.7227	1920686	CBDivE_012463	Cc1oc2c(CNCCCCCC(=O)O)c(O)ccc2c(=O)c1c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P04	compound treatment	1.202	-0.0873	-1.18	1.426	-0.03	-0.41	-1.1218	-0.8997	1920687	CBDivE_012464	CCOC(=O)c1c(NC(=O)C)sc2/C(=N\O)/CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P05	compound treatment	1.247	-0.0423	-0.57	1.413	-0.043	-0.59	-0.8179	-0.9999	1920688	CBDivE_012465	Cc1oc2cc(OCC(=O)N3CCCC3C(=O)N)ccc2c(=O)c1c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P06	compound treatment	1.215	-0.0743	-1.0	1.377	-0.079	-1.08	-1.4703	-0.9994	1920689	CBDivE_012466	CCOC(=O)c1c(/N=C\N(C)C)sc2C(=O)CCCc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P07	compound treatment	1.229	-0.0603	-0.81	1.424	-0.032	-0.44	-0.8835	-0.9572	1920690	CBDivE_012467	Cc1oc2c(CN3CCCC3C(=O)O)c(O)ccc2c(=O)c1Oc4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P08	compound treatment	1.253	-0.0363	-0.49	1.398	-0.058	-0.79	-0.9053	-0.9736	1920691	CBDivE_012468	COc1cc(/C=N/c2ccc3[nH]c(=O)[nH]c3c2)ccc1OC(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P09	compound treatment	1.178	-0.111	-1.5	1.336	-0.12	-1.64	-2.2186	-0.9991	1920692	CBDivE_012469	Cc1nnc(NC(=O)CCN2C(=O)/C(=C/c3ccccc3)/SC2=S)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P10	compound treatment	0.777	-0.512	-6.91	0.898	-0.558	-7.61	-10.2672	-0.9988	1920693	CBDivE_012470	FC(F)(F)c1cccc(NC(=O)CC2(C(=O)c3ccccc3C2=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P11	compound treatment	1.248	-0.0413	-0.56	1.427	-0.029	-0.39	-0.6733	-0.9857	1920694	CBDivE_012471	OC(=O)C(Cc1ccccc1)NCc2c(O)ccc3c(=O)c(Oc4ccc(F)cc4)coc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P12	compound treatment	1.217	-0.0723	-0.98	1.345	-0.111	-1.51	-1.7597	-0.9775	1920695	CBDivE_012472	CC(C)NCC(O)COc1ccc2[nH]cc(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P13	compound treatment	1.244	-0.0453	-0.61	1.41	-0.046	-0.63	-0.8754	-0.9999	1920696	CBDivE_012473	COC(=O)C(Cc1ccc(O)cc1)NC(=O)COc2ccc3c(=O)c(Oc4ccccc4)coc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P14	compound treatment	1.244	-0.0453	-0.61	1.437	-0.019	-0.26	-0.6151	-0.9266	1920697	CBDivE_012474	Oc1ccc(cc1)C(=O)/C=C/C=C(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P15	compound treatment	1.34	0.0507	0.68	1.476	0.02	0.27	0.6768	0.9191	1920698	CBDivE_012475	COc1ccc(cc1)c2nc(c(SC(=O)c3ccc(Cl)cc3)[nH]2)S(=O)(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P16	compound treatment	1.262	-0.0273	-0.37	1.406	-0.05	-0.68	-0.7423	-0.9584	1920699	CBDivE_012476	CC(=O)Cc1[n+](C)ccc2c([N+](=O)[O-])c(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P17	compound treatment	1.213	-0.0763	-1.03	1.41	-0.046	-0.63	-1.1711	-0.9717	1920700	CBDivE_012477	COCCOC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2C1c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P18	compound treatment	1.12	-0.169	-2.28	1.444	-0.012	-0.16	-1.7305	-0.7556	1920701	CBDivE_012478	O=C(CC/1(C(=O)c2ccccc2\C1=N/Nc3ccccc3)c4ccccc4)Nc5ccncc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P19	compound treatment	1.288	-0.00132	-0.02	1.41	-0.046	-0.63	-0.4557	-0.7269	1920702	CBDivE_012479	CN(C)C(=S)N/C(=N/CC\N=C(\NC(=S)N(C)C)/c1ccc(cc1)[N+](=O)[O-])/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.39	P20	compound treatment	1.25	-0.0393	-0.53	1.391	-0.065	-0.89	-1.0014	-0.9699	1920703	CBDivE_012480	CCCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(N3CCOCC3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A01	compound treatment	1.095	0.00291	0.04	1.227	0.0121	0.16	0.1441	0.8519	1912953	CBDivE_000961	CC(=O)N/C(=C\c1ccccc1)/C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A02	compound treatment	1.096	0.00391	0.05	1.266	0.0511	0.7	0.5297	0.7585	1726805	CBDivE_000962	CCOC(=O)C1=C(C)OC2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A03	compound treatment	1.036	-0.0561	-0.76	1.171	-0.0439	-0.6	-0.9587	-0.9933	1912954	CBDivE_000963	ClCC(=O)NNC(=O)C1CC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A04	compound treatment	1.161	0.0689	0.93	1.298	0.0831	1.13	1.4583	0.9952	1912955	CBDivE_000964	CC(=O)C1=C(C)OC2(O)c3ccccc3C(=O)C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A05	compound treatment	1.041	-0.0511	-0.69	1.206	-0.00894	-0.12	-0.5735	-0.8194	1912956	CBDivE_000965	COc1ccc(/C=N/NC(=O)C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A06	compound treatment	1.095	0.00291	0.04	1.236	0.0211	0.29	0.2308	0.7963	1498599	CBDivE_000966	CCOC(=O)C1(CCCC1=O)C2(O)C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A07	compound treatment	1.15	0.0579	0.78	1.221	0.00606	0.08	0.6109	0.7776	1912957	CBDivE_000967	C/C(=N\NC(=O)C1CC1c2ccccc2)/c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A08	compound treatment	1.054	-0.0381	-0.51	1.278	0.0631	0.86	0.2447	0.2443	1912958	CBDivE_000968	OCC1=C(C(=O)O)C2(O)C(=O)c3ccccc3C2(O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A09	compound treatment	1.092	-9.06E-5	0.0	1.243	0.0281	0.38	0.2697	0.7048	1912959	CBDivE_000969	O=C(N/N=C\1/C(=O)Nc2ccccc12)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A10	compound treatment	1.165	0.0729	0.98	1.181	-0.0339	-0.46	0.3683	0.3388	1241918	CBDivE_000970	COc1ccc2C3N(C(Cc4c3[nH]c5ccccc45)C(=O)O)C(=O)c2c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A11	compound treatment	1.066	-0.0261	-0.35	1.234	0.0191	0.26	-0.0651	-0.1487	1912960	CBDivE_000971	O=C(N/N=C/c1c[nH]c2ccccc12)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A12	compound treatment	1.176	0.0839	1.13	1.252	0.0371	0.51	1.1578	0.934	1912961	CBDivE_000972	OC12OC(=C(C(=O)C(F)(F)F)C2(O)C(=O)c3ccccc31)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A13	compound treatment	1.07	-0.0221	-0.3	1.215	6.25E-5	0.0	-0.2101	-0.7051	1912962	CBDivE_000973	C/C(=N\NC(=O)C1CC1c2ccccc2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A14	compound treatment	1.117	0.0249	0.34	1.228	0.0131	0.18	0.3636	0.9559	1912963	CBDivE_000974	OC12OC(=C(C(=O)C(F)(F)F)C2(O)C(=O)c3ccccc31)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A15	compound treatment	1.024	-0.0681	-0.92	1.137	-0.0779	-1.06	-1.401	-0.9974	1912964	CBDivE_000975	CC(=O)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A16	compound treatment	1.129	0.0369	0.5	1.249	0.0341	0.46	0.6805	0.9994	1912965	CBDivE_000976	Cc1cc(C)cc(OP(=O)(Oc2ccccc2)Oc3cc(C)cc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A17	compound treatment	1.043	-0.0491	-0.66	1.257	0.0421	0.57	-0.0627	-0.0716	1912966	CBDivE_000977	CCOC(=O)C/C(=N/c1ccc(Cl)cc1N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A18	compound treatment	1.126	0.0339	0.46	1.234	0.0191	0.26	0.5073	0.9641	1912967	CBDivE_000978	O=P1(NCCCO1)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A19	compound treatment	1.092	-9.06E-5	0.0	1.25	0.0351	0.48	0.3372	0.7053	1912968	CBDivE_000979	[O-][N+](=O)c1cc(Cl)ccc1NC(=O)CC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	A20	compound treatment	1.133	0.0409	0.55	1.196	-0.0189	-0.26	0.2076	0.3408	1912969	CBDivE_000980	CC(C)OP(=O)(C)/C(=C(/C)\O)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B01	compound treatment	1.06	-0.0321	-0.43	1.178	-0.0369	-0.5	-0.6623	-0.9972	1912970	CBDivE_000981	C/C(=N\NC(=O)c1ccccc1I)/c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B02	compound treatment	1.105	0.0129	0.17	1.289	0.0741	1.01	0.8373	0.817	1235517	CBDivE_000982	CC(C)Cc1ccc(cc1)C(C)C(=O)OCC(=O)c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B03	compound treatment	1.142	0.0499	0.67	1.29	0.0751	1.02	1.1999	0.9794	1912971	CBDivE_000983	Ic1ccccc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B04	compound treatment	1.153	0.0609	0.82	1.248	0.0331	0.45	0.8998	0.9601	3105181	CBDivE_000984	CCOC(=N)c1c[nH]c2ccccc12.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B05	compound treatment	1.109	0.0169	0.23	1.27	0.0551	0.75	0.6922	0.8821	1912972	CBDivE_000985	Cc1cccc(c1)C(=O)NNC(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B06	compound treatment	1.16	0.0679	0.92	1.235	0.0201	0.27	0.8413	0.8799	1036269	CBDivE_000986	CN(C)Cc1c[nH]c2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B07	compound treatment	1.166	0.0739	1.0	1.181	-0.0339	-0.46	0.3778	0.3437	1912973	CBDivE_000987	Cc1cccc(c1)C(=O)NNC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B08	compound treatment	1.111	0.0189	0.26	1.221	0.00606	0.08	0.2388	0.8907	1721516	CBDivE_000988	COc1ccc(c(F)c1)c2cc(C(=O)O)c3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B09	compound treatment	1.101	0.00891	0.12	1.207	-0.00794	-0.11	0.0085	0.0523	1912974	CBDivE_000989	Cc1cccc(c1)C(=O)N/N=C\2/C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B10	compound treatment	1.094	0.00191	0.03	1.232	0.0171	0.23	0.1827	0.7806	1912975	CBDivE_000990	O=C(Cc1ccccc1)N2CCC(C2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B11	compound treatment	1.062	-0.0301	-0.41	1.162	-0.0529	-0.72	-0.7975	-0.9629	1912976	CBDivE_000991	O=C(NNC(=O)c1ccc(cc1)c2ccccc2)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B12	compound treatment	1.15	0.0579	0.78	1.202	-0.0129	-0.18	0.4277	0.534	1158303	CBDivE_000992	O=C(N1CC(CC1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B13	compound treatment	1.112	0.0199	0.27	1.204	-0.0109	-0.15	0.0845	0.2749	1912977	CBDivE_000993	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B14	compound treatment	1.117	0.0249	0.34	1.182	-0.0329	-0.45	-0.08	-0.1426	1912978	CBDivE_000994	CC(=O)N1c2ccccc2C(C)(CC1(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B15	compound treatment	1.134	0.0419	0.57	1.335	0.12	1.64	1.5575	0.8992	1597486	CBDivE_000995	O=C(NN1C(=O)c2ccccc2C1=O)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B16	compound treatment	1.172	0.0799	1.08	1.23	0.0151	0.21	0.9075	0.827	1912979	CBDivE_000996	CC1CNN(C1)c2ccc(cc2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B17	compound treatment	1.129	0.0369	0.5	1.223	0.00806	0.11	0.4298	0.8429	1912980	CBDivE_000997	OC(=O)c1ccccc1C(=O)NNC(=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B18	compound treatment	1.147	0.0549	0.74	1.174	-0.0409	-0.56	0.1291	0.1391	1912981	CBDivE_000998	CCCC(=O)NNc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B19	compound treatment	1.114	0.0219	0.3	1.211	-0.00394	-0.05	0.171	0.5693	1912982	CBDivE_000999	CC/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	B20	compound treatment	1.068	-0.0241	-0.32	1.209	-0.00594	-0.08	-0.2871	-0.8571	1912983	CBDivE_001000	O=C(Cc1ccccc1)NNc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C01	compound treatment	1.064	-0.0281	-0.38	1.22	0.00506	0.07	-0.2192	-0.5689	1912984	CBDivE_001001	Cc1c(/N=C/C=N/c2c(C)n(C)n(c3ccccc3)c2=O)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C02	compound treatment	1.081	-0.0111	-0.15	1.25	0.0351	0.48	0.2323	0.4637	1912985	CBDivE_001002	ClCC1(OC(C(=O)c2ccccc2)C(CCl)(OC1C(=O)c3ccccc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C03	compound treatment	1.076	-0.0161	-0.22	1.206	-0.00894	-0.12	-0.2397	-0.9627	1912986	CBDivE_001003	Cc1ccc(/C=N/c2ccc(N=Nc3ccccc3)cc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C04	compound treatment	1.181	0.0889	1.2	1.255	0.0401	0.55	1.2344	0.9366	1912987	CBDivE_001004	CN(C)S(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C05	compound treatment	1.132	0.0399	0.54	1.213	-0.00194	-0.03	0.362	0.6716	1912988	CBDivE_001005	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccco2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C06	compound treatment	1.121	0.0289	0.39	1.23	0.0151	0.21	0.421	0.9551	1781649	CBDivE_001006	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C07	compound treatment	1.067	-0.0251	-0.34	1.182	-0.0329	-0.45	-0.5569	-0.9903	1912989	CBDivE_001007	Cc1c(/N=C/c2ccc(o2)[N+](=O)[O-])c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C08	compound treatment	1.1	0.00791	0.11	1.204	-0.0109	-0.15	-0.03	-0.1637	1777639	CBDivE_001008	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C09	compound treatment	1.066	-0.0261	-0.35	1.215	6.25E-5	0.0	-0.2483	-0.7054	1912990	CBDivE_001009	N/N=C/c1ccc2OCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C10	compound treatment	1.059	-0.0331	-0.45	1.182	-0.0329	-0.45	-0.6333	-1.0	1038567	CBDivE_001010	O=C(N1CCOCC1)c2ccccc2C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C11	compound treatment	1.025	-0.0671	-0.91	1.235	0.0201	0.27	-0.4465	-0.4723	1912991	CBDivE_001011	Oc1ccc(cc1/C=N/c2cccc(c2)C(F)(F)F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C12	compound treatment	1.123	0.0309	0.42	1.167	-0.0479	-0.65	-0.1674	-0.2159	1776964	CBDivE_001012	[O-][N+](=O)c1ccccc1S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C13	compound treatment	1.08	-0.0121	-0.16	1.197	-0.0179	-0.24	-0.2883	-0.9806	1912992	CBDivE_001013	CC(O)CCC(=O)N/N=C/c1ccc(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C14	compound treatment	1.067	-0.0251	-0.34	1.178	-0.0369	-0.5	-0.5955	-0.9813	1912993	CBDivE_001014	[O-][N+](=O)c1ccc(N=NN(Cc2ccccc2)Cc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C15	compound treatment	1.069	-0.0231	-0.31	1.226	0.0111	0.15	-0.1136	-0.3282	3105208	CBDivE_001015	CCCNCCC.O/C(=C\C(=O)C(F)(F)F)/C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C16	compound treatment	1.113	0.0209	0.28	1.327	0.112	1.53	1.28	0.8237	1912995	CBDivE_001016	CC(C)(CCC(=O)Nc1ccccc1)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C17	compound treatment	1.079	-0.0131	-0.18	1.191	-0.0239	-0.33	-0.3557	-0.9584	1912996	CBDivE_001017	CCOC(=O)/C(=N/c1nc2ccccc2s1)/C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C18	compound treatment	1.131	0.0389	0.52	1.191	-0.0239	-0.33	0.1404	0.2271	1912997	CBDivE_001018	OC(=O)CCCC(=O)OC/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C19	compound treatment	1.112	0.0199	0.27	1.222	0.00706	0.1	0.258	0.9043	1912998	CBDivE_001019	CC(O)CCC(=O)N/N=C/c1c2ccccc2cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	C20	compound treatment	1.141	0.0489	0.66	1.188	-0.0269	-0.37	0.2068	0.2739	1005718	CBDivE_001020	OC(=O)CCC(=O)OCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D01	compound treatment	1.102	0.00991	0.13	1.197	-0.0179	-0.24	-0.0784	-0.2814	1912999	CBDivE_001021	Oc1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D02	compound treatment	1.135	0.0429	0.58	1.233	0.0181	0.25	0.5835	0.9275	1913000	CBDivE_001022	CCOc1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D03	compound treatment	1.095	0.00291	0.04	1.224	0.00906	0.12	0.1151	0.888	1913001	CBDivE_001023	CC(C)/C(=N/NC(=O)C1CC1(c2ccccc2)c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D04	compound treatment	1.167	0.0749	1.01	1.195	-0.0199	-0.27	0.5223	0.4991	1913002	CBDivE_001024	N=c1sc2CCCCc2n1CC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D05	compound treatment	1.107	0.0149	0.2	1.251	0.0361	0.49	0.49	0.9222	1913003	CBDivE_001025	FC(F)(F)C(=O)NNC(=O)C1CC1(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D06	compound treatment	1.099	0.00691	0.09	1.214	-9.38E-4	-0.01	0.0569	0.6045	1913004	CBDivE_001026	Clc1ccc(cc1Cl)C(=O)Cn2ccsc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D07	compound treatment	1.12	0.0279	0.38	1.273	0.0581	0.79	0.8261	0.9423	1913005	CBDivE_001027	CC(=O)C/C(=N/NC(=O)C1CC1(c2ccccc2)c3ccccc3)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D08	compound treatment	1.06	-0.0321	-0.43	1.176	-0.0389	-0.53	-0.6816	-0.9949	1913006	CBDivE_001028	Cc1ccn(CC(=O)c2ccc(cc2)c3ccccc3)c(=N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D09	compound treatment	1.127	0.0349	0.47	1.17	-0.0449	-0.61	-0.1003	-0.1298	1913007	CBDivE_001029	O=C(NN1C(=O)C=CC1=O)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D10	compound treatment	1.043	-0.0491	-0.66	1.18	-0.0349	-0.48	-0.8052	-0.9869	1913008	CBDivE_001030	CCOc1ccc(cc1[N+](=O)[O-])C(=O)Cn2ccccc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D11	compound treatment	1.076	-0.0161	-0.22	1.211	-0.00394	-0.05	-0.1915	-0.8562	1913009	CBDivE_001031	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4cccc(N)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D12	compound treatment	1.115	0.0229	0.31	1.24	0.0251	0.34	0.4602	0.9987	1670326	CBDivE_001032	Ic1ccc(cc1)C(=O)CSc2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D13	compound treatment	1.117	0.0249	0.34	1.229	0.0141	0.19	0.3732	0.9646	1913010	CBDivE_001033	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D14	compound treatment	1.073	-0.0191	-0.26	1.202	-0.0129	-0.18	-0.3069	-0.983	1913011	CBDivE_001034	Cc1ccc(cc1)C(=O)Cn2cc(Cl)ccc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D15	compound treatment	1.107	0.0149	0.2	1.228	0.0131	0.18	0.2682	0.9982	1913012	CBDivE_001035	COc1ccc(cc1)/C(=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D16	compound treatment	1.09	-0.00209	-0.03	1.215	6.25E-5	0.0	-0.0193	-0.6854	1913013	CBDivE_001036	Ic1ccc(cc1)C(=O)Cn2ccc(=N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D17	compound treatment	1.046	-0.0461	-0.62	1.234	0.0191	0.26	-0.2559	-0.3797	1913014	CBDivE_001037	[O-][N+](=O)c1cccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D18	compound treatment	1.146	0.0539	0.73	1.243	0.0281	0.38	0.7848	0.955	1375279	CBDivE_001038	Cc1ccc(cc1)C(=O)Cn2ccc(=NCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D19	compound treatment	1.117	0.0249	0.34	1.215	6.25E-5	0.0	0.2382	0.7089	1913015	CBDivE_001039	COc1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	D20	compound treatment	1.073	-0.0191	-0.26	1.235	0.0201	0.27	0.0113	0.0302	1913016	CBDivE_001040	Cc1ccc(NNC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E01	compound treatment	1.066	-0.0261	-0.35	1.244	0.0291	0.4	0.0313	0.0591	1913017	CBDivE_001041	Cc1c(/N=C/c2ccc3OCOc3c2)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E02	compound treatment	1.127	0.0349	0.47	1.227	0.0121	0.16	0.4493	0.9007	1913018	CBDivE_001042	O=C(CCC(=O)OCC#C)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E03	compound treatment	1.044	-0.0481	-0.65	1.217	0.00206	0.03	-0.4389	-0.6758	1913019	CBDivE_001043	C/C(=N\NC(=O)c1ccco1)/C=N/NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E04	compound treatment	1.151	0.0589	0.79	1.233	0.0181	0.25	0.7361	0.8847	1913020	CBDivE_001044	[O-][N+](=O)c1cccc(/C=C/C(=O)NCCc2ccccn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E05	compound treatment	0.992	-0.1	-1.35	1.193	-0.0219	-0.3	-1.1663	-0.8433	1913021	CBDivE_001045	Cc1ccc(o1)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E06	compound treatment	1.138	0.0459	0.62	1.236	0.0211	0.29	0.641	0.939	1426871	CBDivE_001046	Cc1[nH]c2ccc(C)cc2c1CCC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E07	compound treatment	1.081	-0.0111	-0.15	1.217	0.00206	0.03	-0.0859	-0.5643	1913022	CBDivE_001047	CC(C)c1ccc(/C=N/c2ncn[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E08	compound treatment	1.17	0.0779	1.05	1.288	0.0731	1.0	1.4477	0.9996	1913023	CBDivE_001048	COc1ccc(NC(=O)COc2ccccc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E09	compound treatment	1.079	-0.0131	-0.18	1.231	0.0161	0.22	0.03	0.1066	1645424	CBDivE_001049	Cc1ccc(CCC(=O)Nc2c(C)n(C)n(c3ccccc3)c2=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E10	compound treatment	1.098	0.00591	0.08	1.2	-0.0149	-0.2	-0.0877	-0.4008	1913024	CBDivE_001050	COc1ccc(cc1OC)C(=O)Nc2ncn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E11	compound treatment	1.06	-0.0321	-0.43	1.185	-0.0299	-0.41	-0.5948	-0.9996	1913025	CBDivE_001051	CCOC(=O)C(O)(O/N=C(/C)\C(=N\O)\C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E12	compound treatment	1.121	0.0289	0.39	1.124	-0.0909	-1.24	-0.6011	-0.4624	1913026	CBDivE_001052	Oc1[nH]c(=S)[nH]c(=O)c1/C=C/C=C/C=C2C(=O)NC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E13	compound treatment	1.105	0.0129	0.17	1.206	-0.00894	-0.12	0.037	0.1739	1913027	CBDivE_001053	Cc1ccc(/C=N/NC(=O)CCC2(O)CCCC2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E14	compound treatment	1.038	-0.0541	-0.73	1.206	-0.00894	-0.12	-0.6022	-0.8139	1913028	CBDivE_001054	CCN(CC)C(=O)CCCC(=O)c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E15	compound treatment	1.088	-0.00409	-0.06	1.193	-0.0219	-0.3	-0.2506	-0.8237	1913029	CBDivE_001055	COc1cc2C(CC(=O)Nc3ccccc3)C(=O)N(N=C(C)c2cc1OC)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E16	compound treatment	1.111	0.0189	0.26	1.245	0.0301	0.41	0.4703	0.9739	1774317	CBDivE_001056	CC(=O)Nc1ccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E17	compound treatment	1.1	0.00791	0.11	1.23	0.0151	0.21	0.2207	0.9535	1913030	CBDivE_001057	Cc1ccc(/C=C/2\CC(NCc3ccccc3)C(=O)O2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E18	compound treatment	1.142	0.0499	0.67	1.232	0.0171	0.23	0.6406	0.8993	1738216	CBDivE_001058	Brc1ccc(cc1)C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccc(Br)cc4)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E19	compound treatment	1.012	-0.0801	-1.08	1.214	-9.38E-4	-0.01	-0.7731	-0.7154	1913031	CBDivE_001059	C/C(=N\NC(=O)c1ccco1)/CC(C)(C)c2ccc(C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	E20	compound treatment	1.121	0.0289	0.39	1.223	0.00806	0.11	0.3535	0.8724	1435541	CBDivE_001060	Cc1cc(ccc1NC(=O)c2ccc(Br)cc2)c3ccc(NC(=O)c4ccc(Br)cc4)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F01	compound treatment	1.069	-0.0231	-0.31	1.204	-0.0109	-0.15	-0.3257	-0.9431	1913032	CBDivE_001061	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F02	compound treatment	1.165	0.0729	0.98	1.226	0.0111	0.15	0.8022	0.8061	1103123	CBDivE_001062	c1cn2cc(nc2s1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F03	compound treatment	1.113	0.0209	0.28	1.194	-0.0209	-0.29	-0.0024	-0.006	1913033	CBDivE_001063	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F04	compound treatment	1.142	0.0499	0.67	1.204	-0.0109	-0.15	0.3706	0.5374	1471158	CBDivE_001064	N=c1sccn1CC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F05	compound treatment	1.102	0.00991	0.13	1.143	-0.0719	-0.98	-0.5991	-0.6052	1913034	CBDivE_001065	Oc1ccc2ccccc2c1/C=N/NC(=O)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F06	compound treatment	1.097	0.00491	0.07	1.204	-0.0109	-0.15	-0.0586	-0.3593	1913035	CBDivE_001066	Clc1ccc(cc1)C(=O)CSc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F07	compound treatment	1.048	-0.0441	-0.59	1.155	-0.0599	-0.82	-0.9985	-0.9878	1913036	CBDivE_001067	[O-][N+](=O)c1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F08	compound treatment	1.154	0.0619	0.84	1.239	0.0241	0.33	0.8226	0.9167	1913037	CBDivE_001068	Clc1ccc(cc1Cl)C(=O)Cn2ccccc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F09	compound treatment	1.103	0.0109	0.15	1.228	0.0131	0.18	0.23	0.9955	1913038	CBDivE_001069	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F10	compound treatment	1.168	0.0759	1.02	1.172	-0.0429	-0.59	0.3101	0.2629	1913039	CBDivE_001070	CCOc1ccc(cc1[N+](=O)[O-])C(=O)Cn2cccnc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F11	compound treatment	1.139	0.0469	0.63	1.226	0.0111	0.15	0.5542	0.8518	1913040	CBDivE_001071	O=C(N/N=C\1/C(=O)Nc2ccccc12)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F12	compound treatment	1.11	0.0179	0.24	1.221	0.00606	0.08	0.2293	0.8979	1697510	CBDivE_001072	Ic1ccc(cc1)C(=O)Cn2ccc(=NCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F13	compound treatment	1.129	0.0369	0.5	1.176	-0.0389	-0.53	-0.0234	-0.0321	1913041	CBDivE_001073	COc1ccc(/C(=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)/C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F14	compound treatment	1.097	0.00491	0.07	1.277	0.0621	0.85	0.6453	0.7601	1913042	CBDivE_001074	Cc1c[n+]2ccsc2n1Cc3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F15	compound treatment	1.058	-0.0341	-0.46	1.167	-0.0479	-0.65	-0.7874	-0.9852	1913043	CBDivE_001075	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccccc4O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F16	compound treatment	1.115	0.0229	0.31	1.198	-0.0169	-0.23	0.0552	0.1431	1913044	CBDivE_001076	Cc1cccn(CC(=O)c2ccc(I)c(c2)[N+](=O)[O-])c1=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F17	compound treatment	1.063	-0.0291	-0.39	1.216	0.00106	0.01	-0.2673	-0.6805	1913045	CBDivE_001077	O=C(N/N=C/c1ccco1)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F18	compound treatment	1.057	-0.0351	-0.47	1.216	0.00106	0.01	-0.3245	-0.6851	1913046	CBDivE_001078	N=c1ccccn1CC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F19	compound treatment	1.101	0.00891	0.12	1.202	-0.0129	-0.18	-0.0398	-0.1862	1913047	CBDivE_001079	CCC/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	F20	compound treatment	1.136	0.0439	0.59	1.193	-0.0219	-0.3	0.2073	0.3124	1474170	CBDivE_001080	Clc1ccc(cc1)C(=O)CSc2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G01	compound treatment	1.131	0.0389	0.52	1.195	-0.0199	-0.27	0.1789	0.3027	1913048	CBDivE_001081	Oc1ccc(cc1/C=N/NC(=O)c2ccco2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G02	compound treatment	1.125	0.0329	0.44	1.271	0.0561	0.76	0.8545	0.9666	1229631	CBDivE_001082	OC(=O)CCCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G03	compound treatment	0.99	-0.102	-1.38	1.16	-0.0549	-0.75	-1.5036	-0.959	1389169	CBDivE_001083	Cc1ccc(CCC(=O)Nc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G04	compound treatment	1.16	0.0679	0.92	1.228	0.0131	0.18	0.7738	0.8291	1913049	CBDivE_001084	Ic1ccccc1C(=O)Nc2ccc(Cc3ccc(NC(=O)c4ccccc4I)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G05	compound treatment	1.086	-0.00609	-0.08	1.2	-0.0149	-0.2	-0.2021	-0.9203	1913050	CBDivE_001085	Cc1c(/N=C/c2ccc(cc2)[N+](=O)[O-])c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G06	compound treatment	1.095	0.00291	0.04	1.23	0.0151	0.21	0.173	0.8273	1913051	CBDivE_001086	CN(C)c1ccc(/C=C/C2=[N+](C)c3ccccc3C2(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G07	compound treatment	1.075	-0.0171	-0.23	1.227	0.0121	0.16	-0.0467	-0.165	1913052	CBDivE_001087	O=C(N/N=C/C=N/NC(=O)c1ccco1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G08	compound treatment	1.146	0.0539	0.73	1.21	-0.00494	-0.07	0.4666	0.6389	1913053	CBDivE_001088	Cc1cccc(c1)C(=O)Nc2ccc(NC(=O)c3cccc(C)c3)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G09	compound treatment	1.07	-0.0221	-0.3	1.227	0.0121	0.16	-0.0944	-0.2774	1913054	CBDivE_001089	O=C(N/N=C/C=N/NC(=O)c1cccnc1)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G10	compound treatment	1.049	-0.0431	-0.58	1.229	0.0141	0.19	-0.2755	-0.45	1913055	CBDivE_001090	Cc1ccccc1C(=O)Nc2ncn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G11	compound treatment	1.075	-0.0171	-0.23	1.171	-0.0439	-0.6	-0.5867	-0.9139	1913056	CBDivE_001091	Oc1ccc(/C=N/C2CCCCC2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G12	compound treatment	1.159	0.0669	0.9	1.272	0.0571	0.78	1.1885	0.9973	1913057	CBDivE_001092	OC(=O)/C=C\C(=O)NNC(=O)C1CC21CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G13	compound treatment	1.132	0.0399	0.54	1.145	-0.0699	-0.95	-0.2937	-0.2681	1913058	CBDivE_001093	C/C(=N\NC(=O)c1cccnc1)/C(=N/NC(=O)c2cccnc2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G14	compound treatment	1.082	-0.0101	-0.14	1.221	0.00606	0.08	-0.0378	-0.2373	1913059	CBDivE_001094	O=C(NN1C(=O)C=CC1=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G15	compound treatment	1.024	-0.0681	-0.92	1.225	0.0101	0.14	-0.5525	-0.5949	1913060	CBDivE_001095	Cc1ccc(CCC(=O)NNc2ccccc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G16	compound treatment	1.152	0.0599	0.81	1.235	0.0201	0.27	0.7649	0.8965	1913061	CBDivE_001096	CC1(C)C(CCC1(C)C(=O)O)C(=O)NNC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G17	compound treatment	1.106	0.0139	0.19	1.14	-0.0749	-1.02	-0.5899	-0.5678	1913062	CBDivE_001097	Cc1ccc(/C=N/CCCCC\N=C\c2ccc(C)o2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G18	compound treatment	1.102	0.00991	0.13	1.241	0.0261	0.36	0.3458	0.9108	1913063	CBDivE_001098	OC(=O)c1ccccc1C(=O)NNC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G19	compound treatment	1.075	-0.0171	-0.23	1.199	-0.0159	-0.22	-0.3167	-0.9996	1913064	CBDivE_001099	OCCCc1ccc(o1)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	G20	compound treatment	1.141	0.0489	0.66	1.223	0.00806	0.11	0.5443	0.8137	1913065	CBDivE_001100	Oc1ccc(/C=N/NC(=O)C2CC32CCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H01	compound treatment	1.068	-0.0241	-0.32	1.209	-0.00594	-0.08	-0.2871	-0.8571	1638137	CBDivE_001101	NNC(=O)C1CC1(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H02	compound treatment	1.085	-0.00709	-0.1	1.231	0.0161	0.22	0.0872	0.365	1686179	CBDivE_001102	N=c1sccn1CC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H03	compound treatment	1.059	-0.0331	-0.45	1.151	-0.0639	-0.87	-0.9322	-0.9517	1913066	CBDivE_001103	COc1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H04	compound treatment	1.147	0.0549	0.74	1.224	0.00906	0.12	0.6112	0.8138	1913067	CBDivE_001104	O=C(CSc1nc2ccccc2s1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H05	compound treatment	1.09	-0.00209	-0.03	1.227	0.0121	0.16	0.0964	0.5774	1913068	CBDivE_001105	O=C1C(=Cc2ccnc3ccccc23)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H06	compound treatment	1.085	-0.00709	-0.1	1.162	-0.0529	-0.72	-0.5781	-0.7939	1913069	CBDivE_001106	CCOc1ccc(cc1[N+](=O)[O-])C(=O)CSc2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H07	compound treatment	1.042	-0.0501	-0.68	1.18	-0.0349	-0.48	-0.8147	-0.9854	1020326	CBDivE_001107	CCOC(=O)C1=C(O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H08	compound treatment	1.091	-0.00109	-0.01	1.223	0.00806	0.11	0.0673	0.6071	1913070	CBDivE_001108	N=c1ncccn1CC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H09	compound treatment	1.096	0.00391	0.05	1.071	-0.144	-1.96	-1.3506	-0.6879	1236876	CBDivE_001109	OCCC1(C(=O)c2ccccc2C1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H10	compound treatment	1.068	-0.0241	-0.32	1.257	0.0421	0.57	0.1758	0.2666	1385584	CBDivE_001110	Clc1ccc(cc1)C(=O)Cn2ccc(=NCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H11	compound treatment	1.056	-0.0361	-0.49	1.16	-0.0549	-0.75	-0.874	-0.9782	1065752	CBDivE_001111	O=C1C(=Cc2c[nH]c3ccccc23)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H12	compound treatment	1.091	-0.00109	-0.01	1.178	-0.0369	-0.5	-0.3666	-0.7275	1913071	CBDivE_001112	Clc1ccc(cc1)C(=O)C[n+]2ccccc2c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H13	compound treatment	1.11	0.0179	0.24	1.202	-0.0129	-0.18	0.0461	0.1541	1913072	CBDivE_001113	CCC/C(=N\O)/c1c(C)[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H14	compound treatment	1.059	-0.0331	-0.45	1.206	-0.00894	-0.12	-0.4018	-0.8684	1913073	CBDivE_001114	CCCC(=O)NNc1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H15	compound treatment	1.093	9.09E-4	0.01	1.183	-0.0319	-0.44	-0.2993	-0.6869	1913074	CBDivE_001115	CC(C)C/C(=N\O)/c1cn(C)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H16	compound treatment	1.078	-0.0141	-0.19	1.235	0.0201	0.27	0.059	0.1772	455	CBDivE_001116	Cc1ccc(cc1)C(=O)Cn2c3CCCCc3sc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H17	compound treatment	1.101	0.00891	0.12	1.224	0.00906	0.12	0.1724	0.9999	1913075	CBDivE_001117	[O-][N+](=O)c1cccc(c1)C(=O)OC2=C(C(=O)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H18	compound treatment	1.074	-0.0181	-0.24	1.205	-0.00994	-0.14	-0.2684	-0.9615	1913076	CBDivE_001118	[O-][N+](=O)c1cc(ccc1I)C(=O)CSc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H19	compound treatment	1.102	0.00991	0.13	1.217	0.00206	0.03	0.1144	0.8375	1913077	CBDivE_001119	OC(=O)[C@@H]1CC(=O)CC[C@@H]1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	H20	compound treatment	1.12	0.0279	0.38	1.222	0.00706	0.1	0.3343	0.8603	1913078	CBDivE_001120	[O-][N+](=O)c1cccc(c1)C(=O)Cn2ccccc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I01	compound treatment	1.056	-0.0361	-0.49	1.231	0.0161	0.22	-0.1894	-0.3548	1913079	CBDivE_001121	C(=N/C(\N=C\c1ccco1)c2ccco2)\c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I02	compound treatment	1.118	0.0259	0.35	1.273	0.0581	0.79	0.807	0.9324	1913080	CBDivE_001122	OC(=O)c1cc(ccc1C(=O)NNC(=O)C2CC32CCC3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I03	compound treatment	1.066	-0.0261	-0.35	1.198	-0.0169	-0.23	-0.4122	-0.9791	1913081	CBDivE_001123	OCC(CC(O)c1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I04	compound treatment	1.107	0.0149	0.2	1.188	-0.0269	-0.37	-0.1175	-0.2806	1913082	CBDivE_001124	O=C(N/N=C/c1nc2ccccc2[nH]1)C3CC43CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I05	compound treatment	1.017	-0.0751	-1.01	1.178	-0.0369	-0.5	-1.0725	-0.948	1913083	CBDivE_001125	NC(=S)N/N=C/1\C(=O)Nc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I06	compound treatment	1.128	0.0359	0.48	1.221	0.00606	0.08	0.401	0.816	1913084	CBDivE_001126	CCOC(=O)Nc1cccc(OC(=O)Nc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I07	compound treatment	1.08	-0.0121	-0.16	1.171	-0.0439	-0.6	-0.539	-0.868	1913085	CBDivE_001127	NC(=S)N/N=C/1\C(=O)Nc2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I08	compound treatment	1.08	-0.0121	-0.16	1.26	0.0451	0.61	0.3192	0.502	1913086	CBDivE_001128	Oc1ccc(cc1/C=N/Nc2ncc(Cl)cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I09	compound treatment	1.059	-0.0331	-0.45	1.169	-0.0459	-0.63	-0.7586	-0.9862	1913087	CBDivE_001129	NC(=S)N/N=C/1\C(=O)Nc2ccc(Br)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I10	compound treatment	1.107	0.0149	0.2	1.151	-0.0639	-0.87	-0.4743	-0.5301	1913088	CBDivE_001130	COc1ccc(O)c(/C=N/Nc2ncc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I11	compound treatment	1.039	-0.0531	-0.72	1.233	0.0181	0.25	-0.3323	-0.4387	1055238	CBDivE_001131	O=C1N(CN2CCOCC2)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I12	compound treatment	1.135	0.0429	0.58	1.2	-0.0149	-0.2	0.2653	0.4323	1913089	CBDivE_001132	COc1cc(/C=N/Nc2ncc(Cl)cc2Cl)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I13	compound treatment	1.066	-0.0261	-0.35	1.208	-0.00694	-0.09	-0.3158	-0.8664	1913090	CBDivE_001133	[O-][N+](=O)c1ccc(N/N=C/2\C(=O)Nc3ccc(Br)cc23)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I14	compound treatment	1.125	0.0329	0.44	1.193	-0.0219	-0.3	0.1024	0.1913	1910128	CBDivE_001134	O=C(NC(=S)Nc1ccc(N=Nc2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I15	compound treatment	1.082	-0.0101	-0.14	1.162	-0.0529	-0.72	-0.6067	-0.8259	1913091	CBDivE_001135	[O-][N+](=O)c1ccc2N(CN3CCOCC3)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I16	compound treatment	1.096	0.00391	0.05	1.236	0.0211	0.29	0.2404	0.8232	1913092	CBDivE_001136	COc1ccc(/C=N/NC(=O)Nc2ccccc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I17	compound treatment	1.102	0.00991	0.13	1.219	0.00406	0.06	0.1337	0.9239	1913093	CBDivE_001137	[O-][N+](=O)c1ccc2NC(=O)/C(=N\Nc3ccccc3)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I18	compound treatment	1.12	0.0279	0.38	1.228	0.0131	0.18	0.3922	0.9416	1913094	CBDivE_001138	NC(=S)N/N=C/c1ccc(O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I19	compound treatment	1.077	-0.0151	-0.2	1.234	0.0191	0.26	0.0399	0.1207	1913095	CBDivE_001139	Clc1ccc(NC(=O)NCc2ccco2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	I20	compound treatment	1.135	0.0429	0.58	1.208	-0.00694	-0.09	0.3424	0.5838	1913096	CBDivE_001140	NC(=S)N/N=C/c1c(O)ccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J01	compound treatment	1.093	9.09E-4	0.01	1.248	0.0331	0.45	0.3275	0.7261	1913097	CBDivE_001141	OC(=O)[C@@H]1CC=CC[C@@H]1C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J02	compound treatment	1.131	0.0389	0.52	1.217	0.00206	0.03	0.3911	0.7439	1500604	CBDivE_001142	O=C(CSc1nc2ccccc2o1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J03	compound treatment	1.069	-0.0231	-0.31	1.183	-0.0319	-0.44	-0.5282	-0.9865	1913098	CBDivE_001143	Br/C(=N\Nc1nc2ccccc2s1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J04	compound treatment	1.064	-0.0281	-0.38	1.241	0.0261	0.36	-0.0167	-0.0321	1913099	CBDivE_001144	CCOc1ccc(cc1[N+](=O)[O-])C(=O)Cn2cc(Br)ccc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J05	compound treatment	1.043	-0.0491	-0.66	1.181	-0.0339	-0.46	-0.7955	-0.9846	1913100	CBDivE_001145	NS(=O)(=O)c1ccc(N/N=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J06	compound treatment	1.129	0.0369	0.5	1.22	0.00506	0.07	0.4009	0.7975	1913101	CBDivE_001146	N=c1ccn(CC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J07	compound treatment	1.095	0.00291	0.04	1.214	-9.38E-4	-0.01	0.0187	0.4533	1913102	CBDivE_001147	[O-][N+](=O)c1ccccc1OCCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J08	compound treatment	1.074	-0.0181	-0.24	1.213	-0.00194	-0.03	-0.1913	-0.7791	1913103	CBDivE_001148	Clc1ccc(cc1Cl)C(=O)Cn2ccc(=NCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J09	compound treatment	1.077	-0.0151	-0.2	1.196	-0.0189	-0.26	-0.3266	-0.9931	1913104	CBDivE_001149	COc1ccc2nc(N/N=C/c3ccccc3)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J10	compound treatment	1.087	-0.00509	-0.07	1.192	-0.0229	-0.31	-0.2697	-0.8423	1913105	CBDivE_001150	[O-][N+](=O)c1ccc(Cc2cc[n+](CC(=O)c3ccc(cc3)c4ccccc4)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J11	compound treatment	1.064	-0.0281	-0.38	1.229	0.0141	0.19	-0.1324	-0.3117	1913106	CBDivE_001151	Cc1nn(c(O)c1N=Nc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J12	compound treatment	1.097	0.00491	0.07	1.142	-0.0729	-0.99	-0.6565	-0.6586	1913107	CBDivE_001152	Cc1cccc(Cn2c(=N)sc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J13	compound treatment	1.188	0.0959	1.29	1.267	0.0521	0.71	1.4169	0.9601	1913108	CBDivE_001153	Cc1nn(c(O)c1N=Nc2ccc(cc2)C(=O)O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J14	compound treatment	1.092	-9.06E-5	0.0	1.2	-0.0149	-0.2	-0.1449	-0.7113	1913109	CBDivE_001154	[O-][N+](=O)c1cccc(c1)c2cn3ccsc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J15	compound treatment	1.052	-0.0401	-0.54	1.223	0.00806	0.11	-0.3047	-0.5521	1913110	CBDivE_001155	OC(=O)/C(=N\Nc1ccccc1O)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J16	compound treatment	1.075	-0.0171	-0.23	1.197	-0.0179	-0.24	-0.336	-0.9996	1913111	CBDivE_001156	Cc1ccc(cc1)C(=O)Cn2ccsc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J17	compound treatment	1.125	0.0329	0.44	1.167	-0.0479	-0.65	-0.1483	-0.1877	1913112	CBDivE_001157	OC(=O)c1ccccc1N=N/C(=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J18	compound treatment	1.122	0.0299	0.4	1.232	0.0171	0.23	0.4498	0.9658	1046649	CBDivE_001158	O=C(CSc1nc2ccccc2[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J19	compound treatment	1.083	-0.00909	-0.12	1.22	0.00506	0.07	-0.0379	-0.2693	1145508	CBDivE_001159	CC(CC1OCC(CN2CCCCC2)O1)CC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	J20	compound treatment	1.079	-0.0131	-0.18	1.202	-0.0129	-0.18	-0.2496	-1.0	1913113	CBDivE_001160	[O-][N+](=O)c1cccc(c1)C(=O)Cn2cccnc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K01	compound treatment	1.043	-0.0491	-0.66	1.209	-0.00594	-0.08	-0.5255	-0.7877	1030967	CBDivE_001161	Clc1ccc(NC(=O)NCc2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K02	compound treatment	1.162	0.0699	0.94	1.229	0.0141	0.19	0.8025	0.8338	1913114	CBDivE_001162	COc1ccc(NC(=S)NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K03	compound treatment	1.033	-0.0591	-0.8	1.178	-0.0369	-0.5	-0.9199	-0.9755	1284097	CBDivE_001163	O=C(NCc1ccco1)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K04	compound treatment	1.106	0.0139	0.19	1.209	-0.00594	-0.08	0.0754	0.3691	1913115	CBDivE_001164	CC(C)(C)c1cc(Br)cc(/C=N/c2cccc3c(=O)[nH][nH]c(=O)c23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K05	compound treatment	1.029	-0.0631	-0.85	1.205	-0.00994	-0.14	-0.6977	-0.8095	1913116	CBDivE_001165	O=C(Nc1cccc2ccccc12)N3C(=O)C(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K06	compound treatment	1.109	0.0169	0.23	1.225	0.0101	0.14	0.2583	0.9704	1104687	CBDivE_001166	NC(=N)NCCCC(NC(=O)c1ccccc1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K07	compound treatment	1.057	-0.0351	-0.47	1.235	0.0201	0.27	-0.1413	-0.2584	1913117	CBDivE_001167	Brc1ccc2N(C(=O)Nc3cccc4ccccc34)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K08	compound treatment	1.063	-0.0291	-0.39	1.231	0.0161	0.22	-0.1226	-0.2728	1578704	CBDivE_001168	O=C(Nc1ccc2ccccc2c1)C(Cc3ccccc3)NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K09	compound treatment	1.049	-0.0431	-0.58	1.211	-0.00394	-0.05	-0.449	-0.7691	1913118	CBDivE_001169	Brc1ccc2N(CN3CCN(Cc4ccccc4)CC3)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K10	compound treatment	1.131	0.0389	0.52	1.18	-0.0349	-0.48	0.0343	0.0484	1913119	CBDivE_001170	CC(C)(C)c1cc(Br)cc(/C=N/c2ccccc2c3ccccc3\N=C\c4cc(Br)cc(c4O)C(C)(C)C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K11	compound treatment	1.086	-0.00609	-0.08	1.211	-0.00394	-0.05	-0.0961	-0.9787	1030966	CBDivE_001171	O=C(NCc1ccco1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K12	compound treatment	1.104	0.0119	0.16	1.178	-0.0369	-0.5	-0.2426	-0.4588	1913120	CBDivE_001172	CC(C)(C)c1cc(Br)cc(/C=N/Cc2ccccc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K13	compound treatment	1.089	-0.00309	-0.04	1.239	0.0241	0.33	0.2025	0.6123	1913121	CBDivE_001173	CCCN1C/C(=C\c2cccc(c2)[N+](=O)[O-])/C(=O)\C(=C\c3cccc(c3)[N+](=O)[O-])\C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K14	compound treatment	1.103	0.0109	0.15	1.235	0.0201	0.27	0.2975	0.9577	1740329	CBDivE_001174	CC(C)(C)c1cc(Br)cc(C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K15	compound treatment	1.106	0.0139	0.19	1.193	-0.0219	-0.3	-0.0788	-0.2233	1913122	CBDivE_001175	Cc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K16	compound treatment	1.087	-0.00509	-0.07	1.227	0.0121	0.16	0.0678	0.3801	1913123	CBDivE_001176	CC(C)(C)c1cc(Br)cc(C2N(CCN2c3ccccc3)c4ccccc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K17	compound treatment	1.041	-0.0511	-0.69	1.185	-0.0299	-0.41	-0.776	-0.9687	1913124	CBDivE_001177	COc1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K18	compound treatment	1.098	0.00591	0.08	1.246	0.0311	0.42	0.3559	0.8257	1015122	CBDivE_001178	CCOC(=O)C(N)Cc1ccc(O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K19	compound treatment	1.04	-0.0521	-0.7	1.192	-0.0229	-0.31	-0.7181	-0.9335	1913125	CBDivE_001179	Cc1cc(O)c(C(=O)/C=C/c2ccc3OCOc3c2)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	K20	compound treatment	1.06	-0.0321	-0.43	1.197	-0.0179	-0.24	-0.4791	-0.9635	1024400	CBDivE_001180	COC(=O)C(N)Cc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L01	compound treatment	1.08	-0.0121	-0.16	1.279	0.0641	0.87	0.5024	0.5653	1609168	CBDivE_001181	CC(C1OCC(CN2CCCCC2)O1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L02	compound treatment	1.14	0.0479	0.65	1.244	0.0291	0.4	0.7373	0.9724	1913126	CBDivE_001182	[O-][N+](=O)c1cc(ccc1I)C(=O)Cn2ccc(=N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L03	compound treatment	1.093	9.09E-4	0.01	1.233	0.0181	0.25	0.1828	0.7414	1256664	CBDivE_001183	C(C1COC(O1)c2cccnc2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L04	compound treatment	1.129	0.0369	0.5	1.246	0.0311	0.42	0.6516	0.9968	1913127	CBDivE_001184	O=C(Cn1ccc(=NCc2ccccc2)cc1)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L05	compound treatment	1.106	0.0139	0.19	1.185	-0.0299	-0.41	-0.156	-0.3472	1253236	CBDivE_001185	CCOC(=O)CC1(C)OCC(CN2CCCCC2)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L06	compound treatment	1.075	-0.0171	-0.23	1.155	-0.0599	-0.82	-0.741	-0.8725	1913128	CBDivE_001186	Brc1ccc(=N)n(CC(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L07	compound treatment	1.099	0.00691	0.09	1.234	0.0191	0.26	0.2497	0.9043	1248959	CBDivE_001187	CN(C)CC(C)(C)C1OCC2(CCC(=CC2)C)CO1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L08	compound treatment	1.076	-0.0161	-0.22	1.115	-0.0999	-1.36	-1.1171	-0.8095	1913129	CBDivE_001188	Cc1ccc(cc1)C(=O)Cn2cccnc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L09	compound treatment	1.032	-0.0601	-0.81	1.246	0.0311	0.42	-0.2737	-0.2992	1239854	CBDivE_001189	CC(C)C1OCCN1CC2COC3(CCCCC3)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L10	compound treatment	1.07	-0.0221	-0.3	1.206	-0.00894	-0.12	-0.2969	-0.9221	1913130	CBDivE_001190	[O-][N+](=O)c1cccc(c1)C(=O)Cn2ccc(=NCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L11	compound treatment	1.079	-0.0131	-0.18	1.245	0.0301	0.41	0.165	0.3696	1913131	CBDivE_001191	CC1OC(CC(=C1)C)c2ccccc2OCC(O)CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L12	compound treatment	1.053	-0.0391	-0.53	1.262	0.0471	0.64	0.0809	0.0974	1913132	CBDivE_001192	[O-][N+](=O)c1ccccc1CSc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L13	compound treatment	1.077	-0.0151	-0.2	1.223	0.00806	0.11	-0.0662	-0.2862	1305174	CBDivE_001193	CC1=CCC2(CO)COC(C1C2)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L14	compound treatment	1.025	-0.0671	-0.91	1.213	-0.00194	-0.03	-0.6587	-0.7274	1913133	CBDivE_001194	CCOc1ccc(cc1[N+](=O)[O-])C(=O)Cn2ccsc2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L15	compound treatment	1.092	-9.06E-5	0.0	1.177	-0.0379	-0.52	-0.3667	-0.7088	1168722	CBDivE_001195	CC1=CCC2(CO)COC(C1C2)C(C)(C)CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L16	compound treatment	1.017	-0.0751	-1.01	1.221	0.00606	0.08	-0.6579	-0.6472	1913134	CBDivE_001196	Nc1nc(cs1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L17	compound treatment	1.123	0.0309	0.42	1.224	0.00906	0.12	0.3822	0.8789	1913135	CBDivE_001197	C(C1COC2(CCCCC2)O1)N3CCOC3c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L18	compound treatment	1.117	0.0249	0.34	1.236	0.0211	0.29	0.4407	0.9969	1913136	CBDivE_001198	OC(=O)c1ccccc1N/C=C/[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L19	compound treatment	1.115	0.0229	0.31	1.169	-0.0459	-0.63	-0.2244	-0.3213	1490162	CBDivE_001199	O=C1C(CC(=NN1Cc2ccccc2)c3ccccc3)c4c[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	L20	compound treatment	1.106	0.0139	0.19	1.192	-0.0229	-0.31	-0.0885	-0.2426	1778029	CBDivE_001200	Cc1ccc2c([N+](=O)[O-])c(C)ccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M01	compound treatment	1.05	-0.0421	-0.57	1.271	0.0561	0.76	0.1391	0.146	1913137	CBDivE_001201	Cc1cc(O)c(C(=O)/C=C/c2ccc(O)c(c2)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M02	compound treatment	1.145	0.0529	0.71	1.248	0.0331	0.45	0.8235	0.9755	1913138	CBDivE_001202	CC(C)CC(N)C(=O)Nc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M03	compound treatment	1.05	-0.0421	-0.57	1.207	-0.00794	-0.11	-0.4781	-0.827	1913139	CBDivE_001203	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M04	compound treatment	1.097	0.00491	0.07	1.246	0.0311	0.42	0.3463	0.8079	1082254	CBDivE_001204	OC(=O)CCNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M05	compound treatment	1.072	-0.0201	-0.27	1.223	0.00806	0.11	-0.1139	-0.3895	1913140	CBDivE_001205	O=C/1/C(=C/c2ccc3OCOc3c2)/CC\C1=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M06	compound treatment	1.099	0.00691	0.09	1.312	0.0971	1.32	1.0018	0.755	1913141	CBDivE_001206	CC(C)(C)c1cc(Br)cc(C2N(Cc3ccccc3)CCN2Cc4ccccc4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M07	compound treatment	1.094	0.00191	0.03	1.261	0.0461	0.63	0.4624	0.7355	1913142	CBDivE_001207	COc1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M08	compound treatment	1.134	0.0419	0.57	1.241	0.0261	0.36	0.6511	0.975	1913143	CBDivE_001208	CC(C)(C)c1cc(Br)cc(/C=N/c2ccc(cc2)c3ccc(\N=C\c4cc(Br)cc(c4O)C(C)(C)C)cc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M09	compound treatment	1.023	-0.0691	-0.93	1.223	0.00806	0.11	-0.5813	-0.6194	1913144	CBDivE_001209	CCCN1C/C(=C\c2ccc3OCOc3c2)/C(=O)\C(=C\c4ccc5OCOc5c4)\C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M10	compound treatment	1.112	0.0199	0.27	1.185	-0.0299	-0.41	-0.0987	-0.2021	1913145	CBDivE_001210	Cc1cc(ccc1/N=C/c2cc(Br)cc(c2O)C(C)(C)C)c3ccc(/N=C/c4cc(Br)cc(c4O)C(C)(C)C)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M11	compound treatment	1.086	-0.00609	-0.08	1.23	0.0151	0.21	0.0871	0.3939	1913146	CBDivE_001211	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M12	compound treatment	1.154	0.0619	0.84	1.164	-0.0509	-0.69	0.0994	0.0915	1913147	CBDivE_001212	CC(C)(C)c1cc(Br)cc(/C=N/c2cccc(CO)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M13	compound treatment	1.097	0.00491	0.07	1.243	0.0281	0.38	0.3174	0.8173	1913148	CBDivE_001213	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccccc4[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M14	compound treatment	1.122	0.0299	0.4	1.212	-0.00294	-0.04	0.257	0.6338	1913149	CBDivE_001214	CC(C)(C)c1cc(Br)cc(/C=N/NC(=O)c2ccccc2O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M15	compound treatment	1.087	-0.00509	-0.07	1.247	0.0321	0.44	0.2606	0.5888	1913150	CBDivE_001215	COc1ccc(cc1)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M16	compound treatment	1.131	0.0389	0.52	1.254	0.0391	0.53	0.7478	1.0	1913151	CBDivE_001216	CC(C)(C)c1cc(Br)cc(/C=N/NC(=S)N)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M17	compound treatment	1.074	-0.0181	-0.24	1.219	0.00406	0.06	-0.1334	-0.533	1913152	CBDivE_001217	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4cccc(c4)[N+](=O)[O-])c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M18	compound treatment	1.128	0.0359	0.48	1.229	0.0141	0.19	0.4781	0.9177	1913153	CBDivE_001218	CC(C)(C)c1cc(Br)cc(/C=N/c2ccc3ccccc3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M19	compound treatment	1.099	0.00691	0.09	1.236	0.0211	0.29	0.269	0.8908	1913154	CBDivE_001219	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4cc(Br)ccc4O)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	M20	compound treatment	1.151	0.0589	0.79	1.238	0.0231	0.31	0.7843	0.9177	1913155	CBDivE_001220	CC(C)(C)c1cc(Br)cc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N01	compound treatment	1.091	-0.00109	-0.01	1.215	6.25E-5	0.0	-0.0098	-0.665	1774772	CBDivE_001221	COc1cc2CCNC(c3cc(ccc3O)[N+](=O)[O-])c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N02	compound treatment	1.12	0.0279	0.38	1.21	-0.00494	-0.07	0.2186	0.5716	1253823	CBDivE_001222	Nc1nc-2c(s1)C(=O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N03	compound treatment	1.063	-0.0291	-0.39	1.178	-0.0369	-0.5	-0.6337	-0.9924	1738864	CBDivE_001223	OC1(CCCCC1)C#CCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N04	compound treatment	1.078	-0.0141	-0.19	1.184	-0.0309	-0.42	-0.4327	-0.9352	1913156	CBDivE_001224	OC(=O)CCC(=O)C1CNc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N05	compound treatment	1.069	-0.0231	-0.31	1.221	0.00606	0.08	-0.1618	-0.5021	3105732	CBDivE_001225	CN1CCCN=C1C.Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N06	compound treatment	1.061	-0.0311	-0.42	1.227	0.0121	0.16	-0.1803	-0.4001	1913158	CBDivE_001226	Oc1ccccc1NC(=O)NNC=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N07	compound treatment	1.02	-0.0721	-0.97	1.182	-0.0329	-0.45	-1.0053	-0.9384	3105733	CBDivE_001227	CN(C)/C=N/Cc1ccccc1.Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N08	compound treatment	1.027	-0.0651	-0.88	1.165	-0.0499	-0.68	-1.1024	-0.9921	1913160	CBDivE_001228	NC(=N)Sc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N09	compound treatment	1.048	-0.0441	-0.59	1.235	0.0201	0.27	-0.2271	-0.3469	1210567	CBDivE_001229	CCCCc1c(cc(C)cc1C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N10	compound treatment	1.07	-0.0221	-0.3	1.225	0.0101	0.14	-0.1137	-0.3466	1034148	CBDivE_001230	c1ccc2c(c1)[nH]c3nc4ccccc4nc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N11	compound treatment	1.097	0.00491	0.07	1.257	0.0421	0.57	0.4524	0.7835	1431880	CBDivE_001231	CCCCc1c(cc(OC)cc1C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N12	compound treatment	1.046	-0.0461	-0.62	1.215	6.25E-5	0.0	-0.4391	-0.7061	1913161	CBDivE_001232	CC(Br)C(=O)Nc1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N13	compound treatment	1.059	-0.0331	-0.45	1.17	-0.0449	-0.61	-0.749	-0.9879	3105734	CBDivE_001233	CN(C)/C=N/c1ccc(C)cc1.Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N14	compound treatment	1.092	-9.06E-5	0.0	1.224	0.00906	0.12	0.0865	0.7001	1913163	CBDivE_001234	CN(C)c1ccc(cc1)C2NC(CCl)CO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N15	compound treatment	1.002	-0.0901	-1.22	1.225	0.0101	0.14	-0.7624	-0.6233	1497656	CBDivE_001235	CC1(C)CC(=O)C(C(O)c2ccccc2)C(C)(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N16	compound treatment	1.099	0.00691	0.09	1.2	-0.0149	-0.2	-0.0781	-0.3487	1913164	CBDivE_001236	Oc1ccc(Cc2ccccc2)cc1/C=N\Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N17	compound treatment	1.08	-0.0121	-0.16	1.204	-0.0109	-0.15	-0.2208	-0.999	1913165	CBDivE_001237	CCc1cc(Br)c(SC(CC(=O)c2ccccc2)c3cccc(c3)[N+](=O)[O-])s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N18	compound treatment	1.044	-0.0481	-0.65	1.239	0.0241	0.33	-0.2267	-0.3119	1913166	CBDivE_001238	C/C(=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c2ccc-3c(Cc4ccccc43)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N19	compound treatment	1.099	0.00691	0.09	1.209	-0.00594	-0.08	0.0087	0.0701	1913167	CBDivE_001239	CCSc1sc(CCN(CC)CC)cc1/C=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	N20	compound treatment	1.089	-0.00309	-0.04	1.188	-0.0269	-0.37	-0.2892	-0.7823	1913168	CBDivE_001240	C/C(=N/NC(=O)N)/c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O01	compound treatment	1.033	-0.0591	-0.8	1.265	0.0501	0.68	-0.081	-0.0771	1913169	CBDivE_001241	COc1cc(cc(OC)c1OC)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O02	compound treatment	1.091	-0.00109	-0.01	1.295	0.0801	1.09	0.7616	0.6975	1913170	CBDivE_001242	CC(C)(C)c1cc(Br)cc(/C=N/c2ccc(\N=C\c3cc(Br)cc(c3O)C(C)(C)C)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O03	compound treatment	1.049	-0.0431	-0.58	1.228	0.0131	0.18	-0.2851	-0.4689	1913171	CBDivE_001243	O=C(/C=C/c1ccc2OCOc2c1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O04	compound treatment	1.143	0.0509	0.69	1.225	0.0101	0.14	0.5827	0.8319	1913172	CBDivE_001244	CC(C)(C)c1cc(Br)cc(/C=N/c2cccc3c(\N=C\c4cc(Br)cc(c4O)C(C)(C)C)cccc23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O05	compound treatment	1.083	-0.00909	-0.12	1.225	0.0101	0.14	0.0103	0.056	1913173	CBDivE_001245	Oc1ccc(Br)cc1[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O06	compound treatment	1.141	0.0489	0.66	1.239	0.0241	0.33	0.6986	0.948	1520503	CBDivE_001246	S=C(NCc1ccccc1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O07	compound treatment	1.04	-0.0521	-0.7	1.246	0.0311	0.42	-0.1974	-0.2406	1913174	CBDivE_001247	CN1C/C(=C\c2ccc3OCOc3c2)/C(=O)\C(=C\c4ccc5OCOc5c4)\C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O08	compound treatment	1.143	0.0509	0.69	1.247	0.0321	0.44	0.7948	0.9762	1913175	CBDivE_001248	CC(=O)Nc1ccc(/N=C/c2cc(Br)cc(c2O)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O09	compound treatment	1.101	0.00891	0.12	1.283	0.0681	0.93	0.7413	0.7921	1913176	CBDivE_001249	O[C@@]12CCCC[C@@H]2[C@H](NCC1)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O10	compound treatment	1.124	0.0319	0.43	1.264	0.0491	0.67	0.7775	0.9773	1913177	CBDivE_001250	CC(C)(C)c1cc(Br)cc(/C=N/c2ccc(N=Nc3ccccc3)cc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O11	compound treatment	1.047	-0.0451	-0.61	1.203	-0.0119	-0.16	-0.5452	-0.8659	1913178	CBDivE_001251	O[C@@]12CCCC[C@@H]2[C@H](NCC1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O12	compound treatment	1.113	0.0209	0.28	1.26	0.0451	0.61	0.634	0.9376	1913179	CBDivE_001252	Ic1ccccc1C(=O)NNC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O13	compound treatment	1.027	-0.0651	-0.88	1.202	-0.0129	-0.18	-0.7457	-0.8325	1913180	CBDivE_001253	OC(=O)C1CC(=Nc2ccccc2S1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O14	compound treatment	1.135	0.0429	0.58	1.226	0.0111	0.15	0.516	0.8626	1913181	CBDivE_001254	OC(=O)c1ccccc1C(=O)NNC(=O)c2ccccc2I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O15	compound treatment	1.128	0.0359	0.48	1.202	-0.0129	-0.18	0.2178	0.4225	1913182	CBDivE_001255	CCOC(=O)c1c(N)scc1c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O16	compound treatment	1.102	0.00991	0.13	1.232	0.0171	0.23	0.2591	0.9654	1913183	CBDivE_001256	Oc1ccc(/C=N/NC(=O)c2ccccc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O17	compound treatment	1.075	-0.0171	-0.23	1.253	0.0381	0.52	0.204	0.3592	1913184	CBDivE_001257	COc1cc(ccc1O)C2NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O18	compound treatment	1.079	-0.0131	-0.18	1.262	0.0471	0.64	0.3289	0.4942	1913185	CBDivE_001258	Ic1ccccc1C(=O)N/N=C\2/C(=O)Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O19	compound treatment	1.077	-0.0151	-0.2	1.235	0.0201	0.27	0.0495	0.1451	1274904	CBDivE_001259	OC(=O)c1cc(nc2ccccc12)c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	O20	compound treatment	1.148	0.0559	0.75	1.233	0.0181	0.25	0.7075	0.8917	1913186	CBDivE_001260	Ic1ccccc1C(=O)N/N=C/c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P01	compound treatment	1.06	-0.0321	-0.43	1.142	-0.0729	-0.99	-1.0094	-0.9306	1913187	CBDivE_001261	CSc1sc(SC)c(C[n+]2ccccc2)c1C[n+]3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P02	compound treatment	1.124	0.0319	0.43	1.273	0.0581	0.79	0.8643	0.959	1913188	CBDivE_001262	COc1ccc(Nc2ccc(cc2[N+](=O)[O-])C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P03	compound treatment	0.968	-0.124	-1.67	1.209	-0.00594	-0.08	-1.241	-0.7404	1913189	CBDivE_001263	CCc1cc(/C=N/CC\N=C\c2cc(CC)sc2S)c(S)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P04	compound treatment	1.098	0.00591	0.08	1.14	-0.0749	-1.02	-0.6662	-0.65	1314376	CBDivE_001264	OC(=O)c1ccccc1C(=O)Nc2ccc3ncccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P05	compound treatment	1.038	-0.0541	-0.73	1.138	-0.0769	-1.05	-1.2579	-0.9843	1913190	CBDivE_001265	CSc1sc(SC)c(COC(=O)C)c1COC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P06	compound treatment	1.036	-0.0561	-0.76	1.192	-0.0229	-0.31	-0.7562	-0.9236	1913191	CBDivE_001266	COc1ccc(NC(=O)c2ccccc2C(=O)O)c3ncccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P07	compound treatment	0.997	-0.0951	-1.28	1.121	-0.0939	-1.28	-1.8129	-1.0	1171943	CBDivE_001267	CC(CSC(=O)C)C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P08	compound treatment	1.163	0.0709	0.96	1.234	0.0191	0.26	0.8602	0.8678	1913192	CBDivE_001268	Cc1ccc2c(NC(=O)c3ccccc3C(=O)O)cccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P09	compound treatment	1.071	-0.0211	-0.28	1.339	0.124	1.69	0.9951	0.58	1913193	CBDivE_001269	CC(CSC(=O)C)C(=O)NCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P10	compound treatment	1.037	-0.0551	-0.74	1.141	-0.0739	-1.01	-1.2385	-0.9887	1434158	CBDivE_001270	COC(=O)C(Cc1ccccc1)NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P11	compound treatment	1.009	-0.0831	-1.12	1.171	-0.0439	-0.6	-1.2163	-0.9569	3105776	CBDivE_001271	CC(C[S-](=O)=O)C(=O)Nc1ccccc1.Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P12	compound treatment	1.123	0.0309	0.42	1.175	-0.0399	-0.54	-0.0902	-0.1316	1555861	CBDivE_001272	OC(CNC(=O)c1ccc(Cl)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P13	compound treatment	0.999	-0.0931	-1.26	1.199	-0.0159	-0.22	-1.0417	-0.8173	3105777	CBDivE_001273	NC1CCCCC1.O=C(NC1CCCCC1)c2ccccc2[S-](=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P14	compound treatment	1.108	0.0159	0.21	1.154	-0.0609	-0.83	-0.4358	-0.5078	1913197	CBDivE_001274	CC(C)Cc1ccc(cc1)C(C)C(=O)Nc2ccc(/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P15	compound treatment	1.105	0.0129	0.17	1.215	6.25E-5	0.0	0.1237	0.7106	1913198	CBDivE_001275	CCOC(=O)/C(=N/O)/C(=O)c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P16	compound treatment	1.102	0.00991	0.13	1.181	-0.0339	-0.46	-0.2327	-0.4831	1083944	CBDivE_001276	COC(=O)c1ccccc1NC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P17	compound treatment	1.142	0.0499	0.67	1.272	0.0571	0.78	1.0263	0.9974	1913199	CBDivE_001277	COc1ccc2[nH]cc(CCNC(=O)OCCCl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P18	compound treatment	1.044	-0.0481	-0.65	1.201	-0.0139	-0.19	-0.5931	-0.8774	1163290	CBDivE_001278	COc1ccccc1NC(=O)c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P19	compound treatment	1.05	-0.0421	-0.57	1.15	-0.0649	-0.89	-1.0277	-0.9769	1913200	CBDivE_001279	C=CC1CN2CCC1CC2[C@@H](OC(=O)C3CC3)c4ccnc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.4	P20	compound treatment	1.054	-0.0381	-0.51	1.254	0.0391	0.53	0.0133	0.018	1740608	CBDivE_001280	Cc1ccc2cc(NC(=O)c3ccccc3C(=O)O)ccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A01	compound treatment	1.366	0.0471	0.64	1.479	-0.00959	-0.13	0.3567	0.5501	1920704	CBDivE_012481	CSc1ccc(OC(=O)NC(=O)COc2ccccc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A02	compound treatment	1.37	0.0511	0.69	1.456	-0.0326	-0.44	0.1731	0.2111	1920705	CBDivE_012482	CC(C)C(=O)NC(Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A03	compound treatment	1.3	-0.0189	-0.26	1.442	-0.0466	-0.64	-0.6296	-0.9197	1920706	CBDivE_012483	CCCCNC(=O)Oc1cccc(c1)N2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A04	compound treatment	1.368	0.0491	0.66	1.447	-0.0416	-0.57	0.0673	0.0772	1920707	CBDivE_012484	COc1ccccc1NC(=O)CCCC(=O)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A05	compound treatment	1.404	0.0851	1.15	1.484	-0.00459	-0.06	0.7675	0.6676	1920708	CBDivE_012485	CCOC(=O)/C=C(/C)\N1N=C(CC1c2ccccc2)\C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A06	compound treatment	1.331	0.0121	0.16	1.413	-0.0756	-1.03	-0.6135	-0.5879	1920709	CBDivE_012486	CC(OC(=O)C1CC=CCC1C(=O)Nc2cccc3ccccc23)C(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A07	compound treatment	1.44	0.121	1.63	1.509	0.0204	0.28	1.3519	0.8158	1920710	CBDivE_012487	CC/C(=N\NC(=N)N[N+](=O)[O-])/c1ccc(OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A08	compound treatment	1.383	0.0641	0.86	1.493	0.00441	0.06	0.6539	0.7545	1320015	CBDivE_012488	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CCN4CCCCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A09	compound treatment	1.42	0.101	1.36	1.435	-0.0536	-0.73	0.4476	0.2893	1642812	CBDivE_012489	Cc1cc(=O)oc2cc(OC(=O)c3ccco3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A10	compound treatment	1.343	0.0241	0.32	1.431	-0.0576	-0.79	-0.3255	-0.383	1920711	CBDivE_012490	C[SiH]1O[Si](C)(O[SiH](C)O[Si](C)(O1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A11	compound treatment	1.366	0.0471	0.64	1.478	-0.0106	-0.14	0.3471	0.5328	1421528	CBDivE_012491	Cc1nc(N2CCOCC2)c3c4CCCCc4sc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A12	compound treatment	1.346	0.0271	0.37	1.493	0.00441	0.06	0.301	0.8126	1920712	CBDivE_012492	CCOC(=O)/C=C(\C)/CCC=C(C(C)C)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A13	compound treatment	1.424	0.105	1.42	1.46	-0.0286	-0.39	0.7268	0.4943	1920713	CBDivE_012493	CCOC(=O)c1sc(NC(=O)CN2CCCCC2)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A14	compound treatment	1.336	0.0171	0.23	1.477	-0.0116	-0.16	0.0513	0.1835	1920714	CBDivE_012494	Cc1n(c(S)n[n+]1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A15	compound treatment	1.352	0.0331	0.45	1.486	-0.00259	-0.04	0.2907	0.6492	1920715	CBDivE_012495	CCCCN(CCCC)c1ncnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A16	compound treatment	1.281	-0.0379	-0.51	1.453	-0.0356	-0.49	-0.7048	-0.9997	1920716	CBDivE_012496	CC(C)COc1ccc(cc1)/C(=N\O)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A17	compound treatment	1.47	0.151	2.04	1.52	0.0314	0.43	1.7442	0.8374	1920717	CBDivE_012497	CCOC(=O)c1c(NC(=O)CNCc2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A18	compound treatment	1.346	0.0271	0.37	1.4	-0.0886	-1.21	-0.5958	-0.4721	1920718	CBDivE_012498	CC(C)COc1ccc(cc1)/C(=N\NS(=O)(=O)c2ccc(C)cc2)/c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A19	compound treatment	1.379	0.0601	0.81	1.498	0.00941	0.13	0.664	0.809	1325656	CBDivE_012499	Oc1cc(CN(CC=C)CC=C)c(O)cc1CN(CC=C)CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	A20	compound treatment	1.283	-0.0359	-0.48	1.401	-0.0876	-1.19	-1.1871	-0.921	1920719	CBDivE_012500	C/C(=N\NC(=O)COc1cc(I)c(Br)c(I)c1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B01	compound treatment	1.344	0.0251	0.34	1.422	-0.0666	-0.91	-0.4027	-0.4156	3020924	CBDivE_012501	OC(=O)CC(=O)O.C1CCC(C1)NC2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B02	compound treatment	1.414	0.0951	1.28	1.495	0.00641	0.09	0.9689	0.7536	1920720	CBDivE_012502	COc1cc(Br)cc(/C=N/c2ccc(cc2)c3cn4ccccc4n3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B03	compound treatment	1.354	0.0351	0.47	1.451	-0.0376	-0.51	-0.0277	-0.0397	1426710	CBDivE_012503	C1CCc2c(C1)sc3ncnc(N4CCCCCC4)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B04	compound treatment	1.349	0.0301	0.41	1.49	0.00141	0.02	0.3006	0.7398	1920721	CBDivE_012504	C/C(=N/OC(=O)c1ccc(cc1)c2ccccc2)/C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B05	compound treatment	1.322	0.00309	0.04	1.496	0.00741	0.1	0.1009	0.9232	1218596	CBDivE_012505	CCc1nc(NN)c2c3CCCc3sc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B06	compound treatment	1.271	-0.0479	-0.65	1.469	-0.0196	-0.27	-0.6459	-0.9236	1920722	CBDivE_012506	Brc1ccc(/C=N/NC(=O)c2ccccc2I)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B07	compound treatment	1.362	0.0431	0.58	1.504	0.0154	0.21	0.5596	0.9054	1920723	CBDivE_012507	OCC/N=C\1/CCCc2c1[nH]c3ccc(Br)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B08	compound treatment	1.414	0.0951	1.28	1.473	-0.0156	-0.21	0.7568	0.582	1920724	CBDivE_012508	Cc1ccc2nc(sc2c1)c3ccc(/N=C/c4ccc(Br)s4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B09	compound treatment	1.278	-0.0409	-0.55	1.47	-0.0186	-0.25	-0.5695	-0.9377	1316402	CBDivE_012509	Cc1nc(NN)c2c3CCCc3sc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B10	compound treatment	1.406	0.0871	1.17	1.499	0.0104	0.14	0.9312	0.7868	1920725	CBDivE_012510	CC(=O)c1ccc(cc1)n2c(=O)c3cc4c(=O)n(c5ccc(cc5)C(=O)C)c(=O)c4cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B11	compound treatment	1.315	-0.00391	-0.05	1.459	-0.0296	-0.4	-0.3226	-0.7929	1153163	CBDivE_012511	NNc1ncnc2sc3CCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B12	compound treatment	1.321	0.00209	0.03	1.454	-0.0346	-0.47	-0.3136	-0.6637	1920726	CBDivE_012512	COc1cc(O)c(/C=N/c2ccc(cc2)N3CCN(Cc4ccccc4)CC3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B13	compound treatment	1.36	0.0411	0.55	1.433	-0.0556	-0.76	-0.144	-0.1534	1363005	CBDivE_012513	Fc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B14	compound treatment	1.286	-0.0329	-0.44	1.492	0.00341	0.05	-0.281	-0.6295	1920727	CBDivE_012514	C/C(=N\OC(=O)c1cccc2ccccc12)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B15	compound treatment	1.356	0.0371	0.5	1.489	4.13E-4	0.01	0.3578	0.715	1360444	CBDivE_012515	COc1nc(nc(n1)N2CCCC2)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B16	compound treatment	1.293	-0.0259	-0.35	1.483	-0.00559	-0.08	-0.3011	-0.8415	1920728	CBDivE_012516	CN/1CCC\C1=N/c2c3CCN(C)c3nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B17	compound treatment	1.325	0.00609	0.08	1.502	0.0134	0.18	0.1874	0.9347	1920729	CBDivE_012517	Nc1ccc(cc1)C(=O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B18	compound treatment	1.303	-0.0159	-0.21	1.496	0.00741	0.1	-0.0803	-0.3385	1313009	CBDivE_012518	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccccc4I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B19	compound treatment	1.32	0.00109	0.01	1.405	-0.0836	-1.14	-0.7956	-0.6979	1920730	CBDivE_012519	CN1CCN(CC1)C2CC(=O)N(C2=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	B20	compound treatment	1.242	-0.0769	-1.04	1.445	-0.0436	-0.59	-1.154	-0.965	1920731	CBDivE_012520	Cc1ccc2nc(sc2c1)c3ccc(/N=C\4/C(=O)Nc5ccccc45)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C01	compound treatment	1.347	0.0281	0.38	1.447	-0.0416	-0.57	-0.1331	-0.1951	1475664	CBDivE_012521	NCCc1n[nH]c(Cc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C02	compound treatment	1.298	-0.0209	-0.28	1.488	-5.87E-4	-0.01	-0.2051	-0.7269	1920732	CBDivE_012522	CC(C)COC(=O)Sc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C03	compound treatment	1.413	0.0941	1.27	1.536	0.0474	0.65	1.3547	0.951	1465547	CBDivE_012523	OC(=O)CC(NC(=O)c1ccco1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C04	compound treatment	1.327	0.00809	0.11	1.449	-0.0396	-0.54	-0.3046	-0.553	1471312	CBDivE_012524	CN(C)CCCN1C(=O)CCCCc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C05	compound treatment	1.297	-0.0219	-0.3	1.6	0.111	1.52	0.8653	0.559	1320959	CBDivE_012525	Cc1ccccc1NC(=O)CN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C06	compound treatment	1.345	0.0261	0.35	1.53	0.0414	0.56	0.6482	0.9741	1920733	CBDivE_012526	Fc1ccc(Br)c(SCCc2ccccn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C07	compound treatment	1.362	0.0431	0.58	1.522	0.0334	0.46	0.7332	0.9927	1203298	CBDivE_012527	Cc1cc(C)n(c(=O)n1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C08	compound treatment	1.325	0.00609	0.08	1.524	0.0354	0.48	0.3995	0.8157	1920734	CBDivE_012528	CC(=O)c1cccc(NCn2cnc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C09	compound treatment	1.273	-0.0459	-0.62	1.492	0.00341	0.05	-0.4051	-0.6521	1920735	CBDivE_012529	O=C(NC(=S)N1CCCCCC1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C10	compound treatment	1.356	0.0371	0.5	1.535	0.0464	0.63	0.8013	0.9932	1920736	CBDivE_012530	CC(C)COP(=O)(OCC(C)C)SSP(=O)(OCC(C)C)OCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C11	compound treatment	1.35	0.0311	0.42	1.52	0.0314	0.43	0.5995	0.9999	1920737	CBDivE_012531	Cc1cc(C)n(c2ccccc2)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C12	compound treatment	1.342	0.0231	0.31	1.474	-0.0146	-0.2	0.0796	0.2154	1920738	CBDivE_012532	COc1ccc(/C=C/C(=O)N2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C13	compound treatment	1.314	-0.00491	-0.07	1.494	0.00541	0.07	0.0053	0.0538	1658214	CBDivE_012533	O=C(NC(=S)N1CCCCCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C14	compound treatment	1.403	0.0841	1.13	1.545	0.0564	0.77	1.3461	0.9821	1210923	CBDivE_012534	OC(=O)C(Cc1ccccc1)NC(=O)COc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C15	compound treatment	1.379	0.0601	0.81	1.565	0.0764	1.04	1.31	0.9923	1920739	CBDivE_012535	O=C(CCS(=O)CCC(=O)NCCc1ccccc1)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C16	compound treatment	1.318	-9.12E-4	-0.01	1.533	0.0444	0.61	0.4195	0.6926	1920740	CBDivE_012536	CN1/C(=C\C(=O)c2cccc(c2)[N+](=O)[O-])/Sc3cc4OCOc4cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C17	compound treatment	1.411	0.0921	1.24	1.59	0.101	1.38	1.8563	0.9986	1920741	CBDivE_012537	CCOC(=O)c1cnn(c1N)c2nc(CC)nc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C18	compound treatment	1.343	0.0241	0.32	1.507	0.0184	0.25	0.4073	0.9919	1920742	CBDivE_012538	O=C(N(c1ccccc1)c2ccccc2)C3=COCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C19	compound treatment	1.248	-0.0709	-0.96	1.48	-0.00859	-0.12	-0.7593	-0.7878	1920743	CBDivE_012539	CCN(CC)CC(=O)Nc1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	C20	compound treatment	1.303	-0.0159	-0.21	1.465	-0.0236	-0.32	-0.3792	-0.9807	1725211	CBDivE_012540	COc1cc(cc(OC)c1OC)C(=O)Nc2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D01	compound treatment	1.293	-0.0259	-0.35	1.407	-0.0816	-1.11	-1.0339	-0.8866	1920744	CBDivE_012541	[O-][N+](=O)c1ccccc1/C=N/NC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D02	compound treatment	1.331	0.0121	0.16	1.43	-0.0586	-0.8	-0.4496	-0.5514	1920745	CBDivE_012542	C(=N/N=C/c1cccc2ccccc12)\c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D03	compound treatment	1.186	-0.133	-1.79	1.501	0.0124	0.17	-1.1482	-0.6375	1223306	CBDivE_012543	OC(=O)c1ccc(cc1)S(=O)(=O)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D04	compound treatment	1.325	0.00609	0.08	1.417	-0.0716	-0.98	-0.6322	-0.6453	1920746	CBDivE_012544	COc1cc(OC)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D05	compound treatment	1.287	-0.0319	-0.43	1.487	-0.00159	-0.02	-0.3197	-0.7417	1278436	CBDivE_012545	O=C1OC(=NC1C2(CC3CC4CC(C3)C2)C4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D06	compound treatment	1.404	0.0851	1.15	1.556	0.0674	0.92	1.4617	0.9939	1920747	CBDivE_012546	Clc1ccccc1NS(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D07	compound treatment	1.338	0.0191	0.26	1.52	0.0314	0.43	0.485	0.9703	1728007	CBDivE_012547	Fc1ccc(CC2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D08	compound treatment	1.316	-0.00291	-0.04	1.484	-0.00459	-0.06	-0.072	-0.9749	1703279	CBDivE_012548	Clc1ccc(cc1)N2CCN(Cc3cccc(Cl)c3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D09	compound treatment	1.305	-0.0139	-0.19	1.477	-0.0116	-0.16	-0.2444	-0.9963	1427992	CBDivE_012549	CCN(CC)CCc1c(O)n(C)c(=O)n(C)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D10	compound treatment	1.31	-0.00891	-0.12	1.5	0.0114	0.16	0.025	0.1273	1367053	CBDivE_012550	CC(C)(C)c1nc(CN2CCOCC2)cc(CN3CCOCC3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D11	compound treatment	1.303	-0.0159	-0.21	1.544	0.0554	0.76	0.3825	0.487	1678143	CBDivE_012551	Nc1ccc2nc3c(=O)[nH]c(=O)nc3[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D12	compound treatment	1.372	0.0531	0.72	1.532	0.0434	0.59	0.925	0.9955	1920748	CBDivE_012552	CC(C)(C)c1cc(nc(N)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D13	compound treatment	1.395	0.0761	1.03	1.484	-0.00459	-0.06	0.6816	0.6628	1920749	CBDivE_012553	O=C1NC(=O)C(=NNc2cccc3ccccc23)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D14	compound treatment	1.328	0.00909	0.12	1.465	-0.0236	-0.32	-0.1407	-0.4089	1920750	CBDivE_012554	CC(C)(C)c1ccc(cc1)c2nc(I)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D15	compound treatment	1.314	-0.00491	-0.07	1.53	0.0414	0.56	0.3525	0.6199	1920751	CBDivE_012555	O=C1NC(=S)NC(=O)C1C/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D16	compound treatment	1.307	-0.0119	-0.16	1.415	-0.0736	-1.0	-0.8232	-0.81	1455185	CBDivE_012556	CC(C)(C)c1nc(CN2CCCCC2)cc(CN3CCCCC3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D17	compound treatment	1.298	-0.0209	-0.28	1.47	-0.0186	-0.25	-0.3787	-0.9986	1920752	CBDivE_012557	O=C(/C=C/N1CCOCC1)c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D18	compound treatment	1.284	-0.0349	-0.47	1.437	-0.0516	-0.7	-0.8305	-0.981	1920753	CBDivE_012558	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D19	compound treatment	1.393	0.0741	1.0	1.52	0.0314	0.43	1.0096	0.9285	1162782	CBDivE_012559	Clc1ccc(Cn2ncc3c(ncnc23)N4CCCCC4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	D20	compound treatment	1.323	0.00409	0.06	1.541	0.0524	0.71	0.5444	0.7594	1920754	CBDivE_012560	FC(c1nc2ccccc2[nH]1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E01	compound treatment	1.274	-0.0449	-0.61	1.469	-0.0196	-0.27	-0.6173	-0.9323	1920755	CBDivE_012561	O/N=C/1\CCc2nonc2\C1=N/Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E02	compound treatment	1.329	0.0101	0.14	1.496	0.00741	0.1	0.1677	0.9893	1920756	CBDivE_012562	CCOC(=O)C1=C(C)NC(=O)NC1c2ccc(o2)c3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E03	compound treatment	1.272	-0.0469	-0.63	1.491	0.00241	0.03	-0.4242	-0.6694	1920757	CBDivE_012563	O=C(NC(=S)N1CCCCCC1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E04	compound treatment	1.316	-0.00291	-0.04	1.509	0.0204	0.28	0.1691	0.6013	1920758	CBDivE_012564	COc1ccc(OC)c(CNNC(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E05	compound treatment	1.281	-0.0379	-0.51	1.531	0.0424	0.58	0.0473	0.0613	1920759	CBDivE_012565	CC(=O)O/N=C/1\CCc2nonc2\C1=N/Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E06	compound treatment	1.242	-0.0769	-1.04	1.484	-0.00459	-0.06	-0.7779	-0.7484	1920760	CBDivE_012566	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccc-4c(Cc5cc(ccc54)N6C(=O)c7ccc(cc7C6=O)C(=O)O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E07	compound treatment	1.285	-0.0339	-0.46	1.599	0.11	1.51	0.7412	0.471	1920761	CBDivE_012567	O=C(NC(=S)NCc1ccccc1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E08	compound treatment	1.342	0.0231	0.31	1.576	0.0874	1.19	1.0631	0.8629	1920762	CBDivE_012568	CCCCOP(=S)(OCCCC)SCSP(=S)(OCCCC)OCCCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E09	compound treatment	1.375	0.0561	0.76	1.555	0.0664	0.91	1.1754	0.996	1920763	CBDivE_012569	Brc1ccc(cc1)S(=O)(=O)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E10	compound treatment	1.353	0.0341	0.46	1.534	0.0454	0.62	0.7631	0.9893	1711890	CBDivE_012570	O=c1[nH]n(c2ncnc3sc4CCCCc4c23)c(=O)c5cccc6cccc1c65
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E11	compound treatment	1.423	0.104	1.4	1.596	0.107	1.46	2.0286	0.9998	1920764	CBDivE_012571	O=S(=O)(c1ccccc1)c2cccc3N=S=Nc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E12	compound treatment	1.314	-0.00491	-0.07	1.513	0.0244	0.33	0.1885	0.5555	1336875	CBDivE_012572	CC(C)C1CCC(C)CC1OCC(O)CN2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E13	compound treatment	1.268	-0.0509	-0.69	1.524	0.0354	0.48	-0.1442	-0.1717	1441725	CBDivE_012573	COc1ccc2CCCN3CCCc1c32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E14	compound treatment	1.305	-0.0139	-0.19	1.476	-0.0126	-0.17	-0.2541	-0.999	1920765	CBDivE_012574	CCN(CC(O)CNS(=O)(=O)O)CC(O)COc1ccc(cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E15	compound treatment	1.308	-0.0109	-0.15	1.513	0.0244	0.33	0.1313	0.3607	1920766	CBDivE_012575	CC(C)(C)NC(NC(=O)c1ccc(cc1)[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E16	compound treatment	1.326	0.00709	0.1	1.477	-0.0116	-0.16	-0.0441	-0.2389	1920767	CBDivE_012576	Cc1cc(c2ccco2)n(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E17	compound treatment	1.448	0.129	1.74	1.548	0.0594	0.81	1.8043	0.9394	1568233	CBDivE_012577	CCOC(=O)c1ccccc1NC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E18	compound treatment	1.337	0.0181	0.24	1.502	0.0134	0.18	0.3019	0.9899	1920768	CBDivE_012578	CCN(CC)c1nc(Cl)nc(n1)N(CC)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E19	compound treatment	1.316	-0.00291	-0.04	1.617	0.128	1.75	1.2104	0.6911	1228558	CBDivE_012579	Cc1cc(=O)oc2cc(OC(=O)C(C)(C)C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	E20	compound treatment	1.375	0.0561	0.76	1.465	-0.0236	-0.32	0.3076	0.3741	1920769	CBDivE_012580	COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F01	compound treatment	1.272	-0.0469	-0.63	1.364	-0.125	-1.7	-1.6488	-0.9095	1920770	CBDivE_012581	N/N=C(\Cc1nc2ccccc2[nH]1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F02	compound treatment	1.276	-0.0429	-0.58	1.398	-0.0906	-1.24	-1.2828	-0.9403	1920771	CBDivE_012582	FC(OC(F)(F)F)c1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F03	compound treatment	1.268	-0.0509	-0.69	1.465	-0.0236	-0.32	-0.7131	-0.9402	1920772	CBDivE_012583	CC(=O)C(=C1Nc2ccccc2N1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F04	compound treatment	1.315	-0.00391	-0.05	1.476	-0.0126	-0.17	-0.1587	-0.8837	1479264	CBDivE_012584	CCOC(=O)C1=C(C)NC2=C(C1c3c[nH]c4ccccc34)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F05	compound treatment	1.371	0.0521	0.7	1.509	0.0204	0.28	0.6937	0.9178	1920773	CBDivE_012585	Cc1ccc(cc1)N2Cc3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F06	compound treatment	1.31	-0.00891	-0.12	1.489	4.13E-4	0.01	-0.081	-0.6732	1920774	CBDivE_012586	CC(C)(C)NS(=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F07	compound treatment	1.351	0.0321	0.43	1.427	-0.0616	-0.84	-0.2877	-0.3046	1920775	CBDivE_012587	O=C(CCCN1C(=O)c2cccc3cccc(C1=O)c23)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F08	compound treatment	1.353	0.0341	0.46	1.507	0.0184	0.25	0.5027	0.9595	1920776	CBDivE_012588	C1Cc2c3cc(ccc3n4ccnc(C1)c24)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F09	compound treatment	1.258	-0.0609	-0.82	1.533	0.0444	0.61	-0.1528	-0.1497	1920777	CBDivE_012589	CC(N)C(=O)Oc1ccc2c(=O)c(coc2c1)c3ccon3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F10	compound treatment	1.319	8.78E-5	0.0	1.47	-0.0186	-0.25	-0.1784	-0.7038	1920778	CBDivE_012590	S=c1nc(c2ccccc2)c(n[nH]1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F11	compound treatment	1.334	0.0151	0.2	1.54	0.0514	0.7	0.6397	0.8762	1216437	CBDivE_012591	O=C(NC1CCCCC1NC(=O)C2CC2c3ccccc3)C4CC4c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F12	compound treatment	1.2	-0.119	-1.6	1.46	-0.0286	-0.39	-1.41	-0.8541	1920779	CBDivE_012592	FC(F)(F)C(=O)O/N=C\1/CCCc2nonc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F13	compound treatment	1.296	-0.0229	-0.31	1.51	0.0214	0.29	-0.0121	-0.0284	1695409	CBDivE_012593	CCc1nnc(s1)N2CCN(CC2)c3ncnc4n(ncc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F14	compound treatment	1.295	-0.0239	-0.32	1.507	0.0184	0.25	-0.0506	-0.1237	1920780	CBDivE_012594	Cc1cc(C)n(CCC(=O)O)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F15	compound treatment	1.336	0.0171	0.23	1.531	0.0424	0.58	0.572	0.9187	1501451	CBDivE_012595	OC(CNc1ccccc1)Cn2c3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F16	compound treatment	1.283	-0.0359	-0.48	1.456	-0.0326	-0.44	-0.6568	-0.9991	1920781	CBDivE_012596	N(/N=C/c1c[nH]c2ccccc12)c3ccc4nn(nc4c3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F17	compound treatment	1.26	-0.0589	-0.79	1.493	0.00441	0.06	-0.5194	-0.6517	1373713	CBDivE_012597	Cc1ccc(cc1)C2(CC3CC4CC(C3)(C2)C(=O)NO)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F18	compound treatment	1.326	0.00709	0.1	1.522	0.0334	0.46	0.3898	0.8373	3020331	CBDivE_012598	CC(N)C1CC2CCC1C2.OC(=O)c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F19	compound treatment	1.271	-0.0479	-0.65	1.551	0.0624	0.85	0.1448	0.1355	1172479	CBDivE_012599	Oc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	F20	compound treatment	1.265	-0.0539	-0.73	1.425	-0.0636	-0.87	-1.1274	-0.9962	1498970	CBDivE_012600	COc1ccc(cc1)c2cc(c3ccc(OC)cc3)c4c(N)c(sc4n2)C(=O)Nc5ccc(Br)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G01	compound treatment	1.195	-0.124	-1.67	1.488	-5.87E-4	-0.01	-1.1877	-0.7105	1779172	CBDivE_012601	Oc1cc(O)c2c(cc(=O)oc2c1)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G02	compound treatment	1.267	-0.0519	-0.7	1.435	-0.0536	-0.73	-1.0119	-0.9998	1704486	CBDivE_012602	C(N1CCN(CC1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G03	compound treatment	1.376	0.0571	0.77	1.484	-0.00459	-0.06	0.5004	0.6475	1920782	CBDivE_012603	OC1(CCCCC1)C(=O)CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G04	compound treatment	1.334	0.0151	0.2	1.518	0.0294	0.4	0.4275	0.9506	1019425	CBDivE_012604	[O-][N+](=O)c1ccc(cc1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G05	compound treatment	1.346	0.0271	0.37	1.447	-0.0416	-0.57	-0.1426	-0.2114	1920783	CBDivE_012605	C/C(=N/OC(=O)C1CC21CCC2)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G06	compound treatment	1.35	0.0311	0.42	1.479	-0.00959	-0.13	0.2041	0.4646	1376623	CBDivE_012606	C(Nc1nccs1)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G07	compound treatment	1.285	-0.0339	-0.46	1.571	0.0824	1.12	0.4712	0.3883	1920784	CBDivE_012607	CC1(CCCCC1)/C(=N/O)/CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G08	compound treatment	1.341	0.0221	0.3	1.532	0.0434	0.59	0.6293	0.9495	1920785	CBDivE_012608	Brc1ccc(/C=N\OC(=O)C2CC2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G09	compound treatment	1.248	-0.0709	-0.96	1.569	0.0804	1.1	0.0989	0.068	1401059	CBDivE_012609	O=C(NCCc1ccccc1)C2CC=CCC2C(=O)OCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G10	compound treatment	1.316	-0.00291	-0.04	1.537	0.0484	0.66	0.439	0.6639	1732025	CBDivE_012610	CC(C)CC1CC2C(O1)c3ccccc3OC2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G11	compound treatment	1.401	0.0821	1.11	1.624	0.135	1.85	2.0888	0.9701	1920786	CBDivE_012611	O=C(Nc1cccc2ccccc12)C3CC=CCC3C(=O)OCC4CCCO4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G12	compound treatment	1.259	-0.0599	-0.81	1.51	0.0214	0.29	-0.365	-0.4248	1253771	CBDivE_012612	O=C(Nc1nc2ccccc2s1)C3CC=CCC3C(=O)OCC4CCCO4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G13	compound treatment	1.321	0.00209	0.03	1.476	-0.0126	-0.17	-0.1015	-0.5833	1668288	CBDivE_012613	CCOC(=O)C(C1CCCCC1)C(=O)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G14	compound treatment	1.323	0.00409	0.06	1.48	-0.00859	-0.12	-0.0438	-0.3384	1920787	CBDivE_012614	COc1ccc(NC(NC(=O)Nc2ccccc2)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G15	compound treatment	1.441	0.122	1.65	1.562	0.0734	1.0	1.8725	0.9715	1226727	CBDivE_012615	CC1CCC(C(O1)c2ccc3OCOc3c2)C(=C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G16	compound treatment	1.318	-9.12E-4	-0.01	1.506	0.0174	0.24	0.1592	0.6696	1920788	CBDivE_012616	[O-][n+]1c(CSc2nc3ccccc3[nH]2)c(CSc4nc5ccccc5[nH]4)[n+]([O-])c6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G17	compound treatment	1.334	0.0151	0.2	1.509	0.0204	0.28	0.3408	0.9882	1920789	CBDivE_012617	CC(Cc1cccn1C)SCCSC(C)Cc2cccn2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G18	compound treatment	1.319	8.78E-5	0.0	1.493	0.00441	0.06	0.0434	0.7209	1920790	CBDivE_012618	OC(c1ccccc1)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G19	compound treatment	1.314	-0.00491	-0.07	1.496	0.00741	0.1	0.0246	0.2037	1422258	CBDivE_012619	CCOC(=O)c1ccc(CN(CC)CC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	G20	compound treatment	1.336	0.0171	0.23	1.49	0.00141	0.02	0.1766	0.7636	1920791	CBDivE_012620	OC(=O)CCCNC(=O)c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H01	compound treatment	1.265	-0.0539	-0.73	1.313	-0.176	-2.39	-2.2074	-0.8821	1603086	CBDivE_012621	OC(=O)C(NC(=O)c1ccccc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H02	compound treatment	1.302	-0.0169	-0.23	1.427	-0.0616	-0.84	-0.7552	-0.8678	1920792	CBDivE_012622	CC(C)(C)N/C(=N/C(=N/S(=O)(=O)c1ccccc1)/c2ccccc2)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H03	compound treatment	1.343	0.0241	0.32	1.387	-0.102	-1.39	-0.7498	-0.5269	1422907	CBDivE_012623	CCOC(=O)c1c(C)nc2CC(C)(C)CC(=O)c2c1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H04	compound treatment	1.33	0.0111	0.15	1.471	-0.0176	-0.24	-0.0638	-0.2258	1920793	CBDivE_012624	N(/N=C/c1ccccc1)c2ccc3nn(nc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H05	compound treatment	1.253	-0.0659	-0.89	1.458	-0.0306	-0.42	-0.9237	-0.9405	1920794	CBDivE_012625	OC1(CCCCC1)/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H06	compound treatment	1.334	0.0151	0.2	1.454	-0.0346	-0.47	-0.1896	-0.369	1920795	CBDivE_012626	CC(=O)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H07	compound treatment	1.29	-0.0289	-0.39	1.459	-0.0296	-0.4	-0.5611	-0.9999	1920796	CBDivE_012627	C/C(=C(/C)\C#CC#C/C(=C(\C)/C=C/C(=O)O)/C)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H08	compound treatment	1.324	0.00509	0.07	1.449	-0.0396	-0.54	-0.3332	-0.6123	1920797	CBDivE_012628	CC(C(O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H09	compound treatment	1.249	-0.0699	-0.94	1.421	-0.0676	-0.92	-1.3186	-0.9999	1920798	CBDivE_012629	OC(=O)C1CC=CCC1C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H10	compound treatment	1.346	0.0271	0.37	1.519	0.0304	0.41	0.5517	0.998	1179779	CBDivE_012630	COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H11	compound treatment	1.446	0.127	1.71	1.426	-0.0626	-0.85	0.6088	0.3179	1920799	CBDivE_012631	O/N=C(\NCc1ccccc1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H12	compound treatment	1.339	0.0201	0.27	1.491	0.00241	0.03	0.2149	0.7872	1003070	CBDivE_012632	Cc1ccc(cc1)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H13	compound treatment	1.365	0.0461	0.62	1.563	0.0744	1.01	1.1572	0.9724	1920800	CBDivE_012633	CN(C)c1ccc(/C=N/OC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H14	compound treatment	1.299	-0.0199	-0.27	1.479	-0.00959	-0.13	-0.2824	-0.9452	1344479	CBDivE_012634	COc1ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H15	compound treatment	1.305	-0.0139	-0.19	1.475	-0.0136	-0.19	-0.2637	-1.0	1477138	CBDivE_012635	CN(C)CCNc1c(N)c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H16	compound treatment	1.259	-0.0599	-0.81	1.504	0.0154	0.21	-0.4229	-0.5064	1920801	CBDivE_012636	CC(CC(C)(C)N1CCOCC1)OC(=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H17	compound treatment	1.29	-0.0289	-0.39	1.495	0.00641	0.09	-0.214	-0.5353	1920802	CBDivE_012637	NC(=N/N=C/c1ccc(cc1)[N+](=O)[O-])N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H18	compound treatment	1.354	0.0351	0.47	1.445	-0.0436	-0.59	-0.0856	-0.1126	1779987	CBDivE_012638	COc1ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])cc2)nn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H19	compound treatment	1.345	0.0261	0.35	1.52	0.0314	0.43	0.5518	0.9952	1920803	CBDivE_012639	Clc1ccc(NC(=O)CCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	H20	compound treatment	1.288	-0.0309	-0.42	1.454	-0.0346	-0.47	-0.6284	-0.9981	1920804	CBDivE_012640	CC1(C)CC(CC(C)(C)N1)/N=C/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I01	compound treatment	1.265	-0.0539	-0.73	1.505	0.0164	0.22	-0.356	-0.4679	1920805	CBDivE_012641	CCOC(=O)CSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I02	compound treatment	1.269	-0.0499	-0.67	1.509	0.0204	0.28	-0.2793	-0.3833	1920806	CBDivE_012642	COc1ccc(NCCNc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I03	compound treatment	1.301	-0.0179	-0.24	1.544	0.0554	0.76	0.3634	0.4581	1209645	CBDivE_012643	Fc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I04	compound treatment	1.331	0.0121	0.16	1.461	-0.0276	-0.38	-0.1507	-0.3675	1920807	CBDivE_012644	CC1(C)C2CCC1(C)C(C2)OC(=O)CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I05	compound treatment	1.28	-0.0389	-0.52	1.509	0.0204	0.28	-0.1744	-0.2934	1360052	CBDivE_012645	COc1ccc(cc1)c2csc(=Nc3ccccc3)n2CCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I06	compound treatment	1.306	-0.0129	-0.17	1.521	0.0324	0.44	0.1894	0.3986	1920808	CBDivE_012646	COC(C)(C)CCC[C@@H](C)C(COC(=O)C)OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I07	compound treatment	1.401	0.0821	1.11	1.568	0.0794	1.08	1.5488	0.9999	1545745	CBDivE_012647	CC(C)C(N1C(=O)c2ccccc2C1=O)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I08	compound treatment	1.354	0.0351	0.47	1.556	0.0674	0.92	0.9847	0.9524	1659775	CBDivE_012648	CC(C)(C)c1ccc(SCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I09	compound treatment	1.333	0.0141	0.19	1.535	0.0464	0.63	0.5819	0.8806	41	CBDivE_012649	OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I10	compound treatment	1.336	0.0171	0.23	1.487	-0.00159	-0.02	0.1477	0.6379	1551761	CBDivE_012650	CC(=CCCC1(C)Oc2ccccc2C3OC(C)(CCC31)C=C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I11	compound treatment	1.402	0.0831	1.12	1.557	0.0684	0.93	1.4523	0.9958	1215223	CBDivE_012651	CC(=O)Oc1ccccc1OCc2nc3ccccc3n2C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I12	compound treatment	1.289	-0.0299	-0.4	1.549	0.0604	0.82	0.2972	0.324	1920809	CBDivE_012652	ClC(Cl)(Cl)C(NC(=O)Nc1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I13	compound treatment	1.353	0.0341	0.46	1.549	0.0604	0.82	0.9077	0.9621	1920810	CBDivE_012653	COc1ccc(cc1)C(=O)OCCNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I14	compound treatment	1.347	0.0281	0.38	1.542	0.0534	0.73	0.783	0.9536	1920811	CBDivE_012654	COc1ccc(NC(=O)CN2C(=O)c3cccc4cccc(C2=O)c34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I15	compound treatment	1.42	0.101	1.36	1.599	0.11	1.51	2.029	0.9988	1307673	CBDivE_012655	C(CN1CCOCC1)Oc2ccc(cc2)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I16	compound treatment	1.368	0.0491	0.66	1.502	0.0134	0.18	0.5976	0.8698	1920812	CBDivE_012656	COc1ccc(NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I17	compound treatment	1.363	0.0441	0.59	1.581	0.0924	1.26	1.3117	0.9413	1920813	CBDivE_012657	O=C(NNC(=O)c1cccnc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I18	compound treatment	1.312	-0.00691	-0.09	1.49	0.00141	0.02	-0.0523	-0.5494	1920814	CBDivE_012658	[O-][N+](=O)c1ccc(NC(NC(=O)c2ccccc2Cl)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I19	compound treatment	1.402	0.0831	1.12	1.495	0.00641	0.09	0.8544	0.76	1920815	CBDivE_012659	O=C(COc1ccccc1)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	I20	compound treatment	1.351	0.0321	0.43	1.508	0.0194	0.26	0.4933	0.9722	1920816	CBDivE_012660	OC(=O)CCCNC(=O)c1ccccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J01	compound treatment	1.272	-0.0469	-0.63	1.392	-0.0966	-1.32	-1.3788	-0.9436	1305113	CBDivE_012661	CCN(CC)c1ccc2c(C)c(CO)c(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J02	compound treatment	1.291	-0.0279	-0.38	1.464	-0.0246	-0.34	-0.5033	-0.9983	1468984	CBDivE_012662	COc1ccc(cc1)C2C3N4CCC(CC4)C3=NN2C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J03	compound treatment	1.248	-0.0709	-0.96	1.404	-0.0846	-1.15	-1.4921	-0.9957	1920817	CBDivE_012663	Cc1ccc(cc1)c2nc3cc(/N=C/c4ccc(o4)c5cccc(Cl)c5)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J04	compound treatment	1.306	-0.0129	-0.17	1.433	-0.0556	-0.76	-0.6592	-0.8475	1920818	CBDivE_012664	CCCC(=O)N(c1ccc(cc1)N(C(=O)CCC)S(=O)(=O)c2cccc(c2)[N+](=O)[O-])S(=O)(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J05	compound treatment	1.286	-0.0329	-0.44	1.467	-0.0216	-0.29	-0.5221	-0.9801	1920819	CBDivE_012665	C(N1CCN(Cn2nnc3ccccc23)C1)n4nnc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J06	compound treatment	1.325	0.00609	0.08	1.44	-0.0486	-0.66	-0.4104	-0.6148	1920820	CBDivE_012666	Oc1c(Br)cc(NS(=O)(=O)c2ccccc2)c(Br)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J07	compound treatment	1.346	0.0271	0.37	1.479	-0.00959	-0.13	0.166	0.4276	1920821	CBDivE_012667	C/C(=N\NC(=O)c1cccc2ccccc12)/c3ccc(Cl)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J08	compound treatment	1.351	0.0321	0.43	1.458	-0.0306	-0.42	0.0112	0.0186	1920822	CBDivE_012668	OC(=O)c1ccc(Cl)c2c(Cl)ccc(C(=O)O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J09	compound treatment	1.266	-0.0529	-0.71	1.465	-0.0236	-0.32	-0.7322	-0.9352	1920823	CBDivE_012669	CN1CCN(CCCNc2c([N+](=O)[O-])c(=O)oc3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J10	compound treatment	1.29	-0.0289	-0.39	1.523	0.0344	0.47	0.056	0.0918	1920824	CBDivE_012670	Cc1ccc(cc1)S(=O)(=O)Nc2cc(Br)c(NS(=O)(=O)c3ccc(C)cc3)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J11	compound treatment	1.336	0.0171	0.23	1.534	0.0454	0.62	0.6009	0.9094	1920825	CBDivE_012671	COc1ccc(/C=N/Nc2ncnc3sc4CCCCc4c23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J12	compound treatment	1.317	-0.00191	-0.03	1.532	0.0434	0.59	0.4004	0.6757	1920826	CBDivE_012672	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J13	compound treatment	1.343	0.0241	0.32	1.52	0.0314	0.43	0.5327	0.9907	1137572	CBDivE_012673	Nc1nc(cs1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J14	compound treatment	1.301	-0.0179	-0.24	1.424	-0.0646	-0.88	-0.7936	-0.869	1920827	CBDivE_012674	CCOC(=O)/C=C(\C)/N1N=C(CC1c2ccc(F)cc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J15	compound treatment	1.307	-0.0119	-0.16	1.511	0.0224	0.31	0.1025	0.2968	1636442	CBDivE_012675	COc1ccccc1NC2CC3=C(CC2(C)C)C(C)(C)CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J16	compound treatment	1.238	-0.0809	-1.09	1.473	-0.0156	-0.21	-0.9221	-0.8292	1304936	CBDivE_012676	CC(C)Nc1nc(Cl)nc(Nc2ccc(C)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J17	compound treatment	1.274	-0.0449	-0.61	1.487	-0.00159	-0.02	-0.4437	-0.7319	1920828	CBDivE_012677	Oc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J18	compound treatment	1.228	-0.0909	-1.23	1.461	-0.0276	-0.38	-1.1332	-0.8834	1920829	CBDivE_012678	CCCCNc1nc(Cl)nc(Nc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J19	compound treatment	1.275	-0.0439	-0.59	1.528	0.0394	0.54	-0.0389	-0.0486	1195978	CBDivE_012679	Oc1ccc(O)c(c1)C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	J20	compound treatment	1.322	0.00309	0.04	1.477	-0.0116	-0.16	-0.0823	-0.5035	1521849	CBDivE_012680	CC(C)(CO)Nc1nc(Cl)nc(NCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K01	compound treatment	1.239	-0.0799	-1.08	1.521	0.0324	0.44	-0.4498	-0.386	1920830	CBDivE_012681	OS(=O)(=O)c1ccc(N/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K02	compound treatment	1.306	-0.0129	-0.17	1.456	-0.0326	-0.44	-0.4374	-0.9164	1225038	CBDivE_012682	O=C(N1CC(=O)Nc2ccccc12)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K03	compound treatment	1.316	-0.00291	-0.04	1.548	0.0594	0.81	0.5451	0.672	1920831	CBDivE_012683	COc1cccc(c1)/C(=N/NC(=N)N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K04	compound treatment	1.312	-0.00691	-0.09	1.485	-0.00359	-0.05	-0.1005	-0.9546	1432807	CBDivE_012684	CC(C)C1CCC(C)CC1OCC(O)CN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K05	compound treatment	1.456	0.137	1.85	1.614	0.125	1.71	2.517	0.9992	1298656	CBDivE_012685	CSc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K06	compound treatment	1.317	-0.00191	-0.03	1.48	-0.00859	-0.12	-0.101	-0.8427	1920832	CBDivE_012686	FC(F)(F)c1nc2ccccc2nc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K07	compound treatment	1.359	0.0401	0.54	1.521	0.0324	0.44	0.695	0.995	1920833	CBDivE_012687	CCc1ccc(cc1)/C(=N/NC(=N)N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K08	compound treatment	1.321	0.00209	0.03	1.535	0.0464	0.63	0.4675	0.7378	1251647	CBDivE_012688	Fc1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K09	compound treatment	1.252	-0.0669	-0.9	1.558	0.0694	0.95	0.031	0.0237	1920834	CBDivE_012689	C/C(=N\NC(=N)N)/c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K10	compound treatment	1.348	0.0291	0.39	1.526	0.0374	0.51	0.6382	0.9916	1920835	CBDivE_012690	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)CNC)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K11	compound treatment	1.362	0.0431	0.58	1.544	0.0554	0.76	0.9453	0.9916	1156418	CBDivE_012691	Cc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K12	compound treatment	1.31	-0.00891	-0.12	1.534	0.0454	0.62	0.3529	0.5594	1920836	CBDivE_012692	ONC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K13	compound treatment	1.28	-0.0389	-0.52	1.587	0.0984	1.34	0.5777	0.4009	1457453	CBDivE_012693	Clc1ccc(CN2CCN(CC2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K14	compound treatment	1.273	-0.0459	-0.62	1.495	0.00641	0.09	-0.3761	-0.6013	1920837	CBDivE_012694	OC(c1ccccc1)C(F)(F)C(F)(F)OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K15	compound treatment	1.398	0.0791	1.07	1.565	0.0764	1.04	1.4913	0.9999	1920838	CBDivE_012695	CCOC(=O)C(CC1=CNC2C=CC=CC21)NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K16	compound treatment	1.334	0.0151	0.2	1.555	0.0664	0.91	0.7843	0.845	1035570	CBDivE_012696	COc1ccc(cc1)C(O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K17	compound treatment	1.297	-0.0219	-0.3	1.577	0.0884	1.21	0.6435	0.5184	1920839	CBDivE_012697	OS(=O)(=O)c1ccc(NN=C2CCC(=NNc3ccc(cc3)S(=O)(=O)O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K18	compound treatment	1.315	-0.00391	-0.05	1.477	-0.0116	-0.16	-0.149	-0.8947	1920840	CBDivE_012698	CC1CCN(CCOCC(O)CNS(=O)(=O)O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K19	compound treatment	1.383	0.0641	0.86	1.586	0.0974	1.33	1.5507	0.9784	1920841	CBDivE_012699	CN(C)c1ccc(/C=N/NC(=O)C2C[C@@H]2C(=O)N\N=C\c3ccc(cc3)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	K20	compound treatment	1.367	0.0481	0.65	1.573	0.0844	1.15	1.2727	0.9632	1229641	CBDivE_012700	CCOC(=O)C(Cc1ccccc1)C(=O)Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L01	compound treatment	1.276	-0.0429	-0.58	1.434	-0.0546	-0.74	-0.9357	-0.9923	1246594	CBDivE_012701	Oc1ccc(cc1O)C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L02	compound treatment	1.278	-0.0409	-0.55	1.413	-0.0756	-1.03	-1.1191	-0.9572	1920842	CBDivE_012702	CCOC(=O)/C(=N\O)/C(=N/NC(=O)c1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L03	compound treatment	1.36	0.0411	0.55	1.477	-0.0116	-0.16	0.2802	0.4862	1920843	CBDivE_012703	CCOC(=O)C1=C(N)Oc2ccc3ccccc3c2C1c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L04	compound treatment	1.289	-0.0299	-0.4	1.455	-0.0336	-0.46	-0.6092	-0.998	1920844	CBDivE_012704	[O-][N+](=O)c1ccc(NNC(=O)c2sc3ccccc3c2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L05	compound treatment	1.196	-0.123	-1.66	1.489	4.13E-4	0.01	-1.1685	-0.7047	1920845	CBDivE_012705	CCOC(=O)CNc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L06	compound treatment	1.316	-0.00291	-0.04	1.43	-0.0586	-0.8	-0.5927	-0.741	1920846	CBDivE_012706	CCN(CC)c1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(n1)N(CC)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L07	compound treatment	1.265	-0.0539	-0.73	1.501	0.0124	0.17	-0.3946	-0.5284	1920847	CBDivE_012707	Cc1ccc(cc1)S(=O)(=O)O/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L08	compound treatment	1.265	-0.0539	-0.73	1.478	-0.0106	-0.14	-0.6164	-0.8312	1920848	CBDivE_012708	CCc1cc2c(SCC(=O)O)ncnc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L09	compound treatment	1.308	-0.0109	-0.15	1.497	0.00841	0.11	-0.023	-0.1231	1920849	CBDivE_012709	Cc1ccccc1C(=O)O/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L10	compound treatment	1.312	-0.00691	-0.09	1.437	-0.0516	-0.7	-0.5634	-0.7939	1920850	CBDivE_012710	CC(C)(C)Nc1nc(Cl)nc(Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L11	compound treatment	1.306	-0.0129	-0.17	1.477	-0.0116	-0.16	-0.2349	-0.9988	1920851	CBDivE_012711	Cc1cccc(Nc2nc(cs2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L12	compound treatment	1.315	-0.00391	-0.05	1.46	-0.0286	-0.39	-0.313	-0.7956	1920852	CBDivE_012712	C/C(=C/C(=O)NCc1ccccc1)/NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L13	compound treatment	1.344	0.0251	0.34	1.5	0.0114	0.16	0.3494	0.9379	1292262	CBDivE_012713	CC(=O)Oc1ccc(cc1)c2csc(Nc3cccc(O)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L14	compound treatment	1.325	0.00609	0.08	1.446	-0.0426	-0.58	-0.3526	-0.6011	1920853	CBDivE_012714	C/C(=N\N=C(/C)\c1ccc(F)cc1)/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L15	compound treatment	1.325	0.00609	0.08	1.446	-0.0426	-0.58	-0.3526	-0.6011	1920854	CBDivE_012715	Fc1ccc(cc1)C(=O)O/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L16	compound treatment	1.276	-0.0429	-0.58	1.466	-0.0226	-0.31	-0.6271	-0.9564	1920855	CBDivE_012716	C/C(=N\N=C(/C)\c1ccc(Cl)c(Cl)c1)/c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L17	compound treatment	1.308	-0.0109	-0.15	1.546	0.0574	0.78	0.4495	0.5643	1920856	CBDivE_012717	CC(C)(C)c1ccc(cc1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L18	compound treatment	1.282	-0.0369	-0.5	1.429	-0.0596	-0.81	-0.9267	-0.9724	1007983	CBDivE_012718	CC(C)C(O)(C#CC(O)(C(C)C)C(C)C)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L19	compound treatment	1.3	-0.0189	-0.26	1.49	0.00141	0.02	-0.1668	-0.6518	1920857	CBDivE_012719	Cc1cccc(c1)C(=O)O/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	L20	compound treatment	1.279	-0.0399	-0.54	1.501	0.0124	0.17	-0.261	-0.4625	1920858	CBDivE_012720	C/C(=N\N=C(/C)\c1cccs1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M01	compound treatment	1.381	0.0621	0.84	1.492	0.00341	0.05	0.6252	0.7453	1162694	CBDivE_012721	COC(=O)C(CC(C)C)NC(=O)c1cc(OC)c(OC)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M02	compound treatment	1.254	-0.0649	-0.88	1.424	-0.0646	-0.88	-1.242	-1.0	1153609	CBDivE_012722	OC(=O)c1cccc(NC2SC(=O)N(C2=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M03	compound treatment	1.272	-0.0469	-0.63	1.537	0.0484	0.66	0.0193	0.0211	1920859	CBDivE_012723	CC(=O)c1ccc(OC(=O)c2ccc(Br)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M04	compound treatment	1.283	-0.0359	-0.48	1.536	0.0474	0.65	0.1146	0.1418	1920860	CBDivE_012724	CN(C)/C(=C/C(=O)c1ccccc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M05	compound treatment	1.462	0.143	1.93	1.509	0.0204	0.28	1.5618	0.8008	1920861	CBDivE_012725	OC(C/N=C/c1ccccc1O)C/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M06	compound treatment	1.285	-0.0339	-0.46	1.51	0.0214	0.29	-0.117	-0.2156	1920862	CBDivE_012726	CCCC(C(C(=O)OC)C(=O)OC)C(=O)CCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M07	compound treatment	1.365	0.0461	0.62	1.527	0.0384	0.52	0.81	0.9964	1920863	CBDivE_012727	CN(C)c1ccc(/C=N/NC(=N)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M08	compound treatment	1.317	-0.00191	-0.03	1.501	0.0124	0.17	0.1015	0.5925	1920864	CBDivE_012728	OC(=O)CC(NC(=O)COc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M09	compound treatment	1.383	0.0641	0.86	1.623	0.134	1.83	1.9074	0.9412	1920865	CBDivE_012729	OS(=O)(=O)c1ccc(N/N=C/CCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M10	compound treatment	1.324	0.00509	0.07	1.487	-0.00159	-0.02	0.0332	0.4618	1413527	CBDivE_012730	OC(COc1ccc2ccccc2c1)CN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M11	compound treatment	1.39	0.0711	0.96	1.565	0.0764	1.04	1.4149	0.9991	1920866	CBDivE_012731	O=C(NOCONC(=O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M12	compound treatment	1.33	0.0111	0.15	1.51	0.0214	0.29	0.3122	0.9517	1920867	CBDivE_012732	Cc1cc(C)c(SCCc2ccncc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M13	compound treatment	1.247	-0.0719	-0.97	1.594	0.105	1.44	0.3304	0.1905	1920868	CBDivE_012733	NC(=O)CS(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M14	compound treatment	1.316	-0.00291	-0.04	1.499	0.0104	0.14	0.0726	0.4929	1730890	CBDivE_012734	CC(C)C1CCC(C)CC1OCC(O)CN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M15	compound treatment	1.303	-0.0159	-0.21	1.502	0.0134	0.18	-0.0225	-0.0796	1920869	CBDivE_012735	C[C@@H]1Oc2ccccc2O[C@@]1(O)c3ccc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M16	compound treatment	1.293	-0.0259	-0.35	1.502	0.0134	0.18	-0.1178	-0.2987	1134668	CBDivE_012736	CC(C)NCC(O)COC1CC(C)CCC1C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M17	compound treatment	1.443	0.124	1.67	1.546	0.0574	0.78	1.7373	0.9401	1472670	CBDivE_012737	Cc1ccc(cc1)S(=O)(=O)CC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M18	compound treatment	1.339	0.0201	0.27	1.511	0.0224	0.31	0.4077	0.9982	1229921	CBDivE_012738	CC(C)C1CCC(C)CC1OCC(O)CNC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M19	compound treatment	1.44	0.121	1.63	1.616	0.127	1.74	2.3837	0.9995	1920870	CBDivE_012739	O=C(C1Oc2ccccc2OC=C1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	M20	compound treatment	1.332	0.0131	0.18	1.521	0.0324	0.44	0.4374	0.919	1920871	CBDivE_012740	CCCCOc1ccc(O)c(c1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N01	compound treatment	1.269	-0.0499	-0.67	1.428	-0.0606	-0.83	-1.0603	-0.9948	1920872	CBDivE_012741	Cc1[nH]c2ccccc2c1/C=N/c3ccc(cc3C)c4ccc(\N=C\c5c(C)[nH]c6ccccc56)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N02	compound treatment	1.237	-0.0819	-1.11	1.467	-0.0216	-0.29	-0.9895	-0.8653	1920873	CBDivE_012742	CN1CCCCc2c1[nH]c3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N03	compound treatment	1.307	-0.0119	-0.16	1.404	-0.0846	-1.15	-0.9293	-0.7979	1920874	CBDivE_012743	Cc1ccsc1/C=N/c2ccc(cc2)c3nc4ccc(C)cc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N04	compound treatment	1.27	-0.0489	-0.66	1.395	-0.0936	-1.28	-1.369	-0.9529	1920875	CBDivE_012744	Fc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N05	compound treatment	1.346	0.0271	0.37	1.448	-0.0406	-0.55	-0.133	-0.2005	1920876	CBDivE_012745	[O-][N+](=O)c1ccc2NC(=O)/C(=N\c3cccc4c(=O)[nH][nH]c(=O)c34)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N06	compound treatment	1.329	0.0101	0.14	1.463	-0.0256	-0.35	-0.1505	-0.4018	1920877	CBDivE_012746	C/C(=N\NC(=O)c1cc2ccccc2cc1O)/c3ccccc3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N07	compound treatment	1.252	-0.0669	-0.9	1.506	0.0174	0.24	-0.4704	-0.504	1920878	CBDivE_012747	Cc1ccsc1/C=N/c2cccc3c(\N=C\c4sccc4C)cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N08	compound treatment	1.261	-0.0579	-0.78	1.459	-0.0296	-0.4	-0.8377	-0.9527	1920879	CBDivE_012748	CC1(C)CC(CC(C)(C)N1)/N=C/C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N09	compound treatment	1.283	-0.0359	-0.48	1.497	0.00841	0.11	-0.2615	-0.5251	1920880	CBDivE_012749	CC1CCN(c2ccccc2N1S(=O)(=O)c3ccc(C)cc3)S(=O)(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N10	compound treatment	1.314	-0.00491	-0.07	1.462	-0.0266	-0.36	-0.3032	-0.8227	1255178	CBDivE_012750	Cc1cc(CN2C(=O)c3ccccc3C2=O)on1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N11	compound treatment	1.31	-0.00891	-0.12	1.494	0.00541	0.07	-0.0328	-0.2326	1920881	CBDivE_012751	C/C(=N/OC(=O)c1ccc(Cl)cc1Cl)/C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N12	compound treatment	1.253	-0.0659	-0.89	1.439	-0.0496	-0.68	-1.1069	-0.9909	1920882	CBDivE_012752	Clc1cccc(Cl)c1/C=N/NC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N13	compound treatment	1.325	0.00609	0.08	1.477	-0.0116	-0.16	-0.0537	-0.3013	1920883	CBDivE_012753	Brc1ccc(cc1)C(=O)ON=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N14	compound treatment	1.299	-0.0199	-0.27	1.46	-0.0286	-0.39	-0.4656	-0.9835	1920884	CBDivE_012754	CCN(CC)CC#CCC(O)(C1CCCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N15	compound treatment	1.302	-0.0169	-0.23	1.438	-0.0506	-0.69	-0.6491	-0.8934	1920885	CBDivE_012755	O=C(ON=C1CCCCC1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N16	compound treatment	1.333	0.0141	0.19	1.42	-0.0686	-0.94	-0.527	-0.5521	1920886	CBDivE_012756	COC(=O)CCNC(C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N17	compound treatment	1.213	-0.106	-1.43	1.445	-0.0436	-0.59	-1.4306	-0.9245	1920887	CBDivE_012757	OS(=O)(=O)c1cccc2c(cccc12)S(=O)(=[OH])O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N18	compound treatment	1.323	0.00409	0.06	1.428	-0.0606	-0.83	-0.5452	-0.6584	1920888	CBDivE_012758	CCCCCCOC(=O)CCCCC(=O)OCCCCCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N19	compound treatment	1.276	-0.0429	-0.58	1.506	0.0174	0.24	-0.2414	-0.3859	1608631	CBDivE_012759	NCCC1CCCCCC(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	N20	compound treatment	1.291	-0.0279	-0.38	1.461	-0.0276	-0.38	-0.5323	-1.0	1920889	CBDivE_012760	OC(C#Cc1ccccc1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O01	compound treatment	1.394	0.0751	1.01	1.496	0.00741	0.1	0.7878	0.7738	1920890	CBDivE_012761	Clc1ccc(cc1)S(=O)(=O)C2(CCCC2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O02	compound treatment	1.292	-0.0269	-0.36	1.503	0.0144	0.2	-0.1177	-0.2852	1920891	CBDivE_012762	CC(C)COc1ccc(cc1)/C(=N\NS(=O)(=O)c2ccc(C)cc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O03	compound treatment	1.27	-0.0489	-0.66	1.522	0.0334	0.46	-0.1444	-0.1801	1920892	CBDivE_012763	CCOC(=O)N/N=C/c1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O04	compound treatment	1.354	0.0351	0.47	1.504	0.0154	0.21	0.4833	0.9332	1130571	CBDivE_012764	CC1CCC(CC1)OC(=O)CCCC(=O)Oc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O05	compound treatment	1.239	-0.0799	-1.08	1.471	-0.0176	-0.24	-0.9319	-0.8438	1920893	CBDivE_012765	COc1cccc(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O06	compound treatment	1.276	-0.0429	-0.58	1.473	-0.0156	-0.21	-0.5596	-0.9075	1920894	CBDivE_012766	[O-][N+](=O)c1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O07	compound treatment	1.248	-0.0709	-0.96	1.526	0.0374	0.51	-0.3157	-0.2912	1920895	CBDivE_012767	CCOC(=O)N/N=C/c1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O08	compound treatment	1.291	-0.0279	-0.38	1.528	0.0394	0.54	0.1138	0.1734	1126167	CBDivE_012768	CC(C)NCC(O)COc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O09	compound treatment	1.367	0.0481	0.65	1.494	0.00541	0.07	0.5109	0.7825	1920896	CBDivE_012769	C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O10	compound treatment	1.257	-0.0619	-0.84	1.466	-0.0226	-0.31	-0.8084	-0.9081	1301683	CBDivE_012770	Cc1ccc(CCSc2ccc(F)cc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O11	compound treatment	1.428	0.109	1.47	1.484	-0.00459	-0.06	0.9964	0.6764	1184207	CBDivE_012771	Cc1cc(=O)oc2cc(OCC(=O)N3CCOCC3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O12	compound treatment	1.333	0.0141	0.19	1.485	-0.00359	-0.05	0.0998	0.5086	1920897	CBDivE_012772	CCCOP(=S)(OCCC)SCSP(=S)(OCCC)OCCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O13	compound treatment	1.287	-0.0319	-0.43	1.486	-0.00259	-0.04	-0.3294	-0.7625	1920898	CBDivE_012773	C/C(=N\Nc1ccccc1)/c2nonc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O14	compound treatment	1.244	-0.0749	-1.01	1.462	-0.0266	-0.36	-0.971	-0.9043	1206294	CBDivE_012774	Nc1c(sc2nc(cc(c3cccs3)c12)c4ccccc4)C(=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O15	compound treatment	1.406	0.0871	1.17	1.488	-5.87E-4	-0.01	0.8251	0.7023	1920899	CBDivE_012775	CCN(CC)C(=S)SCc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O16	compound treatment	1.358	0.0391	0.53	1.494	0.00541	0.07	0.4251	0.7983	1920900	CBDivE_012776	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O17	compound treatment	1.381	0.0621	0.84	1.66	0.171	2.34	2.2451	0.9042	1920901	CBDivE_012777	CCCCNC(=O)/C(=C\c1ccc(o1)c2ccc(cc2)[N+](=O)[O-])/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O18	compound treatment	1.271	-0.0479	-0.65	1.49	0.00141	0.02	-0.4434	-0.6857	1920902	CBDivE_012778	CC(C)CN(CC(C)C)S(=O)(=O)c1ccc2n(CCCC(=O)O)c(nc2c1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O19	compound treatment	1.417	0.0981	1.32	1.511	0.0224	0.31	1.1518	0.8481	1920903	CBDivE_012779	CCCCCOc1ccc(cc1)c2ccc(cc2)C(=O)NC(NCc3ccccc3)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	O20	compound treatment	1.26	-0.0589	-0.79	1.463	-0.0256	-0.35	-0.8087	-0.9317	1920904	CBDivE_012780	C=CCNC(=O)C1CC=CCC1C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P01	compound treatment	1.305	-0.0139	-0.19	1.483	-0.00559	-0.08	-0.1866	-0.9211	1920905	CBDivE_012781	Clc1ccc(cc1)S(=O)(=O)N=S(=O)(c2ccc(Br)cc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P02	compound treatment	1.295	-0.0239	-0.32	1.398	-0.0906	-1.24	-1.1016	-0.8628	1920906	CBDivE_012782	CC(C)N(CC(O)COc1ccccc1)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P03	compound treatment	1.354	0.0351	0.47	1.421	-0.0676	-0.92	-0.317	-0.3059	1920907	CBDivE_012783	O=C(Nc1cccc2c(NC(=O)c3cccc4ccccc34)cccc12)c5cccc6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P04	compound treatment	1.242	-0.0769	-1.04	1.422	-0.0666	-0.91	-1.3757	-0.9978	1920908	CBDivE_012784	C=CCS(=O)(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P05	compound treatment	1.26	-0.0589	-0.79	1.396	-0.0926	-1.26	-1.4547	-0.9751	1632426	CBDivE_012785	Oc1cccc2ccc(Nc3ccc4cccc(O)c4n3)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P06	compound treatment	1.249	-0.0699	-0.94	1.359	-0.13	-1.77	-1.9164	-0.9568	1023679	CBDivE_012786	C(N1CCN(CC1)c2ccccc2)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P07	compound treatment	1.279	-0.0399	-0.54	1.451	-0.0376	-0.51	-0.7432	-0.9997	1920909	CBDivE_012787	O/N=C\1/C(=O)Nc2ccc(Br)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P08	compound treatment	1.297	-0.0219	-0.3	1.403	-0.0856	-1.17	-1.0343	-0.8591	1152902	CBDivE_012788	Cc1ccc(C)c(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P09	compound treatment	1.215	-0.104	-1.4	1.387	-0.102	-1.39	-1.9708	-1.0	1920910	CBDivE_012789	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P10	compound treatment	0.727	-0.592	-7.99	0.929	-0.56	-7.63	-11.0422	-0.9997	1920911	CBDivE_012790	COc1cccc(c1)C(O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P11	compound treatment	1.319	8.78E-5	0.0	1.388	-0.101	-1.37	-0.9691	-0.7065	1920912	CBDivE_012791	CCn1c2ccccc2c3cc(/C=N/c4ccccc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P12	compound treatment	1.244	-0.0749	-1.01	1.391	-0.0976	-1.33	-1.6556	-0.9908	1920913	CBDivE_012792	CCOC(=O)C(O)(c1ccc(CCC(=O)O)o1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P13	compound treatment	1.298	-0.0209	-0.28	1.43	-0.0586	-0.8	-0.7644	-0.9022	1920914	CBDivE_012793	CC[n+]1c(/C=C/C=C/2\C=CN(CCCS(=O)(=O)O)c3ccccc23)ccc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P14	compound treatment	1.266	-0.0529	-0.71	1.412	-0.0766	-1.04	-1.2432	-0.9828	1357769	CBDivE_012794	COC(=O)c1ccccc1NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P15	compound treatment	1.36	0.0411	0.55	1.464	-0.0246	-0.34	0.1549	0.2391	1633823	CBDivE_012795	COc1ccc2[nH]c(nc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P16	compound treatment	1.278	-0.0409	-0.55	1.385	-0.104	-1.41	-1.3891	-0.916	1920915	CBDivE_012796	OC(CN1CCCCC1)Cn2c(=O)n(CC(O)CN3CCCCC3)c(=O)n(CC(O)CN4CCCCC4)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P17	compound treatment	1.243	-0.0759	-1.02	1.382	-0.107	-1.45	-1.7519	-0.9853	1920916	CBDivE_012797	OC(=O)c1ccc(C(=O)O)c2c(ccc(C(=O)O)c12)c3ccc(C(=O)O)c4c(ccc(C(=O)O)c34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P18	compound treatment	1.224	-0.0949	-1.28	1.465	-0.0236	-0.32	-1.1328	-0.8581	1920917	CBDivE_012798	Cc1ccc(cc1)C(=O)COC(=O)c2cccc(I)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P19	compound treatment	1.31	-0.00891	-0.12	1.439	-0.0496	-0.68	-0.5632	-0.82	1920918	CBDivE_012799	CCN1CCN(CC1)c2ccc(/N=C/c3cc(Br)cc(OC)c3O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.40	P20	compound treatment	1.288	-0.0309	-0.42	1.397	-0.0916	-1.25	-1.178	-0.8947	1138396	CBDivE_012800	Cc1nc2cc(ccc2n1c3ccccc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A01	compound treatment	1.282	-0.0069	-0.09	1.257	0.0284	0.39	0.2077	0.522	1920919	CBDivE_012801	CN(C)CCCOC(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A02	compound treatment	1.288	-9.0E-4	-0.01	1.253	0.0244	0.33	0.2263	0.6808	1920920	CBDivE_012802	N1C(Nc2cccc3cccc1c23)c4ccc(cc4)C5Nc6cccc7cccc(N5)c67
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A03	compound treatment	1.323	0.0341	0.46	1.299	0.0704	0.96	1.0038	0.9433	1920921	CBDivE_012803	Clc1ccc(Sc2ccc(cc2)C(=O)c3ccc(Sc4ccc(Cl)cc4)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A04	compound treatment	1.298	0.0091	0.12	1.241	0.0124	0.17	0.206	0.9879	1920922	CBDivE_012804	Cc1ccc(cc1)I(OS(=O)(=O)C(F)(F)F)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A05	compound treatment	1.289	1.0E-4	0.0	1.235	0.00636	0.09	0.0623	0.718	1495380	CBDivE_012805	O=C(NC(=S)NCc1ccccc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A06	compound treatment	1.303	0.0141	0.19	1.272	0.0434	0.59	0.5526	0.8897	1029416	CBDivE_012806	Cc1cc([N+](=O)[O-])c(C)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A07	compound treatment	1.306	0.0171	0.23	1.256	0.0274	0.37	0.427	0.9733	1920923	CBDivE_012807	COc1cc(OC)c(cc1OC)C2CC(=Nc3ccccc3S2)c4c(O)cc(C)oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A08	compound treatment	1.293	0.0041	0.06	1.272	0.0434	0.59	0.4572	0.7699	1920924	CBDivE_012808	FC(F)(F)C(Oc1nc(NCC=C)nc(Nc2cccc3ccccc23)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A09	compound treatment	1.281	-0.0079	-0.11	1.244	0.0154	0.21	0.0728	0.3097	1209741	CBDivE_012809	O=S(n1cnc2ccccc12)n3cnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A10	compound treatment	1.266	-0.0229	-0.31	1.238	0.00936	0.13	-0.1282	-0.3834	1220384	CBDivE_012810	CN1C(N(C)c2ccccc12)c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A11	compound treatment	1.331	0.0421	0.57	1.268	0.0394	0.54	0.7812	0.9996	1539638	CBDivE_012811	CC1(C)C(CCC1(C)C(=O)O)C(=O)Nc2ccc(Nc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A12	compound treatment	1.349	0.0601	0.81	1.279	0.0504	0.69	1.0589	0.9966	1624942	CBDivE_012812	Brc1ccc(NC(c2ccccc2)c3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A13	compound treatment	1.346	0.0571	0.77	1.314	0.0854	1.16	1.3678	0.9799	1920925	CBDivE_012813	CCCCCCCNC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A14	compound treatment	1.326	0.0371	0.5	1.308	0.0794	1.08	1.1192	0.9386	1776219	CBDivE_012814	[O-][n+]1c2CCc3nonc3-c2nn1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A15	compound treatment	1.292	0.0031	0.04	1.22	-0.00864	-0.12	-0.0537	-0.4297	1920926	CBDivE_012815	C(COCCN1CCOCCOCCOCCOCC1)OCCN2CCOCCOCCOCCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A16	compound treatment	1.297	0.0081	0.11	1.282	0.0534	0.73	0.5918	0.8043	1920927	CBDivE_012816	Nc1cc(ccc1Cl)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A17	compound treatment	1.271	-0.0179	-0.24	1.206	-0.0226	-0.31	-0.389	-0.9926	1215469	CBDivE_012817	Nc1nc(Cc2ccsc2)nc3sc4CCCCc4c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A18	compound treatment	1.352	0.0631	0.85	1.342	0.113	1.55	1.695	0.9605	1920928	CBDivE_012818	O/N=C/1\CCCc2c1nc(c3ccccc3)n2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A19	compound treatment	1.257	-0.0319	-0.43	1.206	-0.0226	-0.31	-0.5226	-0.9867	1920929	CBDivE_012819	CC(CCC=C(C)C)C(=O)OCCOc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	A20	compound treatment	1.318	0.0291	0.39	1.293	0.0644	0.88	0.8982	0.9342	1920930	CBDivE_012820	O/N=C/1\CCCc2c1nn(c3ccccc3)[n+]2[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B01	compound treatment	1.256	-0.0329	-0.44	1.231	0.00236	0.03	-0.291	-0.654	1920931	CBDivE_012821	Cc1[nH]c2ccccc2c1/C=N/c3ccc(C)c(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B02	compound treatment	1.304	0.0151	0.2	1.239	0.0104	0.14	0.244	0.984	1920932	CBDivE_012822	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B03	compound treatment	1.268	-0.0209	-0.28	1.225	-0.00364	-0.05	-0.2344	-0.8189	1920933	CBDivE_012823	Fc1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B04	compound treatment	1.321	0.0321	0.43	1.257	0.0284	0.39	0.5797	0.9984	1777564	CBDivE_012824	Cc1nc2ccccc2n1C(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B05	compound treatment	1.327	0.0381	0.51	1.309	0.0804	1.1	1.1384	0.9405	1920934	CBDivE_012825	OC(=O)C1(O)N(C(=O)Nc2ccccc21)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B06	compound treatment	1.315	0.0261	0.35	1.25	0.0214	0.29	0.455	0.9956	1113529	CBDivE_012826	Cc1cccc(C)c1NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B07	compound treatment	1.293	0.0041	0.06	1.261	0.0324	0.44	0.3512	0.7896	1920935	CBDivE_012827	C/C(=N\N=C(\C)/c1ccc(Br)cc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B08	compound treatment	1.301	0.0121	0.16	1.24	0.0114	0.15	0.225	0.9997	1308755	CBDivE_012828	Clc1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B09	compound treatment	1.295	0.0061	0.08	1.207	-0.0216	-0.3	-0.1504	-0.4911	1920936	CBDivE_012829	CCN(CC)/C(=N\O)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B10	compound treatment	1.348	0.0591	0.8	1.311	0.0824	1.12	1.358	0.9859	1920937	CBDivE_012830	O=C(C(c1ccccc1)c2ccccc2)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B11	compound treatment	1.274	-0.0149	-0.2	1.254	0.0254	0.35	0.1024	0.2561	1920938	CBDivE_012831	Brc1ccc(cc1)C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B12	compound treatment	1.263	-0.0259	-0.35	1.219	-0.00964	-0.13	-0.34	-0.9108	1682229	CBDivE_012832	O=C(C(c1ccccc1)c2ccccc2)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B13	compound treatment	1.264	-0.0249	-0.34	1.208	-0.0206	-0.28	-0.4365	-0.9961	1291296	CBDivE_012833	CC1(CC(=Nc2ccccc2N1)c3ccc(Br)cc3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B14	compound treatment	1.341	0.0521	0.7	1.3	0.0714	0.97	1.1851	0.9872	1920939	CBDivE_012834	Cc1cc(C)n(n1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B15	compound treatment	1.293	0.0041	0.06	1.287	0.0584	0.8	0.6019	0.7544	1388473	CBDivE_012835	O=C1Nc2ccccc2C1=C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B16	compound treatment	1.291	0.0021	0.03	1.234	0.00536	0.07	0.0718	0.9148	1920940	CBDivE_012836	CN(C)c1ccc(/C=C/C(C)(O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B17	compound treatment	1.328	0.0391	0.53	1.298	0.0694	0.95	1.0418	0.962	1920941	CBDivE_012837	[O-][N+](=O)c1ccc([I+]c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B18	compound treatment	1.289	1.0E-4	0.0	1.228	-6.36E-4	-0.01	-0.0052	-0.5897	1920942	CBDivE_012838	Cc1cc(C)n(n1)C(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B19	compound treatment	1.295	0.0061	0.08	1.245	0.0164	0.22	0.216	0.9081	1301055	CBDivE_012839	OCC(O)CSc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	B20	compound treatment	1.3	0.0111	0.15	1.208	-0.0206	-0.28	-0.0931	-0.292	1781380	CBDivE_012840	COc1ccccc1N2CCN(CC2)C(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C01	compound treatment	1.249	-0.0399	-0.54	1.196	-0.0326	-0.45	-0.6953	-0.9955	1538871	CBDivE_012841	CC(CC#C)OC(=O)C1C2CC(C)(CC1C)OC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C02	compound treatment	1.311	0.0221	0.3	1.304	0.0754	1.03	0.9375	0.8761	1728711	CBDivE_012842	CCOc1cc(Br)c(Br)c(C=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C03	compound treatment	1.301	0.0121	0.16	1.265	0.0364	0.5	0.4661	0.8928	1228112	CBDivE_012843	Cc1cccc2c(cc(nc12)c3ccccc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C04	compound treatment	1.301	0.0121	0.16	1.266	0.0374	0.51	0.4757	0.8891	1920943	CBDivE_012844	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C05	compound treatment	1.286	-0.0029	-0.04	1.226	-0.00264	-0.04	-0.0531	-0.9991	1920944	CBDivE_012845	CN(C)c1ccc(/C=N\Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C06	compound treatment	1.316	0.0271	0.37	1.293	0.0644	0.88	0.8791	0.9246	1603673	CBDivE_012846	COc1cc(=O)n(C)c2c(OCC3OC(C)(C)OC3(C)C)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C07	compound treatment	1.297	0.0081	0.11	1.238	0.00936	0.13	0.1676	0.997	1920945	CBDivE_012847	CC(c1ccc(o1)C2CC2C3CC3)c4ccc(o4)C5CC5C6CC6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C08	compound treatment	1.306	0.0171	0.23	1.301	0.0724	0.99	0.8609	0.8495	1531666	CBDivE_012848	COc1ccc(cc1Br)c2nc3cc(N)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C09	compound treatment	1.28	-0.0089	-0.12	1.227	-0.00164	-0.02	-0.1007	-0.8244	1920946	CBDivE_012849	CCOC(=O)C(O)(c1ccc(o1)C2CC2C3CC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C10	compound treatment	1.279	-0.0099	-0.13	1.263	0.0344	0.47	0.2369	0.4862	1920947	CBDivE_012850	CN1C(N(C)c2ccccc12)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C11	compound treatment	1.307	0.0181	0.24	1.249	0.0204	0.28	0.369	0.9979	1051739	CBDivE_012851	OC(=O)CNC(=O)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C12	compound treatment	1.315	0.0261	0.35	1.302	0.0734	1.0	0.9564	0.9018	1388285	CBDivE_012852	CC(CC(=O)NCc1ccccc1)C2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C13	compound treatment	1.288	-9.0E-4	-0.01	1.21	-0.0186	-0.25	-0.1883	-0.74	1920948	CBDivE_012853	Cc1ccc2NC(=O)/C(=N\O)/c2c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C14	compound treatment	1.31	0.0211	0.28	1.281	0.0524	0.71	0.7062	0.9187	1920949	CBDivE_012854	COc1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(n2)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C15	compound treatment	1.349	0.0601	0.81	1.304	0.0754	1.03	1.3	0.9931	1920950	CBDivE_012855	CCCCCOC(=O)C1=C(C)NC2=C(C1c3ccc(O)c(c3)[N+](=O)[O-])C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C16	compound treatment	1.325	0.0361	0.49	1.28	0.0514	0.7	0.8396	0.9842	1920951	CBDivE_012856	O/N=C/1\CC\C(=N\O)\c2nn(nc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C17	compound treatment	1.309	0.0201	0.27	1.211	-0.0176	-0.24	0.0217	0.0598	1920952	CBDivE_012857	CC(=O)C1=C(C)NC(=S)NC1c2cc(Br)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C18	compound treatment	1.338	0.0491	0.66	1.265	0.0364	0.5	0.819	0.9898	1578526	CBDivE_012858	Cc1nn(c2cccc3ccccc23)c(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C19	compound treatment	1.304	0.0151	0.2	1.161	-0.0676	-0.92	-0.5081	-0.538	1663425	CBDivE_012859	COc1cccc2c(OC)c3ccoc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	C20	compound treatment	1.27	-0.0189	-0.25	1.215	-0.0136	-0.19	-0.3118	-0.988	1920953	CBDivE_012860	CN(C)/C=N/c1ccc2nn(nc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D01	compound treatment	1.282	-0.0069	-0.09	1.257	0.0284	0.39	0.2077	0.522	1920954	CBDivE_012861	CN(C)/C=C/C=C\1/CC\C(=C\C=C\N(C)C)\C(=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D02	compound treatment	1.279	-0.0099	-0.13	1.191	-0.0376	-0.51	-0.4573	-0.8624	1140231	CBDivE_012862	Fc1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D03	compound treatment	1.272	-0.0169	-0.23	1.217	-0.0116	-0.16	-0.2734	-0.9843	1920955	CBDivE_012863	CC1(CC(=Nc2ccccc2N1)c3ccc(I)cc3)c4ccc(I)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D04	compound treatment	1.273	-0.0159	-0.21	1.213	-0.0156	-0.21	-0.3024	-1.0	1920956	CBDivE_012864	CCc1nc2cc(/N=C/c3cc(Br)cc(Br)c3O)ccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D05	compound treatment	1.294	0.0051	0.07	1.231	0.00236	0.03	0.0714	0.9403	1920957	CBDivE_012865	Oc1ccc(/C=C\2/SC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D06	compound treatment	1.288	-9.0E-4	-0.01	1.229	3.64E-4	0.0	-0.0051	-0.3872	1920958	CBDivE_012866	Fc1cccc(NC(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D07	compound treatment	1.288	-9.0E-4	-0.01	1.24	0.0114	0.15	0.101	0.6497	1920959	CBDivE_012867	Cc1cc(C)n(/N=C/c2cccc(O)c2)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D08	compound treatment	1.265	-0.0239	-0.32	1.181	-0.0476	-0.65	-0.6873	-0.9478	1128878	CBDivE_012868	COc1ccc(cc1OC)C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D09	compound treatment	1.279	-0.0099	-0.13	1.281	0.0524	0.71	0.4105	0.5651	1112632	CBDivE_012869	COc1ccccc1NC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D10	compound treatment	1.272	-0.0169	-0.23	1.201	-0.0276	-0.38	-0.4277	-0.971	1690718	CBDivE_012870	COC(=O)c1ccc(NC(=O)C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D11	compound treatment	1.282	-0.0069	-0.09	1.212	-0.0166	-0.23	-0.2262	-0.9226	1101854	CBDivE_012871	FC(F)(F)c1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D12	compound treatment	1.292	0.0031	0.04	1.239	0.0104	0.14	0.1295	0.8787	1920960	CBDivE_012872	Brc1ccccc1NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D13	compound treatment	1.334	0.0451	0.61	1.281	0.0524	0.71	0.9351	0.9968	1423298	CBDivE_012873	Clc1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D14	compound treatment	1.29	0.0011	0.01	1.236	0.00736	0.1	0.0815	0.8029	1920961	CBDivE_012874	C/C(=N\NC(=O)c1ccccc1)/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D15	compound treatment	1.249	-0.0399	-0.54	1.195	-0.0336	-0.46	-0.705	-0.9968	1920962	CBDivE_012875	Clc1ccc(cc1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D16	compound treatment	1.319	0.0301	0.41	1.222	-0.00664	-0.09	0.2231	0.5364	1872646	CBDivE_012876	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D17	compound treatment	1.31	0.0211	0.28	1.242	0.0134	0.18	0.3301	0.9768	1670466	CBDivE_012877	CC(C)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D18	compound treatment	1.31	0.0211	0.28	1.217	-0.0116	-0.16	0.0891	0.2733	1920963	CBDivE_012878	N1N=C(Sc2ccccc2)c3ccccc3N=C1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D19	compound treatment	1.306	0.0171	0.23	1.211	-0.0176	-0.24	-0.0069	-0.0208	1111960	CBDivE_012879	Fc1ccc(cc1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	D20	compound treatment	1.302	0.0131	0.18	1.212	-0.0166	-0.23	-0.0354	-0.1233	1545979	CBDivE_012880	Cc1c(Cl)cccc1NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E01	compound treatment	1.278	-0.0109	-0.15	1.208	-0.0206	-0.28	-0.303	-0.9542	1296768	CBDivE_012881	COc1cc(ccc1O)C2C(=C(C)NC3=C2C(=O)CC(C)(C)C3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E02	compound treatment	1.315	0.0261	0.35	1.316	0.0874	1.19	1.0914	0.8785	1920964	CBDivE_012882	CC(C)Nc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E03	compound treatment	1.312	0.0231	0.31	1.287	0.0584	0.8	0.7831	0.9162	1920965	CBDivE_012883	COc1ccc(/N=C/c2ccc(o2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E04	compound treatment	1.303	0.0141	0.19	1.307	0.0784	1.07	0.8901	0.8201	1920966	CBDivE_012884	CCN(CC(O)COc1cc(C)c(Cl)c(C)c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E05	compound treatment	1.285	-0.0039	-0.05	1.244	0.0154	0.21	0.1109	0.5136	1920967	CBDivE_012885	COc1ccc(/N=C/c2ccc(Cl)cc2Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E06	compound treatment	1.301	0.0121	0.16	1.272	0.0434	0.59	0.5336	0.8698	1920968	CBDivE_012886	[O-][N+](=O)c1cc(Cl)c(Sc2nc3ccccc3s2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E07	compound treatment	1.296	0.0071	0.1	1.247	0.0184	0.25	0.2448	0.9131	1920969	CBDivE_012887	CC1=C(C(NC(=S)N1)c2cccs2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E08	compound treatment	1.277	-0.0119	-0.16	1.292	0.0634	0.86	0.4975	0.566	1920970	CBDivE_012888	C1C/C(=N\N=C\2/CCCc3nonc23)/c4nonc4C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E09	compound treatment	1.333	0.0441	0.59	1.28	0.0514	0.7	0.916	0.9967	1119765	CBDivE_012889	COc1cc(ccc1O)C2Cc3c(C(=O)O)c(=O)cc(C)n3-c4ccccc4S2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E10	compound treatment	1.326	0.0371	0.5	1.306	0.0774	1.05	1.0999	0.9419	1227569	CBDivE_012890	CC(=O)Nc1cccc(NC(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E11	compound treatment	1.281	-0.0079	-0.11	1.214	-0.0146	-0.2	-0.2165	-0.9568	1920971	CBDivE_012891	CCc1cc2c(ncnc2s1)n3nc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E12	compound treatment	1.324	0.0351	0.47	1.293	0.0644	0.88	0.9555	0.9581	1708748	CBDivE_012892	CC(=O)Nc1cccc(NC(=O)C(c2ccccc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E13	compound treatment	1.269	-0.0199	-0.27	1.216	-0.0126	-0.17	-0.3117	-0.977	1920972	CBDivE_012893	CN(C)CCCOC(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E14	compound treatment	1.301	0.0121	0.16	1.282	0.0534	0.73	0.63	0.8447	1920973	CBDivE_012894	Clc1ccccc1C(=O)Nc2cccc(NC(=O)c3cccc(I)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E15	compound treatment	1.314	0.0251	0.34	1.25	0.0214	0.29	0.4454	0.9972	1230646	CBDivE_012895	C1CCC(CC1)c2ccc3c(c2)c4CCCc5nccn3c45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E16	compound treatment	1.327	0.0381	0.51	1.265	0.0364	0.5	0.7141	0.9998	1920974	CBDivE_012896	Oc1ccc2cc(ccc2c1/C=N/c3ccc4oc(nc4c3)c5ccccc5)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E17	compound treatment	1.292	0.0031	0.04	1.197	-0.0316	-0.43	-0.2755	-0.6356	1920975	CBDivE_012897	Oc1c(/C=C/2\Sc3ccccc3C2=O)cc(Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E18	compound treatment	1.306	0.0171	0.23	1.27	0.0414	0.56	0.562	0.9222	1920976	CBDivE_012898	Clc1ccc(Cl)c(NC(=O)c2ccccc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E19	compound treatment	1.283	-0.0059	-0.08	1.229	3.64E-4	0.0	-0.0528	-0.6618	1920977	CBDivE_012899	FC(F)(F)C(=O)OI1OC(=O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	E20	compound treatment	1.308	0.0191	0.26	1.285	0.0564	0.77	0.7257	0.8952	1777150	CBDivE_012900	COC(=O)C1=C(C)NC2=C(C1c3ccc(O)c(c3)[N+](=O)[O-])C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F01	compound treatment	1.281	-0.0079	-0.11	1.218	-0.0106	-0.15	-0.1779	-0.9885	1920978	CBDivE_012901	Clc1cccc(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F02	compound treatment	1.278	-0.0109	-0.15	1.202	-0.0266	-0.36	-0.3608	-0.9208	1920979	CBDivE_012902	Cc1nc2ccccc2n1C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F03	compound treatment	1.271	-0.0179	-0.24	1.199	-0.0296	-0.4	-0.4565	-0.9697	1615807	CBDivE_012903	CC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F04	compound treatment	1.243	-0.0459	-0.62	1.181	-0.0476	-0.65	-0.8972	-0.9997	1426293	CBDivE_012904	CCN(C(=O)C(c1ccccc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F05	compound treatment	1.306	0.0171	0.23	1.237	0.00836	0.11	0.2438	0.9472	1920980	CBDivE_012905	COC(=O)/C(=C\C=C\C=C\N(C)C)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F06	compound treatment	1.261	-0.0279	-0.38	1.183	-0.0456	-0.62	-0.7062	-0.971	1780790	CBDivE_012906	COc1ccccc1N2CCN(CC2)C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F07	compound treatment	1.308	0.0191	0.26	1.254	0.0254	0.35	0.4268	0.9895	1920981	CBDivE_012907	CN(C)/C=C/C=C1C(=O)CC(C)(C)CC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F08	compound treatment	1.275	-0.0139	-0.19	1.18	-0.0486	-0.66	-0.6016	-0.8728	1084167	CBDivE_012908	Clc1cccc(NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F09	compound treatment	1.289	1.0E-4	0.0	1.227	-0.00164	-0.02	-0.0148	-0.663	1920982	CBDivE_012909	COc1ccc(cc1)N2C(=O)CC(NCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F10	compound treatment	1.335	0.0461	0.62	1.282	0.0534	0.73	0.9543	0.9969	1920983	CBDivE_012910	CN(C)/C(=C\1/C(=NN(C1=O)c2c(F)c(F)c(F)c(F)c2F)C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F11	compound treatment	1.322	0.0331	0.45	1.298	0.0694	0.95	0.9846	0.9413	1920984	CBDivE_012911	CN(C)/C=C/C=C\1/CCc2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F12	compound treatment	1.35	0.0611	0.82	1.246	0.0174	0.24	0.7503	0.8748	1920985	CBDivE_012912	Brc1ccc(cc1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F13	compound treatment	1.285	-0.0039	-0.05	1.225	-0.00364	-0.05	-0.0723	-0.9996	1920986	CBDivE_012913	CS(=O)(=O)c1ccc2ccc(cc2c1)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F14	compound treatment	1.263	-0.0259	-0.35	1.224	-0.00464	-0.06	-0.2918	-0.8217	1429701	CBDivE_012914	CCc1ccccc1NC(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F15	compound treatment	1.264	-0.0249	-0.34	1.226	-0.00264	-0.04	-0.2629	-0.7783	1920987	CBDivE_012915	Clc1cccc(c1)N2C(=O)CC(NCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F16	compound treatment	1.31	0.0211	0.28	1.252	0.0234	0.32	0.4266	0.9984	1696139	CBDivE_012916	Fc1ccc(cc1)C(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F17	compound treatment	1.246	-0.0429	-0.58	1.188	-0.0406	-0.55	-0.8011	-0.9998	1920988	CBDivE_012917	Fc1ccc(NC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F18	compound treatment	1.324	0.0351	0.47	1.227	-0.00164	-0.02	0.3191	0.673	1665039	CBDivE_012918	CCc1ccccc1NC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F19	compound treatment	1.285	-0.0039	-0.05	1.198	-0.0306	-0.42	-0.3326	-0.7899	1196623	CBDivE_012919	COC(=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	F20	compound treatment	1.297	0.0081	0.11	1.24	0.0114	0.15	0.1868	0.9854	1920989	CBDivE_012920	COC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G01	compound treatment	1.256	-0.0329	-0.44	1.227	-0.00164	-0.02	-0.3296	-0.7417	1920990	CBDivE_012921	COc1ccccc1NC(=O)NC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G02	compound treatment	1.26	-0.0289	-0.39	1.219	-0.00964	-0.13	-0.3686	-0.8959	1920991	CBDivE_012922	COc1cccc(OCC(O)CN(C)S(=O)(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G03	compound treatment	1.256	-0.0329	-0.44	1.199	-0.0296	-0.4	-0.5996	-0.9989	1439295	CBDivE_012923	COc1c2CCC(O)C(CC=C(C)C)(OC)c2nc3occc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G04	compound treatment	1.277	-0.0119	-0.16	1.246	0.0174	0.24	0.0539	0.1885	1920992	CBDivE_012924	FC(F)(F)C(=O)n1nnc2cc(Cl)c(Cl)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G05	compound treatment	1.276	-0.0129	-0.17	1.191	-0.0376	-0.51	-0.486	-0.8967	1484083	CBDivE_012925	COc1c2CCC(O)C(CCC(C)(C)O)(OC)c2nc3occc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G06	compound treatment	1.315	0.0261	0.35	1.284	0.0554	0.75	0.7828	0.9397	1920993	CBDivE_012926	Clc1ccc(cc1)S(=O)(=O)Nc2ccccc2NS(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G07	compound treatment	1.31	0.0211	0.28	1.265	0.0364	0.5	0.5519	0.9653	1920994	CBDivE_012927	CC1=C(C(NC(=S)N1)c2ccc3CCc4cccc2c43)C(=O)Nc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G08	compound treatment	1.294	0.0051	0.07	1.3	0.0714	0.97	0.7368	0.7552	1605101	CBDivE_012928	CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c3cccnc3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G09	compound treatment	1.287	-0.0019	-0.03	1.201	-0.0276	-0.38	-0.2846	-0.7535	1920995	CBDivE_012929	Cc1ccc([I+]c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G10	compound treatment	1.284	-0.0049	-0.07	1.271	0.0424	0.58	0.3617	0.6221	1920996	CBDivE_012930	[O-][N+](=O)c1ccc(Sc2nc3ccccc3s2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G11	compound treatment	1.291	0.0021	0.03	1.209	-0.0196	-0.27	-0.1693	-0.6288	1920997	CBDivE_012931	CCOC(=O)C1=C(C)NC(=S)NC1c2ccc3CCc4cccc2c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G12	compound treatment	1.315	0.0261	0.35	1.288	0.0594	0.81	0.8214	0.9305	934	CBDivE_012932	Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G13	compound treatment	1.267	-0.0219	-0.3	1.18	-0.0486	-0.66	-0.6779	-0.9336	1920998	CBDivE_012933	CC(=O)c1cccc(NC(=O)C(Cc2ccc(cc2)[N+](=O)[O-])N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G14	compound treatment	1.332	0.0431	0.58	1.318	0.0894	1.22	1.2728	0.9427	1920999	CBDivE_012934	CCOC(=O)C1=C(C)N(C)C(=O)NC1c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G15	compound treatment	1.319	0.0301	0.41	1.249	0.0204	0.28	0.4835	0.9828	1921000	CBDivE_012935	O/N=C/1\CC(OC21CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G16	compound treatment	1.296	0.0071	0.1	1.3	0.0714	0.97	0.7558	0.773	1692480	CBDivE_012936	COc1cc(C=O)ccc1OC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G17	compound treatment	1.374	0.0851	1.15	1.259	0.0304	0.41	1.1046	0.9051	1921001	CBDivE_012937	Cc1ccccc1C(=O)Nc2cccc(NC(=O)c3cccc(I)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G18	compound treatment	1.327	0.0381	0.51	1.255	0.0264	0.36	0.6177	0.9847	1036956	CBDivE_012938	Clc1ccccc1C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G19	compound treatment	1.349	0.0601	0.81	1.306	0.0774	1.05	1.3193	0.9915	1921002	CBDivE_012939	Fc1ccc(/C=N/N=C/c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	G20	compound treatment	1.318	0.0291	0.39	1.276	0.0474	0.65	0.7343	0.9715	1671141	CBDivE_012940	CCN(CC)c1nc(Nc2ccc(OC)cc2)nc(Nc3ccc(OC)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H01	compound treatment	1.252	-0.0369	-0.5	1.173	-0.0556	-0.76	-0.8885	-0.9791	1013650	CBDivE_012941	Clc1ccccc1C(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H02	compound treatment	1.261	-0.0279	-0.38	1.199	-0.0296	-0.4	-0.5519	-0.9994	1921003	CBDivE_012942	CC(=O)Nc1cccc(NC(=O)c2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H03	compound treatment	1.287	-0.0019	-0.03	1.21	-0.0186	-0.25	-0.1978	-0.7745	1921004	CBDivE_012943	Fc1cccc(NC(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H04	compound treatment	1.275	-0.0139	-0.19	1.185	-0.0436	-0.6	-0.5534	-0.8869	1921005	CBDivE_012944	Brc1ccccc1C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H05	compound treatment	1.323	0.0341	0.46	1.235	0.00636	0.09	0.3867	0.8259	1082124	CBDivE_012945	COc1ccccc1NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H06	compound treatment	1.246	-0.0429	-0.58	1.177	-0.0516	-0.7	-0.9071	-0.9953	1921006	CBDivE_012946	Cc1cc(C)n(n1)C(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H07	compound treatment	1.295	0.0061	0.08	1.24	0.0114	0.15	0.1678	0.9562	1742610	CBDivE_012947	Cc1c(Cl)cccc1NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H08	compound treatment	1.258	-0.0309	-0.42	1.171	-0.0576	-0.79	-0.8505	-0.956	1921007	CBDivE_012948	Fc1ccc(NC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H09	compound treatment	1.296	0.0071	0.1	1.235	0.00636	0.09	0.1291	0.9988	1009044	CBDivE_012949	Cc1cccc(NC(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H10	compound treatment	1.26	-0.0289	-0.39	1.182	-0.0466	-0.64	-0.7254	-0.9724	1484011	CBDivE_012950	COc1ccc(cc1OC)C(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H11	compound treatment	1.275	-0.0139	-0.19	1.222	-0.00664	-0.09	-0.1966	-0.9442	1921008	CBDivE_012951	Clc1ccccc1C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H12	compound treatment	1.259	-0.0299	-0.4	1.184	-0.0446	-0.61	-0.7156	-0.98	1921009	CBDivE_012952	C1C/C(=N/n2cnnc2)/c3nonc3C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H13	compound treatment	1.354	0.0651	0.88	1.315	0.0864	1.18	1.4538	0.9896	1921010	CBDivE_012953	CCn1c2ccccc2c3cc(/C=N/O)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H14	compound treatment	1.299	0.0101	0.14	1.23	0.00136	0.02	0.1095	0.7962	1921011	CBDivE_012954	C/C(=N\NC(=O)c1ccncc1)/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H15	compound treatment	1.278	-0.0109	-0.15	1.162	-0.0666	-0.91	-0.7465	-0.811	1921012	CBDivE_012955	C1C2CC3CC1CC(C2)C3=NN=C4C5CC6CC(C5)CC4C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H16	compound treatment	1.27	-0.0189	-0.25	1.217	-0.0116	-0.16	-0.2925	-0.974	1921013	CBDivE_012956	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H17	compound treatment	1.236	-0.0529	-0.71	1.127	-0.102	-1.39	-1.4846	-0.9524	1421586	CBDivE_012957	OC(=O)C1C(C2CC1C=C2)C(=O)S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H18	compound treatment	1.265	-0.0239	-0.32	1.161	-0.0676	-0.92	-0.8802	-0.9008	1921014	CBDivE_012958	Fc1ccc(Nc2nc(NCC=C)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H19	compound treatment	1.266	-0.0229	-0.31	1.122	-0.107	-1.45	-1.2467	-0.8386	1921015	CBDivE_012959	COc1ccc(/C=N/n2c(C)cc(C)c(C(=O)N)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	H20	compound treatment	1.316	0.0271	0.37	1.261	0.0324	0.44	0.5706	0.9956	1297063	CBDivE_012960	CN1CCN(CC1)C(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I01	compound treatment	1.286	-0.0029	-0.04	1.238	0.00936	0.13	0.0626	0.469	1013271	CBDivE_012961	COCc1c(N)c(C)ncc1CN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I02	compound treatment	1.266	-0.0229	-0.31	1.236	0.00736	0.1	-0.1474	-0.4539	1024904	CBDivE_012962	COc1ccc(cc1OC)C2OCC3C(OCC23)c4ccc(OC)c(OC)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I03	compound treatment	1.294	0.0051	0.07	1.216	-0.0126	-0.17	-0.0732	-0.3945	1563447	CBDivE_012963	Nc1ccc2oc(nc2c1)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I04	compound treatment	1.276	-0.0129	-0.17	1.241	0.0124	0.17	-0.0038	-0.0158	1921016	CBDivE_012964	FC(F)(F)C(Oc1nc(NC2CCCCC2)nc(n1)N3CCOCC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I05	compound treatment	1.343	0.0541	0.73	1.278	0.0494	0.67	0.9921	0.9992	1921017	CBDivE_012965	CN1CCC(=CC1)CNc2cccc3CCCCc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I06	compound treatment	1.275	-0.0139	-0.19	1.19	-0.0386	-0.53	-0.5051	-0.9033	1921018	CBDivE_012966	C/C(=N\NC(=O)C1CC1(c2ccccc2)c3ccccc3)/c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I07	compound treatment	1.299	0.0101	0.14	1.225	-0.00364	-0.05	0.0613	0.4227	1921019	CBDivE_012967	NC(=O)NC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I08	compound treatment	1.281	-0.0079	-0.11	1.234	0.00536	0.07	-0.0236	-0.1829	1921020	CBDivE_012968	CC[n+]1cccc(c1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I09	compound treatment	1.289	1.0E-4	0.0	1.216	-0.0126	-0.17	-0.1209	-0.7015	1137240	CBDivE_012969	CCN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I10	compound treatment	1.306	0.0171	0.23	1.244	0.0154	0.21	0.3113	0.9988	1636992	CBDivE_012970	CC(C)(C)Nc1nc(Cl)nc(NCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I11	compound treatment	1.271	-0.0179	-0.24	1.173	-0.0556	-0.76	-0.7072	-0.8883	1921021	CBDivE_012971	CCOC(=O)Nc1ccncc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I12	compound treatment	1.329	0.0401	0.54	1.277	0.0484	0.66	0.8489	0.9952	1921022	CBDivE_012972	COC(=O)c1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I13	compound treatment	1.312	0.0231	0.31	1.261	0.0324	0.44	0.5324	0.9855	1921023	CBDivE_012973	CCOC(=O)Nc1cccnc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I14	compound treatment	1.305	0.0161	0.22	1.246	0.0174	0.24	0.321	0.9991	1921024	CBDivE_012974	FC(F)(F)c1cccc(NC(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I15	compound treatment	1.207	-0.0819	-1.1	1.107	-0.122	-1.66	-1.9541	-0.9805	1178087	CBDivE_012975	CN1C(N(C)c2ccccc12)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I16	compound treatment	1.281	-0.0079	-0.11	1.216	-0.0126	-0.17	-0.1972	-0.9733	1921025	CBDivE_012976	Oc1ccc2cc(ccc2c1/C=N/c3ccc(Cl)c(Cl)c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I17	compound treatment	1.283	-0.0059	-0.08	1.173	-0.0556	-0.76	-0.5927	-0.777	1699574	CBDivE_012977	CN1C(N(C)c2ccccc12)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I18	compound treatment	1.305	0.0161	0.22	1.11	-0.119	-1.62	-0.9904	-0.6067	1921026	CBDivE_012978	FC(F)(F)c1ccc(Br)c(c1)c2ccc(C=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I19	compound treatment	1.279	-0.0099	-0.13	1.15	-0.0786	-1.07	-0.8527	-0.7891	1921027	CBDivE_012979	OC(=O)c1cccc2c(/C=N/NC(=O)c3ccncc3)c[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	I20	compound treatment	1.285	-0.0039	-0.05	1.249	0.0204	0.28	0.1592	0.5631	1921028	CBDivE_012980	COc1ccccc1N2CCN(Cc3ccccc3C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J01	compound treatment	1.279	-0.0099	-0.13	1.222	-0.00664	-0.09	-0.1584	-0.982	1921029	CBDivE_012981	Fc1c(F)c(F)c(CSc2nc3ccccc3[nH]2)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J02	compound treatment	1.28	-0.0089	-0.12	1.18	-0.0486	-0.66	-0.5539	-0.8218	1921030	CBDivE_012982	Fc1ccccc1/C=N/NC(=O)CNc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J03	compound treatment	1.295	0.0061	0.08	1.239	0.0104	0.14	0.1581	0.9669	1921031	CBDivE_012983	CCCC(NCC(C)C)C(=O)Nc1c(C)cc(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J04	compound treatment	1.256	-0.0329	-0.44	1.18	-0.0486	-0.66	-0.7828	-0.9809	1921032	CBDivE_012984	Oc1cc(=O)[nH]c(SCc2c(F)c(F)c(F)c(F)c2F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J05	compound treatment	1.277	-0.0119	-0.16	1.188	-0.0406	-0.55	-0.5053	-0.8759	1112630	CBDivE_012985	[O-][N+](=O)c1cccc(NC(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J06	compound treatment	1.259	-0.0299	-0.4	1.193	-0.0356	-0.49	-0.6288	-0.9957	1453885	CBDivE_012986	Cc1cccc(NC(=O)c2ccccc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J07	compound treatment	1.289	1.0E-4	0.0	1.193	-0.0356	-0.49	-0.3427	-0.7051	1921033	CBDivE_012987	FC(F)(F)c1cccc(NC(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J08	compound treatment	1.302	0.0131	0.18	1.197	-0.0316	-0.43	-0.1801	-0.3863	1921034	CBDivE_012988	Brc1ccc(cc1)N2C(=O)CC(NCCCN3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J09	compound treatment	1.299	0.0101	0.14	1.227	-0.00164	-0.02	0.0806	0.5835	1921035	CBDivE_012989	CCc1ccccc1NC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J10	compound treatment	1.248	-0.0409	-0.55	1.183	-0.0456	-0.62	-0.8302	-0.9982	1921036	CBDivE_012990	Cc1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(n2)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J11	compound treatment	1.319	0.0301	0.41	1.246	0.0174	0.24	0.4546	0.967	1921037	CBDivE_012991	Cc1cc(C)n(n1)C(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J12	compound treatment	1.245	-0.0439	-0.59	1.166	-0.0626	-0.85	-1.0227	-0.984	1921038	CBDivE_012992	FC(F)(F)COc1nc(N/N=C\c2ccc(Br)cc2)nc(n1)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J13	compound treatment	1.249	-0.0399	-0.54	1.186	-0.0426	-0.58	-0.7917	-0.9993	1921039	CBDivE_012993	CCc1ccccc1NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J14	compound treatment	1.216	-0.0729	-0.98	1.136	-0.0926	-1.26	-1.5887	-0.9923	1211600	CBDivE_012994	CCc1ccccc1NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J15	compound treatment	1.314	0.0251	0.34	1.229	3.64E-4	0.0	0.2429	0.7174	1921040	CBDivE_012995	Clc1ccccc1C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J16	compound treatment	1.261	-0.0279	-0.38	1.167	-0.0616	-0.84	-0.8605	-0.9343	1428317	CBDivE_012996	CCN(CC)c1nc(nc(n1)N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J17	compound treatment	1.283	-0.0059	-0.08	1.175	-0.0536	-0.73	-0.5735	-0.7795	1557966	CBDivE_012997	Cc1c(Cl)cccc1NC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J18	compound treatment	1.312	0.0231	0.31	1.215	-0.0136	-0.19	0.0889	0.2449	1409741	CBDivE_012998	CC(=O)Nc1cccc(NC(=O)Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J19	compound treatment	1.268	-0.0209	-0.28	1.223	-0.00564	-0.08	-0.2537	-0.8682	1921041	CBDivE_012999	Fc1ccc(cc1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	J20	compound treatment	1.267	-0.0219	-0.3	1.185	-0.0436	-0.6	-0.6297	-0.9478	1921042	CBDivE_013000	COc1cc(NC(=O)c2ccco2)c(OC)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K01	compound treatment	1.278	-0.0109	-0.15	1.248	0.0194	0.26	0.0827	0.2738	1921043	CBDivE_013001	Oc1ccc(/C=N/c2ccc3oc(nc3c2)c4ccc(F)cc4)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K02	compound treatment	1.284	-0.0049	-0.07	1.274	0.0454	0.62	0.3907	0.628	1280217	CBDivE_013002	CC(C)(C)Nc1nc(Cl)nc(n1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K03	compound treatment	1.287	-0.0019	-0.03	1.214	-0.0146	-0.2	-0.1593	-0.7914	1921044	CBDivE_013003	Oc1c(Br)cc(Br)cc1/C=N/c2ccc3oc(nc3c2)c4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K04	compound treatment	1.278	-0.0109	-0.15	1.212	-0.0166	-0.23	-0.2644	-0.978	1921045	CBDivE_013004	CNc1nc(Nc2ccc(cc2)C(=O)C)nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K05	compound treatment	1.31	0.0211	0.28	1.227	-0.00164	-0.02	0.1855	0.6497	1682996	CBDivE_013005	CN1C2CCC1CC(C2)NCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K06	compound treatment	1.359	0.0701	0.95	1.319	0.0904	1.23	1.54	0.9915	1921046	CBDivE_013006	Fc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K07	compound treatment	1.258	-0.0309	-0.42	1.191	-0.0376	-0.51	-0.6577	-0.9947	1541200	CBDivE_013007	CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c3ccc(C)cc3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K08	compound treatment	1.284	-0.0049	-0.07	1.217	-0.0116	-0.16	-0.1589	-0.9246	1777047	CBDivE_013008	Cc1c(Cl)cccc1NC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K09	compound treatment	1.275	-0.0139	-0.19	1.18	-0.0486	-0.66	-0.6016	-0.8728	1921047	CBDivE_013009	CCCCOCCC/1CCC\C1=N/NC(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K10	compound treatment	1.321	0.0321	0.43	1.278	0.0494	0.67	0.7822	0.9772	1921048	CBDivE_013010	Fc1ccc(cc1)c2nc3cc(/N=C/c4ccc(OC(=O)c5cccc(Br)c5)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K11	compound treatment	1.298	0.0091	0.12	1.201	-0.0276	-0.38	-0.1797	-0.4533	1921049	CBDivE_013011	N(/C=C/C=C/C=N/c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K12	compound treatment	1.288	-9.0E-4	-0.01	1.2	-0.0286	-0.39	-0.2847	-0.7287	1921050	CBDivE_013012	CCc1ccccc1NC(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K13	compound treatment	1.293	0.0041	0.06	1.224	-0.00464	-0.06	-0.0056	-0.0666	1921051	CBDivE_013013	OC(=O)c1ccc2-c3ccc(cc3S(=O)(=O)c2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K14	compound treatment	1.365	0.0761	1.03	1.324	0.0954	1.3	1.6455	0.9932	1342212	CBDivE_013014	CC(C)c1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K15	compound treatment	1.328	0.0391	0.53	1.206	-0.0226	-0.31	0.1547	0.2532	1921052	CBDivE_013015	[O-][N+](=O)c1cccc(/C=C/C=N/NC(=O)c2cncc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K16	compound treatment	1.317	0.0281	0.38	1.266	0.0374	0.51	0.6283	0.9894	1523800	CBDivE_013016	COc1nc(Nc2ccccc2O)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K17	compound treatment	1.335	0.0461	0.62	1.238	0.00936	0.13	0.5301	0.8349	1921053	CBDivE_013017	Clc1ccc(OCC(=O)N/N=C/c2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K18	compound treatment	1.326	0.0371	0.5	1.241	0.0124	0.17	0.4731	0.8958	1921054	CBDivE_013018	CCc1ccccc1NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K19	compound treatment	1.304	0.0151	0.2	1.205	-0.0236	-0.32	-0.0839	-0.2199	1921055	CBDivE_013019	Cn1cc(/C=N/NC(=O)c2ccco2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	K20	compound treatment	1.314	0.0251	0.34	1.237	0.00836	0.11	0.3201	0.8958	1921056	CBDivE_013020	O=C(c1ccco1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L01	compound treatment	1.284	-0.0049	-0.07	1.255	0.0264	0.36	0.2075	0.5676	1335236	CBDivE_013021	Clc1ccc(Cl)c(NC(=O)C(c2ccccc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L02	compound treatment	1.261	-0.0279	-0.38	1.194	-0.0346	-0.47	-0.6001	-0.9937	1777101	CBDivE_013022	CCc1ccccc1NC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L03	compound treatment	1.274	-0.0149	-0.2	1.22	-0.00864	-0.12	-0.2254	-0.9676	1921057	CBDivE_013023	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L04	compound treatment	1.247	-0.0419	-0.57	1.178	-0.0506	-0.69	-0.888	-0.9951	1633957	CBDivE_013024	CC(=O)Nc1ccc(NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L05	compound treatment	1.268	-0.0209	-0.28	1.149	-0.0796	-1.09	-0.9673	-0.8621	1921058	CBDivE_013025	CC(C)c1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L06	compound treatment	1.301	0.0121	0.16	1.216	-0.0126	-0.17	-0.0064	-0.027	1921059	CBDivE_013026	O=C(NC1CCCCC1)N2CCC=CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L07	compound treatment	1.255	-0.0339	-0.46	1.173	-0.0556	-0.76	-0.8598	-0.9706	1350952	CBDivE_013027	CCOc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L08	compound treatment	1.23	-0.0589	-0.79	1.122	-0.107	-1.45	-1.5901	-0.9596	1921060	CBDivE_013028	COc1ccc(cc1)C(=NNc2ccc(cc2)[N+](=O)[O-])c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L09	compound treatment	1.298	0.0091	0.12	1.233	0.00436	0.06	0.1289	0.9447	1921061	CBDivE_013029	Cc1c(Cl)cccc1NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L10	compound treatment	1.258	-0.0309	-0.42	1.178	-0.0506	-0.69	-0.783	-0.9708	1921062	CBDivE_013030	Brc1cccc(c1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L11	compound treatment	1.259	-0.0299	-0.4	1.186	-0.0426	-0.58	-0.6963	-0.984	1921063	CBDivE_013031	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L12	compound treatment	1.305	0.0161	0.22	1.228	-6.36E-4	-0.01	0.1475	0.6783	1921064	CBDivE_013032	Brc1cccc(c1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L13	compound treatment	1.305	0.0161	0.22	1.246	0.0174	0.24	0.321	0.9991	1921065	CBDivE_013033	Cc1cccc(C)c1NC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L14	compound treatment	1.302	0.0131	0.18	1.238	0.00936	0.13	0.2153	0.9873	1328990	CBDivE_013034	COc1ccc(cc1OC)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L15	compound treatment	1.221	-0.0679	-0.92	1.185	-0.0436	-0.6	-1.0685	-0.9782	1586558	CBDivE_013035	CC(=O)Nc1cccc(NC(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L16	compound treatment	1.284	-0.0049	-0.07	1.208	-0.0206	-0.28	-0.2457	-0.8501	1921066	CBDivE_013036	Clc1ccc(C(=O)N2CCCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L17	compound treatment	1.287	-0.0019	-0.03	1.228	-6.36E-4	-0.01	-0.0243	-0.8965	1741860	CBDivE_013037	CN(C)CCCN1c2ccccc2Oc3nnc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L18	compound treatment	1.281	-0.0079	-0.11	1.15	-0.0786	-1.07	-0.8336	-0.7736	1777563	CBDivE_013038	[O-][N+](=O)c1ccc(cc1)C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L19	compound treatment	1.262	-0.0269	-0.36	1.171	-0.0576	-0.79	-0.8124	-0.9384	1045242	CBDivE_013039	Clc1nc(Nc2ccccc2)nc(Nc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	L20	compound treatment	1.297	0.0081	0.11	1.22	-0.00864	-0.12	-0.006	-0.0374	1406615	CBDivE_013040	CCOc1ccc(NC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M01	compound treatment	1.301	0.0121	0.16	1.3	0.0714	0.97	0.8035	0.8143	1921067	CBDivE_013041	[O-][N+](=O)c1cccc(/C=C/C=C/2\Sc3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M02	compound treatment	1.248	-0.0409	-0.55	1.207	-0.0216	-0.3	-0.5988	-0.957	1921068	CBDivE_013042	OC(=O)c1cccc2c(/C=N/NC(=O)c3cccnc3)c[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M03	compound treatment	1.281	-0.0079	-0.11	1.253	0.0244	0.33	0.1596	0.4573	1921069	CBDivE_013043	Oc1c(Br)cc(/C=N/c2ccc(cc2)N3CCOCC3)c(O)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M04	compound treatment	1.284	-0.0049	-0.07	1.251	0.0224	0.3	0.1689	0.5413	1921070	CBDivE_013044	Cn1c(nc2cnccc12)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M05	compound treatment	1.259	-0.0299	-0.4	1.194	-0.0346	-0.47	-0.6192	-0.9969	1921071	CBDivE_013045	Clc1ccc(C(=O)O/N=C/c2ccc(Br)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M06	compound treatment	1.258	-0.0309	-0.42	1.204	-0.0246	-0.34	-0.5323	-0.9943	1921072	CBDivE_013046	Clc1cccc(/C=N/c2ccc(cc2)N3CCOCC3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M07	compound treatment	1.284	-0.0049	-0.07	1.221	-0.00764	-0.1	-0.1204	-0.9759	1101325	CBDivE_013047	OC1CN(C1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M08	compound treatment	1.268	-0.0209	-0.28	1.254	0.0254	0.35	0.0452	0.1013	1921073	CBDivE_013048	Oc1cc(=O)[nH]c(SCC(=O)C2(CC3CC4CC(C3)C2)C4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M09	compound treatment	1.276	-0.0129	-0.17	1.199	-0.0296	-0.4	-0.4088	-0.9291	1122317	CBDivE_013049	COc1cc(OC)c(cc1Br)C(C2C(=O)CC(C)(C)CC2=O)C3=C(O)CC(C)(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M10	compound treatment	1.294	0.0051	0.07	1.281	0.0524	0.71	0.5536	0.7717	1250591	CBDivE_013050	CCOc1cc(Br)cc(C=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M11	compound treatment	1.297	0.0081	0.11	1.233	0.00436	0.06	0.1193	0.9592	1921074	CBDivE_013051	Nc1cccc(c1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M12	compound treatment	1.286	-0.0029	-0.04	1.252	0.0234	0.32	0.1976	0.6157	1921075	CBDivE_013052	CCN(CC(O)COc1ccccc1C(=O)C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M13	compound treatment	1.285	-0.0039	-0.05	1.192	-0.0366	-0.5	-0.3905	-0.7773	1921076	CBDivE_013053	Nc1ccc(O)c(c1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M14	compound treatment	1.312	0.0231	0.31	1.259	0.0304	0.41	0.5131	0.9902	1921077	CBDivE_013054	CCCCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N2CCNCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M15	compound treatment	1.276	-0.0129	-0.17	1.199	-0.0296	-0.4	-0.4088	-0.9291	1542585	CBDivE_013055	Cc1ccc2nc(oc2c1)c3ccc(N)cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M16	compound treatment	1.285	-0.0039	-0.05	1.247	0.0184	0.25	0.1399	0.5466	1709602	CBDivE_013056	CC(C)(C)c1ccc(cc1)c2nc3cc(N)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M17	compound treatment	1.306	0.0171	0.23	1.234	0.00536	0.07	0.2148	0.8877	1921078	CBDivE_013057	Brc1cncc(c1)C(=O)N/N=C\C=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M18	compound treatment	1.289	1.0E-4	0.0	1.215	-0.0136	-0.19	-0.1305	-0.7019	1367145	CBDivE_013058	CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c3ccc(Cl)cc3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M19	compound treatment	1.275	-0.0139	-0.19	1.175	-0.0536	-0.73	-0.6498	-0.8606	1921079	CBDivE_013059	Nc1ccc2oc(nc2c1)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	M20	compound treatment	1.315	0.0261	0.35	1.306	0.0774	1.05	0.995	0.8946	1921080	CBDivE_013060	CCOc1cc(Br)cc(/C=N/c2ccc(F)c(Cl)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N01	compound treatment	1.268	-0.0209	-0.28	1.236	0.00736	0.1	-0.1284	-0.4289	1921081	CBDivE_013061	[O-][N+](=O)c1ccc(cc1)C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N02	compound treatment	1.26	-0.0289	-0.39	1.19	-0.0386	-0.53	-0.6482	-0.989	1921082	CBDivE_013062	Cc1cc(C)n(n1)C(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N03	compound treatment	1.231	-0.0579	-0.78	1.172	-0.0566	-0.77	-1.0984	-1.0	1921083	CBDivE_013063	Cc1c(Cl)cccc1NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N04	compound treatment	1.234	-0.0549	-0.74	1.177	-0.0516	-0.7	-1.0216	-0.9997	1777562	CBDivE_013064	CCc1ccccc1NC(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N05	compound treatment	1.258	-0.0309	-0.42	1.199	-0.0296	-0.4	-0.5805	-0.9999	1101850	CBDivE_013065	Fc1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N06	compound treatment	1.223	-0.0659	-0.89	1.125	-0.104	-1.41	-1.6279	-0.975	1303749	CBDivE_013066	CC(C)c1ccc(NC(=O)C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N07	compound treatment	1.261	-0.0279	-0.38	1.182	-0.0466	-0.64	-0.7158	-0.9687	1512104	CBDivE_013067	CCc1ccccc1NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N08	compound treatment	1.199	-0.0899	-1.21	1.144	-0.0846	-1.15	-1.6737	-0.9997	1348265	CBDivE_013068	COc1ccc(cc1OC)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N09	compound treatment	1.22	-0.0689	-0.93	1.177	-0.0516	-0.7	-1.1552	-0.9906	1630395	CBDivE_013069	COc1ccccc1NC(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N10	compound treatment	1.258	-0.0309	-0.42	1.186	-0.0426	-0.58	-0.7059	-0.9867	1505597	CBDivE_013070	CCOc1ccc(NC(=O)C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N11	compound treatment	1.237	-0.0519	-0.7	1.169	-0.0596	-0.81	-1.0701	-0.9972	1921084	CBDivE_013071	Cc1cccc(C)c1NC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N12	compound treatment	1.26	-0.0289	-0.39	1.196	-0.0326	-0.45	-0.5904	-0.9978	1369345	CBDivE_013072	CCOc1ccc(NC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N13	compound treatment	1.271	-0.0179	-0.24	1.214	-0.0146	-0.2	-0.3119	-0.9955	1921085	CBDivE_013073	C/C(=N/CCCN1CCOCC1)/c2c(C)[nH]n(c3c(F)c(F)c(F)c(F)c3F)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N14	compound treatment	1.243	-0.0459	-0.62	1.179	-0.0496	-0.68	-0.9165	-0.999	1921086	CBDivE_013074	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N15	compound treatment	1.235	-0.0539	-0.73	1.168	-0.0606	-0.83	-1.0988	-0.9979	1921087	CBDivE_013075	CC(C)C/N=C(/C)\c1c(C)[nH]n(c2c(F)c(F)c(F)c(F)c2F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N16	compound treatment	1.297	0.0081	0.11	1.17	-0.0586	-0.8	-0.4881	-0.6048	1777566	CBDivE_013076	CCOc1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N17	compound treatment	1.239	-0.0499	-0.67	1.162	-0.0666	-0.91	-1.1185	-0.9891	1921088	CBDivE_013077	Clc1ccc(NC(=O)Nc2cccc(NC(=O)Nc3ccc(Cl)cc3Cl)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N18	compound treatment	1.287	-0.0019	-0.03	1.181	-0.0476	-0.65	-0.4775	-0.7344	1921089	CBDivE_013078	CC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N19	compound treatment	1.286	-0.0029	-0.04	1.24	0.0114	0.15	0.0819	0.5125	1921090	CBDivE_013079	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	N20	compound treatment	1.271	-0.0179	-0.24	1.21	-0.0186	-0.25	-0.3505	-0.9997	1921091	CBDivE_013080	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O01	compound treatment	1.292	0.0031	0.04	1.264	0.0354	0.48	0.3706	0.7656	1305951	CBDivE_013081	CN1C(N(C)c2ccccc12)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O02	compound treatment	1.339	0.0501	0.68	1.323	0.0944	1.29	1.3878	0.9548	1317513	CBDivE_013082	CC(O)(C#C)C1C=C2C(C)(C)CCCC2(C)n3n1c(=O)c4ccccc4c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O03	compound treatment	1.343	0.0541	0.73	1.322	0.0934	1.27	1.4163	0.9651	1921092	CBDivE_013083	Cc1nc2nc([nH]c2cc1Br)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O04	compound treatment	1.316	0.0271	0.37	1.324	0.0954	1.3	1.1781	0.8721	1921093	CBDivE_013084	CCC(C)Nc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O05	compound treatment	1.326	0.0371	0.5	1.291	0.0624	0.85	0.9552	0.9681	1921094	CBDivE_013085	CCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O06	compound treatment	1.269	-0.0199	-0.27	1.208	-0.0206	-0.28	-0.3888	-0.9997	1921095	CBDivE_013086	Clc1ccc(/C=N/c2ccc3oc(nc3c2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O07	compound treatment	1.279	-0.0099	-0.13	1.221	-0.00764	-0.1	-0.1681	-0.9924	1921096	CBDivE_013087	O=C1NC(=O)C2(COC(OC2)c3ccccc3)S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O08	compound treatment	1.284	-0.0049	-0.07	1.237	0.00836	0.11	0.0339	0.2572	1661092	CBDivE_013088	COc1cc(C)c(CCC(C)(O)C#C)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O09	compound treatment	1.367	0.0781	1.05	1.271	0.0424	0.58	1.1535	0.96	1921097	CBDivE_013089	CC(C)Nc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O10	compound treatment	1.348	0.0591	0.8	1.295	0.0664	0.9	1.2037	0.998	1921098	CBDivE_013090	Clc1ccccc1C(=O)Nc2cccc3C(=O)c4ccccc4C(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O11	compound treatment	1.307	0.0181	0.24	1.218	-0.0106	-0.15	0.0701	0.2468	1921099	CBDivE_013091	FC(F)(F)COc1nc(nc(n1)N2CCOCC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O12	compound treatment	1.359	0.0701	0.95	1.283	0.0544	0.74	1.1929	0.9927	1921100	CBDivE_013092	FC(F)(F)c1cccc(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O13	compound treatment	1.29	0.0011	0.01	1.243	0.0144	0.2	0.149	0.7585	1921101	CBDivE_013093	[O-][N+](=O)c1cccc(Nc2nc(NCC=C)nc(OC(C(F)(F)F)C(F)(F)F)n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O14	compound treatment	1.314	0.0251	0.34	1.297	0.0684	0.93	0.8986	0.906	1921102	CBDivE_013094	Cc1cccc(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O15	compound treatment	1.298	0.0091	0.12	1.27	0.0414	0.56	0.4857	0.8413	1392282	CBDivE_013095	O=S(=O)(NC1CCCCC1)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O16	compound treatment	1.308	0.0191	0.26	1.262	0.0334	0.45	0.5039	0.9638	1921103	CBDivE_013096	Clc1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O17	compound treatment	1.316	0.0271	0.37	1.238	0.00936	0.13	0.3488	0.9007	1921104	CBDivE_013097	Oc1ccc(/N=C/c2ccc(cc2)C(=O)Oc3cc(Cl)ccc3Cl)cc1c4nc5ccccc5s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O18	compound treatment	1.3	0.0111	0.15	1.241	0.0124	0.17	0.2251	0.9983	1921105	CBDivE_013098	Fc1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O19	compound treatment	1.302	0.0131	0.18	1.254	0.0254	0.35	0.3695	0.9514	1921106	CBDivE_013099	FC(F)(F)C(=O)Nc1ccc(cc1)C(=O)c2ccc(NC(=O)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	O20	compound treatment	1.376	0.0871	1.18	1.345	0.116	1.59	1.9529	0.9891	1921107	CBDivE_013100	Clc1cccc(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P01	compound treatment	1.287	-0.0019	-0.03	1.24	0.0114	0.15	0.0915	0.5823	1230459	CBDivE_013101	Clc1ccc(Cl)c(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P02	compound treatment	1.263	-0.0259	-0.35	1.193	-0.0356	-0.49	-0.5907	-0.9869	1245577	CBDivE_013102	CCOc1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P03	compound treatment	1.293	0.0041	0.06	1.222	-0.00664	-0.09	-0.0249	-0.2345	1921108	CBDivE_013103	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P04	compound treatment	1.21	-0.0789	-1.06	1.139	-0.0896	-1.22	-1.617	-0.9976	1921109	CBDivE_013104	Fc1cccc(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P05	compound treatment	1.328	0.0391	0.53	1.28	0.0514	0.7	0.8683	0.9902	1921110	CBDivE_013105	Nc1ccccc1/N=C/c2ccc(o2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P06	compound treatment	1.294	0.0051	0.07	1.202	-0.0266	-0.36	-0.2082	-0.5631	1921111	CBDivE_013106	Cc1cc(C)n(n1)C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P07	compound treatment	1.252	-0.0369	-0.5	1.185	-0.0436	-0.6	-0.7728	-0.9961	1112987	CBDivE_013107	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P08	compound treatment	1.188	-0.101	-1.36	1.108	-0.121	-1.65	-2.1257	-0.9956	1921112	CBDivE_013108	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P09	compound treatment	1.231	-0.0579	-0.78	1.172	-0.0566	-0.77	-1.0984	-1.0	1703103	CBDivE_013109	Brc1ccc(cc1)C(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P10	compound treatment	0.775	-0.514	-6.93	0.72	-0.509	-6.94	-9.8067	-1.0	1549605	CBDivE_013110	COc1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P11	compound treatment	1.236	-0.0529	-0.71	1.162	-0.0666	-0.91	-1.1472	-0.9929	1921113	CBDivE_013111	Clc1c(sc2ccccc12)C(=O)NNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P12	compound treatment	1.273	-0.0159	-0.21	1.185	-0.0436	-0.6	-0.5724	-0.905	1921114	CBDivE_013112	OC(=O)c1cc(Cc2ccc(/N=C/c3ccc(C#Cc4ccccc4)cc3)c(c2)C(=O)O)ccc1/N=C/c5ccc(C#Cc6ccccc6)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P13	compound treatment	1.188	-0.101	-1.36	1.115	-0.114	-1.55	-2.0582	-0.9979	1921115	CBDivE_013113	Clc1c(sc2ccccc12)c3nnc(o3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P14	compound treatment	1.3	0.0111	0.15	1.183	-0.0456	-0.62	-0.3342	-0.5221	1921116	CBDivE_013114	CC1(C)CC(=O)C/C(=N/NC(=S)N)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P15	compound treatment	1.21	-0.0789	-1.06	1.153	-0.0756	-1.03	-1.482	-0.9999	1921117	CBDivE_013115	O=C(Nc1cccc2C(=O)c3ccccc3C(=O)c12)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P16	compound treatment	1.283	-0.0059	-0.08	1.182	-0.0466	-0.64	-0.506	-0.7894	1921118	CBDivE_013116	CC(C)(C)Nc1nc(Cl)nc(Nc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P17	compound treatment	1.289	1.0E-4	0.0	1.231	0.00236	0.03	0.0237	0.7361	1579728	CBDivE_013117	Clc1ccc(C(=O)n2cnc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P18	compound treatment	1.261	-0.0279	-0.38	1.241	0.0124	0.17	-0.1469	-0.3563	1921119	CBDivE_013118	CCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P19	compound treatment	1.271	-0.0179	-0.24	1.185	-0.0436	-0.6	-0.5915	-0.9211	1921120	CBDivE_013119	O=C(Cc1ccccc1)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.41	P20	compound treatment	1.322	0.0331	0.45	1.248	0.0194	0.26	0.5025	0.9686	1777567	CBDivE_013120	[O-][N+](=O)c1cccc(c1)C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A01	compound treatment	1.277	0.00164	0.02	1.264	0.0298	0.41	0.303	0.7444	1690589	CBDivE_013121	OC(=O)c1ccc(NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A02	compound treatment	1.239	-0.0364	-0.49	1.238	0.00381	0.05	-0.3102	-0.6287	1921121	CBDivE_013122	CC/C(=C\c1sc2ccc(OC)cc2[n+]1CCCS(=O)(=O)O)/C=C/3\Sc4ccccc4N3CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A03	compound treatment	1.304	0.0286	0.39	1.267	0.0328	0.45	0.5895	0.9973	1124031	CBDivE_013123	CCOc1ccc(NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A04	compound treatment	1.271	-0.00436	-0.06	1.263	0.0288	0.39	0.2362	0.5945	1921122	CBDivE_013124	Cc1ccc(/N=C/c2ccc(OC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A05	compound treatment	1.266	-0.00936	-0.13	1.251	0.0168	0.23	0.0728	0.278	1495338	CBDivE_013125	Ic1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A06	compound treatment	1.278	0.00264	0.04	1.287	0.0528	0.72	0.5344	0.7411	1921123	CBDivE_013126	CC(=S)/C=C/1\Sc2ccc3ccccc3c2N1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A07	compound treatment	1.247	-0.0284	-0.38	1.244	0.00981	0.13	-0.176	-0.4342	1377574	CBDivE_013127	Cc1ccc(CCNc2ccccc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A08	compound treatment	1.261	-0.0144	-0.19	1.235	8.09E-4	0.01	-0.1292	-0.6658	1921124	CBDivE_013128	CC(C)OP(=O)(Nc1ccc(C)cn1)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A09	compound treatment	1.237	-0.0384	-0.52	1.194	-0.0402	-0.55	-0.7535	-0.9996	1921125	CBDivE_013129	OCCN1CCN(CC#CCC(O)(c2ccccc2)c3ccccc3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A10	compound treatment	1.226	-0.0494	-0.67	1.211	-0.0232	-0.32	-0.6945	-0.9421	1921126	CBDivE_013130	FC(F)(F)COc1nc(OCC(F)(F)F)nc(OCC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A11	compound treatment	1.257	-0.0184	-0.25	1.229	-0.00519	-0.07	-0.2252	-0.8742	1921127	CBDivE_013131	C/C(=N\NC(=O)COc1c(C)cc(cc1C)[N+](=O)[O-])/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A12	compound treatment	1.267	-0.00836	-0.11	1.259	0.0248	0.34	0.1594	0.4471	1921128	CBDivE_013132	Cn1cnc([N+](=O)[O-])c1Sc2ncnc3nc[nH]c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A13	compound treatment	1.313	0.0376	0.51	1.283	0.0488	0.67	0.8297	0.9911	1921129	CBDivE_013133	OC(C#CCN(CC=C)CC=C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A14	compound treatment	1.292	0.0166	0.22	1.258	0.0238	0.32	0.3883	0.9837	2255	CBDivE_013134	CCCOC(=O)c1cc(O)c(O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A15	compound treatment	1.273	-0.00236	-0.03	1.231	-0.00319	-0.04	-0.0533	-0.9883	1921130	CBDivE_013135	C/C(=N\NC(=O)COc1ccc(I)cc1)/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A16	compound treatment	1.281	0.00564	0.08	1.297	0.0628	0.86	0.6594	0.7669	1921131	CBDivE_013136	Cc1ccc(OCCOC(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A17	compound treatment	1.242	-0.0334	-0.45	1.207	-0.0272	-0.37	-0.5805	-0.9954	1921132	CBDivE_013137	CCN(CC)CCC#CC(OC)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A18	compound treatment	1.289	0.0136	0.18	1.289	0.0548	0.75	0.6586	0.8556	1921133	CBDivE_013138	FC(F)(F)C(F)(F)C(=O)Nc1ccccc1c2ccccc2NC(=O)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A19	compound treatment	1.221	-0.0544	-0.73	1.195	-0.0392	-0.53	-0.8965	-0.9879	1921134	CBDivE_013139	CC(C)N(CC#CCC1(O)c2ccccc2-c3ccccc31)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	A20	compound treatment	1.271	-0.00436	-0.06	1.271	0.0368	0.5	0.3133	0.6199	1585165	CBDivE_013140	Oc1ccccc1C(N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B01	compound treatment	1.275	-3.64E-4	0.0	1.239	0.00481	0.07	0.0429	0.6524	1553302	CBDivE_013141	COc1cc2CCNC(c3ccncc3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B02	compound treatment	1.279	0.00364	0.05	1.279	0.0448	0.61	0.4668	0.7614	1382399	CBDivE_013142	C(Cc1ccccc1)NC2CCCc3c2[nH]c4ccc(cc34)C5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B03	compound treatment	1.245	-0.0304	-0.41	1.24	0.00581	0.08	-0.2336	-0.56	1921135	CBDivE_013143	Cc1ccc(C)c(c1)S(=O)(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B04	compound treatment	1.302	0.0266	0.36	1.252	0.0178	0.24	0.4258	0.9818	1674975	CBDivE_013144	Clc1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B05	compound treatment	1.298	0.0226	0.31	1.293	0.0588	0.8	0.783	0.9125	1004794	CBDivE_013145	OC(=O)c1ccccc1NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B06	compound treatment	1.298	0.0226	0.31	1.281	0.0468	0.64	0.6673	0.943	1336765	CBDivE_013146	Clc1ccc(cc1)N2CCN(Cc3ccc(Cl)cc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B07	compound treatment	1.296	0.0206	0.28	1.313	0.0788	1.07	0.9568	0.8618	1001846	CBDivE_013147	CCNc1cc2oc3cc(=NCC)c(C)cc3c(c4ccccc4C(=O)OCC)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B08	compound treatment	1.27	-0.00536	-0.07	1.239	0.00481	0.07	-0.0048	-0.0491	1921136	CBDivE_013148	Cn1c2ccc(cc2c3c(=O)[nH]ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B09	compound treatment	1.259	-0.0164	-0.22	1.219	-0.0152	-0.21	-0.3026	-0.9995	1921137	CBDivE_013149	ON(N=Nc1ccc(cc1)S(=O)(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B10	compound treatment	1.299	0.0236	0.32	1.317	0.0828	1.13	1.024	0.8727	1713040	CBDivE_013150	Brc1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B11	compound treatment	1.272	-0.00336	-0.05	1.255	0.0208	0.28	0.1686	0.5866	1921138	CBDivE_013151	C=C(OC(=O)c1ccccc1)C(COC(=O)c2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B12	compound treatment	1.261	-0.0144	-0.19	1.222	-0.0122	-0.17	-0.2546	-0.9971	1921139	CBDivE_013152	FC(F)(F)c1ccccc1CN2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B13	compound treatment	1.227	-0.0484	-0.65	1.239	0.00481	0.07	-0.415	-0.6329	1007311	CBDivE_013153	OC(C(O)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B14	compound treatment	1.296	0.0206	0.28	1.28	0.0458	0.62	0.6386	0.9337	1921140	CBDivE_013154	CN1CCN(Cc2c(NC(=O)C(Cl)(Cl)Cl)oc3ccccc3c2=O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B15	compound treatment	1.272	-0.00336	-0.05	1.248	0.0138	0.19	0.1011	0.5218	1921141	CBDivE_013155	CCN1/C(=C/C=C/C=C/c2sc3ccccc3[n+]2CC(=O)O)/Sc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B16	compound treatment	1.263	-0.0124	-0.17	1.241	0.00681	0.09	-0.0523	-0.2739	1921142	CBDivE_013156	Oc1ccc(N/C=C\2/C(=O)CNC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B17	compound treatment	1.29	0.0146	0.2	1.255	0.0208	0.28	0.3403	0.9843	1921143	CBDivE_013157	CCOC(=O)c1ccc2n(CC)c(C)[n+](CCCS(=O)(=O)N)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B18	compound treatment	1.294	0.0186	0.25	1.236	0.00181	0.02	0.1952	0.7728	1921144	CBDivE_013158	C[N+](C)(C)CCOC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B19	compound treatment	1.261	-0.0144	-0.19	1.241	0.00681	0.09	-0.0714	-0.3321	1024120	CBDivE_013159	CCCCOC(=O)c1cc(O)c(O)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	B20	compound treatment	1.296	0.0206	0.28	1.244	0.00981	0.13	0.2914	0.9436	1921145	CBDivE_013160	Cc1c(N2C(=O)/C(=C/c3cc(ccc3O)[N+](=O)[O-])/SC2=S)c(=O)n(c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C01	compound treatment	1.25	-0.0254	-0.34	1.192	-0.0422	-0.58	-0.6488	-0.9692	1921146	CBDivE_013161	CC(CC(=O)N[C@@H](C)c1ccccc1)C(=O)N[C@@H](C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C02	compound treatment	1.277	0.00164	0.02	1.288	0.0538	0.73	0.5345	0.7281	1119698	CBDivE_013162	Cc1ccc(O)c(CCc2ccc(N)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C03	compound treatment	1.273	-0.00236	-0.03	1.235	8.09E-4	0.01	-0.0147	-0.4371	1921147	CBDivE_013163	O=C(N1CCCCC1)c2ccc(c3ccccc3)c(c2)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C04	compound treatment	1.265	-0.0104	-0.14	1.249	0.0148	0.2	0.0439	0.1789	1921148	CBDivE_013164	OC(=O)c1cc(/N=C/c2cccc(CC=C)c2O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C05	compound treatment	1.258	-0.0174	-0.23	1.213	-0.0212	-0.29	-0.37	-0.9946	1466607	CBDivE_013165	Cc1ccc2n(C)c3CC[N+](C)(C)Cc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C06	compound treatment	1.213	-0.0624	-0.84	1.239	0.00481	0.07	-0.5485	-0.65	1921149	CBDivE_013166	Oc1cc(cc2cc(c(N=Nc3cc(cc4cc(cc(O)c34)S(=O)(=O)O)S(=O)(=O)O)c(O)c12)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C07	compound treatment	1.288	0.0126	0.17	1.228	-0.00619	-0.08	0.0608	0.3198	1921150	CBDivE_013167	ClC1=CC(=O)C2=C(Cl)C=C3C4C2C1=CC(=C4C(=O)C=C3Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C08	compound treatment	1.277	0.00164	0.02	1.275	0.0408	0.56	0.4091	0.7346	1921151	CBDivE_013168	OC(=O)c1cc(/N=C/c2ccccc2I)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C09	compound treatment	1.257	-0.0184	-0.25	1.218	-0.0162	-0.22	-0.3313	-0.9984	1921152	CBDivE_013169	CC(C)N(CC#CC(C)(C)O)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C10	compound treatment	1.291	0.0156	0.21	1.29	0.0558	0.76	0.6873	0.8703	1921153	CBDivE_013170	O/N=C(/C(O)c1ccccc1)\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C11	compound treatment	1.296	0.0206	0.28	1.27	0.0358	0.49	0.5421	0.9645	1921154	CBDivE_013171	Cc1ccc2nc(sc2c1)c3ccc(/N=C/c4cccc(Cl)c4Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C12	compound treatment	1.313	0.0376	0.51	1.303	0.0688	0.94	1.0225	0.9584	3021270	CBDivE_013172	CCN1/C(=C/c2sc3ccccc3[n+]2CC)/Sc4ccccc14.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C13	compound treatment	1.266	-0.00936	-0.13	1.199	-0.0352	-0.48	-0.4287	-0.8638	1921156	CBDivE_013173	FC(F)(F)c1cccc(c1)c2ccc(/C=N/NC(=O)c3cncc(Br)c3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C14	compound treatment	1.298	0.0226	0.31	1.3	0.0658	0.9	0.8505	0.8972	1921157	CBDivE_013174	Cc1c(N)cc(cc1[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C15	compound treatment	1.333	0.0576	0.78	1.284	0.0498	0.68	1.0301	0.9977	1921158	CBDivE_013175	OS(=O)(=O)c1cc(NS(=O)(=O)c2ccccc2)ccc1/C=C/c3ccc(NS(=O)(=O)c4ccccc4)cc3S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C16	compound treatment	1.308	0.0326	0.44	1.262	0.0278	0.38	0.5795	0.9972	1003514	CBDivE_013176	COc1cc(cc(OC)c1OC)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C17	compound treatment	1.266	-0.00936	-0.13	1.212	-0.0222	-0.3	-0.3033	-0.9249	1921159	CBDivE_013177	Cc1[nH]n(c2c(F)c(F)c(F)c(F)c2F)c(=O)c1/C=N/Cc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C18	compound treatment	1.3	0.0246	0.33	1.278	0.0438	0.6	0.6574	0.9617	1921160	CBDivE_013178	[O-][N+](=O)c1ccc(N/N=C/c2ccccc2F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C19	compound treatment	1.256	-0.0194	-0.26	1.17	-0.0642	-0.88	-0.8037	-0.8798	1083173	CBDivE_013179	CC[N+](CC)(CC)CC(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	C20	compound treatment	1.253	-0.0224	-0.3	1.237	0.00281	0.04	-0.1863	-0.6124	1921161	CBDivE_013180	CCOC(=O)C1=C(C)C2C3C(C(=O)N(C3=O)c4ccccc4OC)C1(C)C5C2C(=O)N(C5=O)c6ccccc6OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D01	compound treatment	1.254	-0.0214	-0.29	1.228	-0.00619	-0.08	-0.2635	-0.8774	1161378	CBDivE_013181	Fc1ccc(cc1F)C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D02	compound treatment	1.252	-0.0234	-0.32	1.195	-0.0392	-0.53	-0.6008	-0.9683	1921162	CBDivE_013182	CN1C(=O)/C(=C/2\SC(=S)N(C(CCC(=O)O)C(=O)O)C2=O)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D03	compound treatment	1.241	-0.0344	-0.46	1.212	-0.0222	-0.3	-0.5418	-0.9786	1921163	CBDivE_013183	CCN/1C(=O)/C(=C/C=C\2/Sc3ccc(OC)cc3N2CC)/S\C1=N/c4ccc(/C=C/c5ccccc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D04	compound treatment	1.24	-0.0354	-0.48	1.221	-0.0132	-0.18	-0.4645	-0.9111	1921164	CBDivE_013184	CC(=O)N1C(=O)/C(=C/2\SC(=S)N(C2=O)c3c(C)n(C)n(c4ccccc4)c3=O)/c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D05	compound treatment	1.255	-0.0204	-0.27	1.224	-0.0102	-0.14	-0.2925	-0.9502	1921165	CBDivE_013185	NNC(=O)c1cc[n+](Cc2ccc3nsnc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D06	compound treatment	1.267	-0.00836	-0.11	1.243	0.00881	0.12	0.0052	0.0313	1921166	CBDivE_013186	CC(C)C(N)C(=O)Oc1ccc2c(=O)c(Oc3ccccc3)coc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D07	compound treatment	1.256	-0.0194	-0.26	1.254	0.0198	0.27	0.0063	0.0167	1921167	CBDivE_013187	O=C(CCCN1C(=O)c2ccccc2C1=O)N3CCOCCOCCOCCOCCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D08	compound treatment	1.233	-0.0424	-0.57	1.209	-0.0252	-0.34	-0.647	-0.9703	1921168	CBDivE_013188	CC1(CC/2(O)C(=[N+]1[O-])CCC\C2=N/O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D09	compound treatment	1.272	-0.00336	-0.05	1.239	0.00481	0.07	0.0143	0.1791	1921169	CBDivE_013189	O=C(CN1C(=O)c2ccccc2C1=O)N3CCOCCOCCOCCOCCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D10	compound treatment	1.27	-0.00536	-0.07	1.226	-0.00819	-0.11	-0.1301	-0.9779	1921170	CBDivE_013190	CC1=CC=CN2CC(O)CN=C21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D11	compound treatment	1.263	-0.0124	-0.17	1.216	-0.0182	-0.25	-0.2933	-0.9813	1921171	CBDivE_013191	CCOC(CCl)/S(=N\S(=O)(=O)c1ccccc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D12	compound treatment	1.265	-0.0104	-0.14	1.247	0.0128	0.17	0.0246	0.1102	1921172	CBDivE_013192	CC(C)N(C(C)C)C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D13	compound treatment	1.304	0.0286	0.39	1.276	0.0418	0.57	0.6763	0.982	1921173	CBDivE_013193	CCCCCC(=O)NC(NC(=S)Nc1ccc(cc1)S(=O)(=O)N)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D14	compound treatment	1.307	0.0316	0.43	1.259	0.0248	0.34	0.541	0.9934	1921174	CBDivE_013194	COc1ccc(CCN(C)CCC(=O)NCCc2ccccc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D15	compound treatment	1.244	-0.0314	-0.42	1.188	-0.0462	-0.63	-0.7446	-0.9813	1921175	CBDivE_013195	Clc1ccc(C(=O)NC(Sc2ccccn2)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D16	compound treatment	1.287	0.0116	0.16	1.215	-0.0192	-0.26	-0.074	-0.2426	1921176	CBDivE_013196	O=c1[nH]nc2ccc(nn12)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D17	compound treatment	1.274	-0.00136	-0.02	1.213	-0.0212	-0.29	-0.2173	-0.7506	1921177	CBDivE_013197	CC(C)C(=O)NC(NC(=S)Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D18	compound treatment	1.297	0.0216	0.29	1.217	-0.0172	-0.23	0.0406	0.1085	1921178	CBDivE_013198	COC1=CC(=C(CC1)NC(=O)COc2ccc(OC)cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D19	compound treatment	1.288	0.0126	0.17	1.24	0.00581	0.08	0.1766	0.9392	1921179	CBDivE_013199	COc1ccc(NC(=S)NC(NC(=O)CF)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	D20	compound treatment	1.28	0.00464	0.06	1.213	-0.0212	-0.29	-0.1601	-0.5415	1921180	CBDivE_013200	O=C(NN=C1C(=O)NC(=O)NC1=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E01	compound treatment	1.25	-0.0254	-0.34	1.193	-0.0412	-0.56	-0.6391	-0.9717	3107719	CBDivE_013201	COc1ccc2n(Cc3ccccc3)cc(CCN)c2c1.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E02	compound treatment	1.337	0.0616	0.83	1.335	0.101	1.37	1.56	0.971	1921182	CBDivE_013202	O=C1C2C(C(=O)N1c3cccc4ccccc34)C5(C(C(c6ccccc6)C2(C5=O)c7ccccc7)c8ccccc8)c9ccccc9
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E03	compound treatment	1.262	-0.0134	-0.18	1.236	0.00181	0.02	-0.11	-0.6047	1921183	CBDivE_013203	COc1ccc(cc1OC)C(=O)NCC(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E04	compound treatment	1.266	-0.00936	-0.13	1.266	0.0318	0.43	0.2174	0.4812	1921184	CBDivE_013204	CN(C)c1nc(CCl)nc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E05	compound treatment	1.212	-0.0634	-0.85	1.192	-0.0422	-0.58	-1.0113	-0.9814	1921185	CBDivE_013205	COc1nc(Nc2ccc(C#Cc3ccc(Nc4nc(OC)nc(OC)n4)cc3S(=O)(=O)O)c(c2)S(=O)(=O)O)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E06	compound treatment	1.271	-0.00436	-0.06	1.221	-0.0132	-0.18	-0.1688	-0.892	1560261	CBDivE_013206	COc1ccc(cc1)C2NCCc3cc(OC)c(OC)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E07	compound treatment	1.266	-0.00936	-0.13	1.235	8.09E-4	0.01	-0.0815	-0.6429	1921186	CBDivE_013207	Clc1cccc(Cl)c1/C=N/NC(=O)COc2ccc(Br)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E08	compound treatment	1.277	0.00164	0.02	1.308	0.0738	1.01	0.7273	0.7224	1141069	CBDivE_013208	CN(C)c1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E09	compound treatment	1.281	0.00564	0.08	1.233	-0.00119	-0.02	0.0423	0.5438	1921187	CBDivE_013209	CC(=O)C[n+]1cccc2cccc(O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E10	compound treatment	1.3	0.0246	0.33	1.29	0.0558	0.76	0.7731	0.931	1180198	CBDivE_013210	Fc1ccc(CN2CCN(CC2)c3ccccc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E11	compound treatment	1.285	0.00964	0.13	1.22	-0.0142	-0.19	-0.0449	-0.1927	1921188	CBDivE_013211	OS(=O)(=O)c1cc(NC(=O)c2ccccc2)ccc1/C=C/c3ccc(NC(=O)c4ccccc4)cc3S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E12	compound treatment	1.303	0.0276	0.37	1.298	0.0638	0.87	0.8789	0.9284	1921189	CBDivE_013212	Clc1cccc(NC(=O)NCCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E13	compound treatment	1.257	-0.0184	-0.25	1.163	-0.0712	-0.97	-0.8616	-0.86	1069773	CBDivE_013213	Cc1ccc(cc1)S(=O)(=O)N2CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E14	compound treatment	1.289	0.0136	0.18	1.275	0.0408	0.56	0.5236	0.8933	1921190	CBDivE_013214	Nc1nnc(CCS(=O)(=O)c2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E15	compound treatment	1.28	0.00464	0.06	1.21	-0.0242	-0.33	-0.189	-0.563	1921191	CBDivE_013215	COc1cccc(c1)C(=O)Nc2ccc(/C=C/c3ccc(NC(=O)c4cccc(OC)c4)cc3S(=O)(=O)O)c(c2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E16	compound treatment	1.282	0.00664	0.09	1.273	0.0388	0.53	0.4375	0.8151	1921192	CBDivE_013216	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E17	compound treatment	1.283	0.00764	0.1	1.209	-0.0252	-0.34	-0.1701	-0.4742	1352983	CBDivE_013217	CCOC(=O)N(c1ccccc1)P2(=S)OCC(C)(C)CO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E18	compound treatment	1.311	0.0356	0.48	1.272	0.0378	0.52	0.7045	0.9994	1921193	CBDivE_013218	COc1cc(Br)cc(/C=C/2\Sc3ccccc3C2=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E19	compound treatment	1.255	-0.0204	-0.27	1.213	-0.0212	-0.29	-0.3986	-0.9997	1921194	CBDivE_013219	CCCCCOc1ccc(C=C2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	E20	compound treatment	1.307	0.0316	0.43	1.31	0.0758	1.03	1.0328	0.9234	1921195	CBDivE_013220	Clc1ccc2c(c1)c3CCCc4nccn2c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F01	compound treatment	1.257	-0.0184	-0.25	1.212	-0.0222	-0.3	-0.3892	-0.9951	1921196	CBDivE_013221	Oc1cc(O)c(C(=N)COc2ccc(Cl)cc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F02	compound treatment	1.218	-0.0574	-0.77	1.197	-0.0372	-0.51	-0.9058	-0.979	1053281	CBDivE_013222	O=C(CN1CCOCC1)N2CCN(CC2)C(=O)CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F03	compound treatment	1.25	-0.0254	-0.34	1.204	-0.0302	-0.41	-0.5331	-0.9958	1921197	CBDivE_013223	O=C(NNC(=S)NC(=O)C1(CC2CC3CC(C2)C1)C3)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F04	compound treatment	1.237	-0.0384	-0.52	1.212	-0.0222	-0.3	-0.5799	-0.9673	1921198	CBDivE_013224	CC(C)(C)NCC(O)CO/N=C(\c1ccccc1)/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F05	compound treatment	1.279	0.00364	0.05	1.249	0.0148	0.2	0.1775	0.854	1921199	CBDivE_013225	Brc1ccc(/C=C/2\SC(=S)N(NC(=O)CN3C(=O)\C(=C\c4ccccc4)\SC3=S)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F06	compound treatment	1.27	-0.00536	-0.07	1.178	-0.0562	-0.77	-0.593	-0.7705	1921200	CBDivE_013226	Cc1cc(O)nc(=O)n1c2ccc(CC(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F07	compound treatment	1.276	6.36E-4	0.01	1.257	0.0228	0.31	0.226	0.7263	1713236	CBDivE_013227	CC(=O)NCc1ccc(cc1)S(=O)(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F08	compound treatment	1.247	-0.0284	-0.38	1.191	-0.0432	-0.59	-0.687	-0.9782	1921201	CBDivE_013228	COc1cc(/C=N/Nc2ccc(cc2)S(=O)(=O)O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F09	compound treatment	1.269	-0.00636	-0.09	1.227	-0.00719	-0.1	-0.13	-0.9978	1921202	CBDivE_013229	C/C(=C/c1oc2ccc(O)cc2c1[N+](=O)[O-])/N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F10	compound treatment	1.309	0.0336	0.45	1.293	0.0588	0.8	0.8879	0.9636	1568506	CBDivE_013230	CC(C)NCc1c(C)sc(C)c1CNC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F11	compound treatment	1.311	0.0356	0.48	1.303	0.0688	0.94	1.0034	0.9518	1921203	CBDivE_013231	CCOc1ccc(N/C=C\2/C(=O)CNC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F12	compound treatment	1.318	0.0426	0.58	1.279	0.0448	0.61	0.8388	0.9995	1921204	CBDivE_013232	Oc1c(C(=O)NCCCCCCNC(=O)CCl)c(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F13	compound treatment	1.275	-3.64E-4	0.0	1.232	-0.00219	-0.03	-0.0246	-0.8123	1921205	CBDivE_013233	Cc1oc2ccc(O)cc2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F14	compound treatment	1.261	-0.0144	-0.19	1.191	-0.0432	-0.59	-0.5535	-0.8927	1921206	CBDivE_013234	ClC(CSc1nnnn1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F15	compound treatment	1.293	0.0176	0.24	1.271	0.0368	0.5	0.5232	0.9418	1921207	CBDivE_013235	Cc1[nH]c2ccc(cc2c1Cc3c(C)[nH]c4ccc(cc34)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F16	compound treatment	1.282	0.00664	0.09	1.236	0.00181	0.02	0.0807	0.8695	1000116	CBDivE_013236	CC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F17	compound treatment	1.252	-0.0234	-0.32	1.211	-0.0232	-0.32	-0.4465	-1.0	1727901	CBDivE_013237	C(Cc1ccccc1)NC2CCCc3c2[nH]c4ccc(cc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F18	compound treatment	1.306	0.0306	0.41	1.262	0.0278	0.38	0.5604	0.9991	1118846	CBDivE_013238	Cn1c2C(=O)C(CCc2c3ccccc13)C=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F19	compound treatment	1.253	-0.0224	-0.3	1.217	-0.0172	-0.23	-0.3791	-0.9922	1494023	CBDivE_013239	Cc1ccc2n3CCCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	F20	compound treatment	1.266	-0.00936	-0.13	1.26	0.0258	0.35	0.1595	0.4267	1921208	CBDivE_013240	CN(CC(O)CNS(=O)(=O)O)CC(O)COc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G01	compound treatment	1.254	-0.0214	-0.29	1.198	-0.0362	-0.49	-0.5528	-0.9672	1921209	CBDivE_013241	CC[n+]1c(/C=C/N(C)c2ccccc2)oc3ccc(cc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G02	compound treatment	1.27	-0.00536	-0.07	1.282	0.0478	0.65	0.4098	0.6248	1921210	CBDivE_013242	COc1ccc(/C=C/2\C(=O)CNC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G03	compound treatment	1.262	-0.0134	-0.18	1.213	-0.0212	-0.29	-0.3318	-0.9742	1921211	CBDivE_013243	OS(=O)(=O)CCCN1/C(=C/c2oc3ccc4ccccc4c3[n+]2CCCS(=O)(=O)O)/Oc5ccc6ccccc6c15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G04	compound treatment	1.23	-0.0454	-0.61	1.23	-0.00419	-0.06	-0.4732	-0.7698	1921212	CBDivE_013244	O=C(NNC(=O)[C@@H]1C[C@@H]1c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G05	compound treatment	1.25	-0.0254	-0.34	1.19	-0.0442	-0.6	-0.6681	-0.964	1449100	CBDivE_013245	C[N+]1(Cc2ccccc2)CCCC1c3ccc(N)nc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G06	compound treatment	1.268	-0.00736	-0.1	1.263	0.0288	0.39	0.2075	0.5122	1921213	CBDivE_013246	c1ccc(cc1)c2nnc3ccc4nnc(c5ccccc5)n4n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G07	compound treatment	1.304	0.0286	0.39	1.253	0.0188	0.26	0.4545	0.9802	1921214	CBDivE_013247	CN(C(=O)C)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G08	compound treatment	1.265	-0.0104	-0.14	1.253	0.0188	0.26	0.0825	0.2824	1921215	CBDivE_013248	CN1CCN(CC1)C(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G09	compound treatment	1.273	-0.00236	-0.03	1.218	-0.0162	-0.22	-0.1787	-0.8009	1921216	CBDivE_013249	COc1cc2sc(C)[n+](CCCS(=O)(=O)O)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G10	compound treatment	1.317	0.0416	0.56	1.272	0.0378	0.52	0.7618	0.9991	1921217	CBDivE_013250	N(/N=C/c1ccccc1)c2ccc3nncn3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G11	compound treatment	1.276	6.36E-4	0.01	1.225	-0.00919	-0.13	-0.0826	-0.6571	1921218	CBDivE_013251	Fc1ccc(SCCc2cc[n+](CC(=O)C3(CC4CC5CC(C4)C3)C5)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G12	compound treatment	1.298	0.0226	0.31	1.289	0.0548	0.75	0.7444	0.922	1216492	CBDivE_013252	O=C1N(CCSC(=S)N2CCCCCC2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G13	compound treatment	1.24	-0.0354	-0.48	1.157	-0.0772	-1.05	-1.0817	-0.9359	1921219	CBDivE_013253	[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])n2nc(S)sc2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G14	compound treatment	1.362	0.0866	1.17	1.344	0.11	1.5	1.8853	0.9925	1921220	CBDivE_013254	[O-][N+](=O)c1ccc(NNC(=O)Nc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G15	compound treatment	1.286	0.0106	0.14	1.24	0.00581	0.08	0.1575	0.9608	1661524	CBDivE_013255	Clc1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G16	compound treatment	1.275	-3.64E-4	0.0	1.286	0.0518	0.71	0.4961	0.7022	1188565	CBDivE_013256	CN1CCN(CC1)C(=S)SCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G17	compound treatment	1.319	0.0436	0.59	1.25	0.0158	0.22	0.5687	0.9071	1142601	CBDivE_013257	Cc1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G18	compound treatment	1.331	0.0556	0.75	1.325	0.0908	1.24	1.4063	0.9712	1565315	CBDivE_013258	O=C(CSC(=S)N1CCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G19	compound treatment	1.336	0.0606	0.82	1.316	0.0818	1.12	1.3673	0.9884	1177188	CBDivE_013259	Clc1ccc(cc1)N2CCN(Cc3ccoc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	G20	compound treatment	1.305	0.0296	0.4	1.287	0.0528	0.72	0.7919	0.9614	1921221	CBDivE_013260	O=C(CSC(=S)N1CCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H01	compound treatment	1.222	-0.0534	-0.72	1.172	-0.0622	-0.85	-1.1087	-0.9967	1921222	CBDivE_013261	CC(=O)Oc1ccc2oc(C)c([N+](=O)[O-])c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H02	compound treatment	1.262	-0.0134	-0.18	1.23	-0.00419	-0.06	-0.1679	-0.8877	1921223	CBDivE_013262	COc1ccc(cc1Br)c2nc3cc(/N=C/c4ccc(OCc5ccccc5)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H03	compound treatment	1.25	-0.0254	-0.34	1.214	-0.0202	-0.28	-0.4366	-0.9942	1921224	CBDivE_013263	S=c1[nH]nc2ccc(nn12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H04	compound treatment	1.239	-0.0364	-0.49	1.202	-0.0322	-0.44	-0.6573	-0.9985	1921225	CBDivE_013264	CC(C)NCC(O)COc1cc2CCCCc2cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H05	compound treatment	1.282	0.00664	0.09	1.249	0.0148	0.2	0.2061	0.933	1921226	CBDivE_013265	Brc1ccc(NC(=N)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H06	compound treatment	1.106	-0.169	-2.28	1.201	-0.0332	-0.45	-1.9357	-0.831	1921227	CBDivE_013266	CCCN1C(=O)c2ccc(F)cc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H07	compound treatment	1.304	0.0286	0.39	1.248	0.0138	0.19	0.4063	0.9454	1921228	CBDivE_013267	Cc1[nH]c2cc(ccc2c1C=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H08	compound treatment	1.255	-0.0204	-0.27	1.206	-0.0282	-0.38	-0.4661	-0.9864	1921229	CBDivE_013268	CCc1ccc(cc1)C(=O)C[n+]2cccc3cc(OC)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H09	compound treatment	1.259	-0.0164	-0.22	1.23	-0.00419	-0.06	-0.1965	-0.8618	1716722	CBDivE_013269	Cc1ccc2[nH]c3C(CCCc3c2c1)NCC4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H10	compound treatment	1.285	0.00964	0.13	1.23	-0.00419	-0.06	0.0515	0.3627	1921230	CBDivE_013270	N/C(=N\Nc1ccc(Br)cc1Br)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H11	compound treatment	1.278	0.00264	0.04	1.244	0.00981	0.13	0.1197	0.8651	1658297	CBDivE_013271	Brc1ccc2[nH]c3C(CCCc3c2c1)NCCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H12	compound treatment	1.333	0.0576	0.78	1.281	0.0468	0.64	1.0012	0.9952	1921231	CBDivE_013272	COc1ccc(cc1)C(=O)Nc2ccc(/C=C/c3ccc(NC(=O)c4ccc(OC)cc4)cc3S(=O)(=O)O)c(c2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H13	compound treatment	1.306	0.0306	0.41	1.281	0.0468	0.64	0.7436	0.9779	1921232	CBDivE_013273	Clc1ccc(cc1)c2nnc3ccc4nnc(c5ccc(Cl)cc5)n4n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H14	compound treatment	1.275	-3.64E-4	0.0	1.227	-0.00719	-0.1	-0.0728	-0.7416	1244206	CBDivE_013274	Cc1nc2ccccc2c3c(N)c4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H15	compound treatment	1.262	-0.0134	-0.18	1.216	-0.0182	-0.25	-0.3029	-0.9877	1333537	CBDivE_013275	c1ccc(nc1)c2nc3ncccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H16	compound treatment	1.254	-0.0214	-0.29	1.196	-0.0382	-0.52	-0.5721	-0.9611	1921233	CBDivE_013276	Cc1cc(C)c(NC(=O)CNC2C3CC4CC(C3)CC2C4)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H17	compound treatment	1.227	-0.0484	-0.65	1.18	-0.0542	-0.74	-0.9839	-0.9981	1396888	CBDivE_013277	COc1ccc(cc1)N2C(=C(CCC2=O)C(=O)c3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H18	compound treatment	1.284	0.00864	0.12	1.231	-0.00319	-0.04	0.0516	0.415	1921234	CBDivE_013278	OC(=O)[C@H]1[C@@H]([C@@H]([C@H]1c2ccccc2)C(=O)O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H19	compound treatment	1.29	0.0146	0.2	1.241	0.00681	0.09	0.2053	0.9408	1921235	CBDivE_013279	Cc1c(C=O)c2cc(ccc2n1C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	H20	compound treatment	1.303	0.0276	0.37	1.268	0.0338	0.46	0.5896	0.9945	1921236	CBDivE_013280	N/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I01	compound treatment	1.263	-0.0124	-0.17	1.211	-0.0232	-0.32	-0.3416	-0.9553	1610854	CBDivE_013281	Clc1ccc(cc1)N2CCN(Cc3cccnc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I02	compound treatment	1.286	0.0106	0.14	1.282	0.0478	0.65	0.5625	0.8426	1921237	CBDivE_013282	Clc1cccc(NC(=O)NNC(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I03	compound treatment	1.281	0.00564	0.08	1.235	8.09E-4	0.01	0.0616	0.8013	1366812	CBDivE_013283	Brc1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I04	compound treatment	1.26	-0.0154	-0.21	1.298	0.0638	0.87	0.4687	0.524	1921238	CBDivE_013284	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I05	compound treatment	1.35	0.0746	1.01	1.286	0.0518	0.71	1.2115	0.985	1576797	CBDivE_013285	COc1cc(CN2CCN(CC2)c3ccccc3)cc(Br)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I06	compound treatment	1.125	-0.15	-2.03	1.254	0.0198	0.27	-1.2434	-0.6076	1405975	CBDivE_013286	Cc1c(CCO)c2ccccc2n1Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I07	compound treatment	1.313	0.0376	0.51	1.227	-0.00719	-0.1	0.2897	0.5602	1577844	CBDivE_013287	Clc1ccc(cc1)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I08	compound treatment	1.31	0.0346	0.47	1.254	0.0198	0.27	0.5214	0.9661	1523749	CBDivE_013288	Clc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I09	compound treatment	1.265	-0.0104	-0.14	1.186	-0.0482	-0.66	-0.5635	-0.8388	1707535	CBDivE_013289	COc1ccccc1N2CCN(Cc3cccnc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I10	compound treatment	1.301	0.0256	0.35	1.284	0.0498	0.68	0.7248	0.951	1420136	CBDivE_013290	Oc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I11	compound treatment	1.281	0.00564	0.08	1.199	-0.0352	-0.48	-0.2856	-0.5877	1677781	CBDivE_013291	COc1ccccc1N2CCN(Cc3cccs3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I12	compound treatment	1.3	0.0246	0.33	1.259	0.0248	0.34	0.4742	1.0	1624299	CBDivE_013292	Clc1ccc(cc1)N2CCN(Cc3cccc(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I13	compound treatment	1.305	0.0296	0.4	1.262	0.0278	0.38	0.5509	0.9997	1359364	CBDivE_013293	Oc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I14	compound treatment	1.293	0.0176	0.24	1.244	0.00981	0.13	0.2628	0.9629	1071059	CBDivE_013294	C(N1CCN(CC1)c2ccccc2)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I15	compound treatment	1.298	0.0226	0.31	1.181	-0.0532	-0.73	-0.297	-0.3773	1121213	CBDivE_013295	CCOc1cc(CN2CCN(CC2)c3ccc(Cl)cc3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I16	compound treatment	1.321	0.0456	0.62	1.283	0.0488	0.67	0.906	0.9992	1140162	CBDivE_013296	COc1ccccc1N2CCN(Cc3cc(Br)c(O)c(OC)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I17	compound treatment	1.32	0.0446	0.6	1.231	-0.00319	-0.04	0.395	0.6543	1779768	CBDivE_013297	COc1ccccc1N2CCN(Cc3ccc(cc3)[N+](=O)[O-])CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I18	compound treatment	1.321	0.0456	0.62	1.249	0.0148	0.2	0.5781	0.8923	1450439	CBDivE_013298	COc1ccc(CN2CCN(CC2)c3ccccc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I19	compound treatment	1.277	0.00164	0.02	1.204	-0.0302	-0.41	-0.2755	-0.6682	1385730	CBDivE_013299	Oc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	I20	compound treatment	1.274	-0.00136	-0.02	1.233	-0.00119	-0.02	-0.0245	-0.9981	1220425	CBDivE_013300	COc1ccc(CN2CCCCCC2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J01	compound treatment	1.248	-0.0274	-0.37	1.184	-0.0502	-0.68	-0.745	-0.958	1319130	CBDivE_013301	Brc1ccccc1N2CCC(=O)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J02	compound treatment	1.25	-0.0254	-0.34	1.228	-0.00619	-0.08	-0.3017	-0.8559	1692508	CBDivE_013302	C1C[N+]2(CC[N+]3(CCc4ccccc43)CC2)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J03	compound treatment	1.258	-0.0174	-0.23	1.221	-0.0132	-0.18	-0.2928	-0.9915	1921239	CBDivE_013303	Cc1cc(C)n(n1)c2ccc3nncn3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J04	compound treatment	1.235	-0.0404	-0.54	1.191	-0.0432	-0.59	-0.8015	-0.9992	1921240	CBDivE_013304	[O-][N+](=O)c1ccccc1SNCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J05	compound treatment	1.284	0.00864	0.12	1.224	-0.0102	-0.14	-0.0159	-0.0876	1921241	CBDivE_013305	CC[n+]1c(/C=C/N(C)c2ccccc2)oc3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J06	compound treatment	1.271	-0.00436	-0.06	1.22	-0.0142	-0.19	-0.1785	-0.8823	1921242	CBDivE_013306	Oc1ccccc1C(=O)N/N=C/C(=N\NC(=O)c2ccccc2O)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J07	compound treatment	1.267	-0.00836	-0.11	1.205	-0.0292	-0.4	-0.3613	-0.8731	1921243	CBDivE_013307	[O-][N+](=O)c1cc([N+](=O)[O-])c2N(CCSc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J08	compound treatment	1.274	-0.00136	-0.02	1.207	-0.0272	-0.37	-0.2752	-0.7413	1921244	CBDivE_013308	Cc1ccc2[n+](CCCS(=O)(=O)O)c(Oc3ccccc3)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J09	compound treatment	1.27	-0.00536	-0.07	1.225	-0.00919	-0.13	-0.1398	-0.9659	1155700	CBDivE_013309	C(N1CCN(CC1)c2ccccn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J10	compound treatment	1.263	-0.0124	-0.17	1.202	-0.0322	-0.44	-0.4283	-0.9122	1921245	CBDivE_013310	Cc1cc(=O)oc2c(CN(CCO)CCO)c(O)c(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J11	compound treatment	1.31	0.0346	0.47	1.243	0.00881	0.12	0.4153	0.8609	1463948	CBDivE_013311	Clc1ccc(CN2CCN(CC2)c3ccccn3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J12	compound treatment	1.265	-0.0104	-0.14	1.174	-0.0602	-0.82	-0.6793	-0.8158	1921246	CBDivE_013312	Cc1cc(C)c(NC(=O)CN2CCN3CCCC3C2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J13	compound treatment	1.281	0.00564	0.08	1.215	-0.0192	-0.26	-0.1313	-0.4817	1921247	CBDivE_013313	FC(F)(F)c1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J14	compound treatment	1.257	-0.0184	-0.25	1.175	-0.0592	-0.81	-0.7459	-0.8835	1737075	CBDivE_013314	Fc1ccc(cc1)C2NC(C3C(NC(C2C3=O)c4ccc(F)cc4)c5ccc(F)cc5)c6ccc(F)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J15	compound treatment	1.296	0.0206	0.28	1.224	-0.0102	-0.14	0.0986	0.3168	1557119	CBDivE_013315	C(N1CCN(CC1)c2ccccc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J16	compound treatment	1.261	-0.0144	-0.19	1.196	-0.0382	-0.52	-0.5053	-0.9093	1921248	CBDivE_013316	c1ccc(cc1)c2ncc3c(ccc4ccccc43)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J17	compound treatment	1.273	-0.00236	-0.03	1.164	-0.0702	-0.96	-0.6994	-0.7303	1159683	CBDivE_013317	Clc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J18	compound treatment	1.307	0.0316	0.43	1.254	0.0198	0.27	0.4928	0.9756	1921249	CBDivE_013318	Clc1ccc2C(=O)/C(=C\3/Sc4ccc5ccccc5c4C3=O)/Sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J19	compound treatment	1.235	-0.0404	-0.54	1.224	-0.0102	-0.14	-0.4833	-0.86	1921250	CBDivE_013319	Cc1ccc2[nH]c3/C(=N/Cc4ccccc4)/CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	J20	compound treatment	1.243	-0.0324	-0.44	1.201	-0.0332	-0.45	-0.6288	-0.9998	1270527	CBDivE_013320	CN(C)CC(Oc1ccc(Cl)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K01	compound treatment	1.26	-0.0154	-0.21	1.238	0.00381	0.05	-0.1098	-0.514	1649591	CBDivE_013321	COc1ccccc1N2CCN(Cc3ccc(SC)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K02	compound treatment	1.27	-0.00536	-0.07	1.247	0.0128	0.17	0.0723	0.3826	1552717	CBDivE_013322	COc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K03	compound treatment	1.286	0.0106	0.14	1.211	-0.0232	-0.32	-0.1222	-0.3518	1594080	CBDivE_013323	Brc1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K04	compound treatment	1.269	-0.00636	-0.09	1.228	-0.00619	-0.08	-0.1204	-1.0	1921251	CBDivE_013324	FC(F)(F)c1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K05	compound treatment	1.305	0.0296	0.4	1.215	-0.0192	-0.26	0.0977	0.2044	1133839	CBDivE_013325	Clc1cccc(CN2CCN(CC2)c3ccccn3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K06	compound treatment	1.317	0.0416	0.56	1.315	0.0808	1.1	1.1764	0.9511	1569947	CBDivE_013326	Fc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K07	compound treatment	1.289	0.0136	0.18	1.224	-0.0102	-0.14	0.0318	0.138	1708320	CBDivE_013327	Cc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K08	compound treatment	1.265	-0.0104	-0.14	1.247	0.0128	0.17	0.0246	0.1102	1227116	CBDivE_013328	COc1ccccc1CN2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K09	compound treatment	1.29	0.0146	0.2	1.192	-0.0422	-0.58	-0.2672	-0.4393	1921252	CBDivE_013329	FC(F)(F)c1ccccc1CN2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K10	compound treatment	1.298	0.0226	0.31	1.266	0.0318	0.43	0.5226	0.9852	1090872	CBDivE_013330	OC(=O)c1ccccc1c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K11	compound treatment	1.299	0.0236	0.32	1.183	-0.0512	-0.7	-0.2681	-0.3494	1204941	CBDivE_013331	C(N1CCN(CC1)c2ccccc2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K12	compound treatment	1.303	0.0276	0.37	1.238	0.00381	0.05	0.3004	0.7979	1135145	CBDivE_013332	Cc1ccc(OCC(=O)Nc2ccc3ccccc3c2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K13	compound treatment	1.31	0.0346	0.47	1.22	-0.0142	-0.19	0.1936	0.3827	1707217	CBDivE_013333	CSc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K14	compound treatment	1.347	0.0716	0.97	1.316	0.0818	1.12	1.4722	0.9974	1921253	CBDivE_013334	Brc1ccc2c(c1)-c3cc(Br)ccc3S2(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K15	compound treatment	1.31	0.0346	0.47	1.202	-0.0322	-0.44	0.02	0.0312	1343633	CBDivE_013335	COc1cc(CN2CCN(CC2)c3ccc(Cl)cc3)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K16	compound treatment	1.327	0.0516	0.7	1.31	0.0758	1.03	1.2236	0.9815	1921254	CBDivE_013336	O=C(Oc1c(Cc2ccc3ccccc3c2OC(=O)c4ccccc4)ccc5ccccc15)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K17	compound treatment	1.308	0.0326	0.44	1.232	-0.00219	-0.03	0.2902	0.6576	1921255	CBDivE_013337	CC1(CBr)CN=C(S1)N2CCN(CC2)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K18	compound treatment	1.297	0.0216	0.29	1.253	0.0188	0.26	0.3878	0.9979	1774567	CBDivE_013338	Cc1cc(ccc1OC(=O)c2ccccc2)C(C)(C)c3ccc(OC(=O)c4ccccc4)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K19	compound treatment	1.285	0.00964	0.13	1.196	-0.0382	-0.52	-0.2763	-0.5148	1921256	CBDivE_013339	Brc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	K20	compound treatment	1.306	0.0306	0.41	1.246	0.0118	0.16	0.4061	0.9156	1921257	CBDivE_013340	O=C(Nc1ccccc1)c2ccc(cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L01	compound treatment	1.258	-0.0174	-0.23	1.251	0.0168	0.23	-0.0036	-0.0109	1273037	CBDivE_013341	Nc1nnc(CCS(=O)(=O)c2ccc(Cl)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L02	compound treatment	1.256	-0.0194	-0.26	1.188	-0.0462	-0.63	-0.6301	-0.924	1921258	CBDivE_013342	OC(=O)c1cnc(nc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L03	compound treatment	1.269	-0.00636	-0.09	1.227	-0.00719	-0.1	-0.13	-0.9978	1921259	CBDivE_013343	C/C(=N\NC(=S)N1CCCC1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L04	compound treatment	1.262	-0.0134	-0.18	1.209	-0.0252	-0.34	-0.3704	-0.9547	1018572	CBDivE_013344	OC(=O)c1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L05	compound treatment	1.284	0.00864	0.12	1.19	-0.0442	-0.6	-0.3437	-0.56	1921260	CBDivE_013345	CCCCOc1ccc(cc1)C(=O)Nc2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L06	compound treatment	1.298	0.0226	0.31	1.248	0.0138	0.19	0.3491	0.973	1343336	CBDivE_013346	COc1ccc(cc1)c2nc(CN(C)C)cc(CN(C)C)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L07	compound treatment	1.254	-0.0214	-0.29	1.213	-0.0212	-0.29	-0.4081	-1.0	1634908	CBDivE_013347	Fc1ccccc1CN2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L08	compound treatment	1.214	-0.0614	-0.83	1.155	-0.0792	-1.08	-1.349	-0.9914	1118236	CBDivE_013348	CN1CCc2c(C1)c3ccccc3n2CCc4ccc(C)nc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L09	compound treatment	1.283	0.00764	0.1	1.232	-0.00219	-0.03	0.0517	0.4821	1390811	CBDivE_013349	CCOC(=O)C1=C2N(C)c3ccccc3N2CCC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L10	compound treatment	1.221	-0.0544	-0.73	1.171	-0.0632	-0.86	-1.1279	-0.9968	1921261	CBDivE_013350	Brc1ccc(/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L11	compound treatment	1.244	-0.0314	-0.42	1.154	-0.0802	-1.09	-1.0724	-0.9146	1921262	CBDivE_013351	O=C(NNC(=O)c1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L12	compound treatment	1.311	0.0356	0.48	1.226	-0.00819	-0.11	0.261	0.5287	1921263	CBDivE_013352	On1c2CCCCc2c3c1ccc4[n+]([O-])onc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L13	compound treatment	1.323	0.0476	0.64	1.234	-1.91E-4	0.0	0.4526	0.7042	1921264	CBDivE_013353	Brc1cccc(c1)C(=O)NNC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L14	compound treatment	1.297	0.0216	0.29	1.237	0.00281	0.04	0.2335	0.7931	1456921	CBDivE_013354	Nc1ccc(C2CCCc3nonc23)c4nonc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L15	compound treatment	1.259	-0.0164	-0.22	1.192	-0.0422	-0.58	-0.5629	-0.9135	1921265	CBDivE_013355	CC(=O)n1c(C)c(c2ccccc2)c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L16	compound treatment	1.282	0.00664	0.09	1.228	-0.00619	-0.08	0.0036	0.0293	1921266	CBDivE_013356	Nc1c(ccc2=[N+]([O-])C3(CCCCC3)[N+](=c12)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L17	compound treatment	1.321	0.0456	0.62	1.267	0.0328	0.45	0.7517	0.9877	1152253	CBDivE_013357	CCc1nnc(NS(=O)(=O)c2ccc(Cl)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L18	compound treatment	1.241	-0.0344	-0.46	1.151	-0.0832	-1.13	-1.13	-0.922	1779993	CBDivE_013358	COc1ccc(cc1)n2c(C)c([N+](=O)[O-])c3ccc(O)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L19	compound treatment	1.229	-0.0464	-0.63	1.153	-0.0812	-1.11	-1.2252	-0.9635	1716853	CBDivE_013359	CN1C2=CC(=O)CCN2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	L20	compound treatment	1.273	-0.00236	-0.03	1.199	-0.0352	-0.48	-0.3619	-0.7524	1434513	CBDivE_013360	Cc1cc-2c(C(=O)c3ccc(Br)cc23)n1Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M01	compound treatment	1.282	0.00664	0.09	1.302	0.0678	0.92	0.7171	0.772	1054106	CBDivE_013361	CC1SC(=S)N(C1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M02	compound treatment	1.224	-0.0514	-0.69	1.22	-0.0142	-0.19	-0.6268	-0.8712	1921267	CBDivE_013362	FC(F)(F)COC(=O)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M03	compound treatment	1.3	0.0246	0.33	1.248	0.0138	0.19	0.3682	0.9638	1014271	CBDivE_013363	OC(=O)c1c2CCCc2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M04	compound treatment	1.261	-0.0144	-0.19	1.279	0.0448	0.61	0.295	0.4603	1921268	CBDivE_013364	CCCCNC1=Nc2ccccc2CCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M05	compound treatment	1.223	-0.0524	-0.71	1.21	-0.0242	-0.33	-0.7328	-0.9399	1370736	CBDivE_013365	COc1ccc(CN2CCN(CC2)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M06	compound treatment	1.236	-0.0394	-0.53	1.203	-0.0312	-0.43	-0.6763	-0.9939	1921269	CBDivE_013366	COc1cccc(c1)C(=O)Oc2ccc(cc2)C3(OC(=O)c4ccccc43)c5ccc(OC(=O)c6cccc(OC)c6)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M07	compound treatment	1.267	-0.00836	-0.11	1.202	-0.0322	-0.44	-0.3902	-0.8609	1921270	CBDivE_013367	[O-][N+](=O)c1ccc(Cl)c(CN2CCCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M08	compound treatment	1.263	-0.0124	-0.17	1.238	0.00381	0.05	-0.0812	-0.4649	1143999	CBDivE_013368	CCc1nnc(NS(=O)(=O)c2ccc(C)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M09	compound treatment	1.287	0.0116	0.16	1.182	-0.0522	-0.71	-0.3922	-0.5382	1599398	CBDivE_013369	CC(C)c1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M10	compound treatment	1.288	0.0126	0.17	1.252	0.0178	0.24	0.2923	0.985	1921271	CBDivE_013370	S=c1ccc(n[nH]1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M11	compound treatment	1.283	0.00764	0.1	1.185	-0.0492	-0.67	-0.4015	-0.5916	1921272	CBDivE_013371	C(N1CCN(CC1)c2ccccc2)c3ccoc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M12	compound treatment	1.319	0.0436	0.59	1.262	0.0278	0.38	0.6844	0.9774	1921273	CBDivE_013372	O=C/1OC(=N\C1=C\C=C\c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M13	compound treatment	1.276	6.36E-4	0.01	1.233	-0.00119	-0.02	-0.0054	-0.2948	1551520	CBDivE_013373	COc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M14	compound treatment	1.321	0.0456	0.62	1.313	0.0788	1.07	1.1952	0.9651	1921274	CBDivE_013374	COc1ccccc1/C=N/NC(=O)c2ccn[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M15	compound treatment	1.267	-0.00836	-0.11	1.16	-0.0742	-1.01	-0.7952	-0.7811	1244509	CBDivE_013375	C(N1CCN(CC1)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M16	compound treatment	1.275	-3.64E-4	0.0	1.24	0.00581	0.08	0.0525	0.662	1578214	CBDivE_013376	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2ccnn2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M17	compound treatment	1.297	0.0216	0.29	1.244	0.00981	0.13	0.301	0.9374	1050410	CBDivE_013377	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M18	compound treatment	1.296	0.0206	0.28	1.239	0.00481	0.07	0.2432	0.8504	1239770	CBDivE_013378	COc1ccccc1N2CCN(Cc3cccc(O)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M19	compound treatment	1.251	-0.0244	-0.33	1.209	-0.0252	-0.34	-0.4753	-0.9998	1921275	CBDivE_013379	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	M20	compound treatment	1.281	0.00564	0.08	1.295	0.0608	0.83	0.6401	0.7687	1921276	CBDivE_013380	[O-][N+](=O)c1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N01	compound treatment	1.249	-0.0264	-0.36	1.3	0.0658	0.9	0.3831	0.3968	1534164	CBDivE_013381	COc1ccccc1N2CCN(Cc3ccccc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N02	compound treatment	1.219	-0.0564	-0.76	1.216	-0.0182	-0.25	-0.7131	-0.8915	1921277	CBDivE_013382	[O-][N+](=O)c1ccc(N/N=C\2/CCCCC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N03	compound treatment	1.211	-0.0644	-0.87	1.157	-0.0772	-1.05	-1.3583	-0.9954	1660415	CBDivE_013383	COc1ccccc1N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N04	compound treatment	1.245	-0.0304	-0.41	1.196	-0.0382	-0.52	-0.6579	-0.9929	1921278	CBDivE_013384	CC1(C)CC(=O)c2c(C1)nc(c3ccccc3)n2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N05	compound treatment	1.242	-0.0334	-0.45	1.223	-0.0112	-0.15	-0.4262	-0.8967	1584902	CBDivE_013385	Cc1ccc2cc([nH]c2c1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N06	compound treatment	1.224	-0.0514	-0.69	1.14	-0.0942	-1.28	-1.3982	-0.9581	1483237	CBDivE_013386	CCOC(=O)c1oc2cc(Cl)c(O)c(CN(C)C)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N07	compound treatment	1.263	-0.0124	-0.17	1.235	8.09E-4	0.01	-0.1101	-0.6589	1482370	CBDivE_013387	COc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N08	compound treatment	1.244	-0.0314	-0.42	1.208	-0.0262	-0.36	-0.5517	-0.9964	1196528	CBDivE_013388	Cc1ccc2n(CC3COC(C)(C)O3)c4C(=O)CCCc4c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N09	compound treatment	1.26	-0.0154	-0.21	1.215	-0.0192	-0.26	-0.3316	-0.9933	1921279	CBDivE_013389	Cc1cc(C)n(n1)c2ccc(=O)[nH]n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N10	compound treatment	1.254	-0.0214	-0.29	1.202	-0.0322	-0.44	-0.5142	-0.9792	1921280	CBDivE_013390	COC(=O)NNC(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N11	compound treatment	1.247	-0.0284	-0.38	1.197	-0.0372	-0.51	-0.6292	-0.9904	1921281	CBDivE_013391	Clc1ccc(Sc2ccc(cc2)S(=O)(=O)c3ccc(Sc4ccc(Cl)cc4)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N12	compound treatment	1.281	0.00564	0.08	1.193	-0.0412	-0.56	-0.3434	-0.6059	1410685	CBDivE_013392	O=C1N(CCSC(=S)N2CCCCCC2)Cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N13	compound treatment	1.288	0.0126	0.17	1.235	8.09E-4	0.01	0.1283	0.7513	1067510	CBDivE_013393	Cc1cccc(C)c1NC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N14	compound treatment	1.267	-0.00836	-0.11	1.203	-0.0312	-0.43	-0.3805	-0.8648	1704199	CBDivE_013394	CCOC(=O)c1c(CN(CC)CC)n(C)c2cc(Br)c(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N15	compound treatment	1.241	-0.0344	-0.46	1.188	-0.0462	-0.63	-0.7732	-0.9886	1921282	CBDivE_013395	Clc1cccc(NC(=O)NNC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N16	compound treatment	1.273	-0.00236	-0.03	1.187	-0.0472	-0.64	-0.4776	-0.7412	1921283	CBDivE_013396	OC(=O)/C=C\C(=O)Nc1cccc(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N17	compound treatment	1.227	-0.0484	-0.65	1.168	-0.0662	-0.9	-1.0996	-0.9873	1601095	CBDivE_013397	CC(SC(=S)N1CCCC1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N18	compound treatment	1.262	-0.0134	-0.18	1.178	-0.0562	-0.77	-0.6693	-0.8503	1921284	CBDivE_013398	CC(C)COP(=O)(Nc1ccc(C)cn1)OCC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N19	compound treatment	1.267	-0.00836	-0.11	1.261	0.0268	0.37	0.1787	0.4671	1255710	CBDivE_013399	CN1CCC2Nc3ccc(C)cc3C2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	N20	compound treatment	1.274	-0.00136	-0.02	1.206	-0.0282	-0.38	-0.2848	-0.7401	1921285	CBDivE_013400	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O01	compound treatment	1.296	0.0206	0.28	1.26	0.0258	0.35	0.4457	0.9933	1602377	CBDivE_013401	Fc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O02	compound treatment	1.33	0.0546	0.74	1.326	0.0918	1.25	1.4065	0.9681	1649512	CBDivE_013402	Fc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O03	compound treatment	1.332	0.0566	0.76	1.282	0.0478	0.65	1.0013	0.9969	1341149	CBDivE_013403	CCOc1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O04	compound treatment	1.327	0.0516	0.7	1.307	0.0728	0.99	1.1946	0.985	1601337	CBDivE_013404	CCOc1ccc(CN2CCN(CC2)c3ccccc3OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O05	compound treatment	1.319	0.0436	0.59	1.277	0.0428	0.58	0.829	1.0	1709964	CBDivE_013405	COc1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O06	compound treatment	1.271	-0.00436	-0.06	1.213	-0.0212	-0.29	-0.246	-0.834	1921286	CBDivE_013406	[O-][N+](=O)c1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O07	compound treatment	1.301	0.0256	0.35	1.242	0.00781	0.11	0.3198	0.8839	1921287	CBDivE_013407	FC(F)(F)c1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O08	compound treatment	1.264	-0.0114	-0.15	1.23	-0.00419	-0.06	-0.1488	-0.9096	1545790	CBDivE_013408	Brc1ccc(CN2CCN(CC2)c3ccccc3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O09	compound treatment	1.343	0.0676	0.91	1.288	0.0538	0.73	1.1641	0.9942	1376757	CBDivE_013409	C(N1CCN(CC1)c2ccccn2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O10	compound treatment	1.321	0.0456	0.62	1.265	0.0308	0.42	0.7324	0.9826	1205883	CBDivE_013410	Clc1ccccc1CN2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O11	compound treatment	1.284	0.00864	0.12	1.216	-0.0182	-0.25	-0.093	-0.3394	1625456	CBDivE_013411	Brc1cccc(CN2CCN(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O12	compound treatment	1.349	0.0736	0.99	1.301	0.0668	0.91	1.3466	0.9991	1731988	CBDivE_013412	Clc1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O13	compound treatment	1.3	0.0246	0.33	1.246	0.0118	0.16	0.3489	0.9447	1921288	CBDivE_013413	[O-][N+](=O)c1ccc(cc1)C2=NN=C(SC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O14	compound treatment	1.316	0.0406	0.55	1.271	0.0368	0.5	0.7426	0.999	1396769	CBDivE_013414	COc1ccccc1N2CCN(Cc3ccc(F)cc3F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O15	compound treatment	1.315	0.0396	0.53	1.211	-0.0232	-0.32	0.1545	0.2487	1455691	CBDivE_013415	COc1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O16	compound treatment	1.325	0.0496	0.67	1.269	0.0348	0.47	0.8091	0.9858	1344862	CBDivE_013416	Fc1ccccc1CN2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O17	compound treatment	1.313	0.0376	0.51	1.262	0.0278	0.38	0.6272	0.9897	1354068	CBDivE_013417	Clc1ccc(cc1)N2CCN(Cc3ccc(Br)s3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O18	compound treatment	1.275	-3.64E-4	0.0	1.232	-0.00219	-0.03	-0.0246	-0.8123	1153584	CBDivE_013418	COc1ccccc1CN2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O19	compound treatment	1.306	0.0306	0.41	1.253	0.0188	0.26	0.4736	0.9737	1531054	CBDivE_013419	Clc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	O20	compound treatment	1.369	0.0936	1.26	1.349	0.115	1.57	2.0003	0.9943	1511856	CBDivE_013420	COc1ccccc1N2CCN(Cc3cccc(C)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P01	compound treatment	1.302	0.0266	0.36	1.242	0.00781	0.11	0.3294	0.8789	1921289	CBDivE_013421	COC(=O)NNC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P02	compound treatment	1.238	-0.0374	-0.5	1.201	-0.0332	-0.45	-0.6765	-0.9986	1921290	CBDivE_013422	O=C/1CNC(=O)\C1=C/Nc2ccc(cc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P03	compound treatment	1.298	0.0226	0.31	1.261	0.0268	0.37	0.4744	0.996	1921291	CBDivE_013423	CC(C)N(C(C)C)C(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P04	compound treatment	1.19	-0.0854	-1.15	1.147	-0.0872	-1.19	-1.655	-0.9999	1365423	CBDivE_013424	CC1C(N(C)CCC1(NC(=O)C)NC(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P05	compound treatment	1.289	0.0136	0.18	1.261	0.0268	0.37	0.3886	0.9495	1243945	CBDivE_013425	Cc1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P06	compound treatment	1.282	0.00664	0.09	1.216	-0.0182	-0.25	-0.1121	-0.4251	1331716	CBDivE_013426	Clc1ccc(cc1)N2CCN(Cc3cccc(Br)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P07	compound treatment	1.253	-0.0224	-0.3	1.187	-0.0472	-0.64	-0.6684	-0.9404	1444825	CBDivE_013427	Clc1ccc(cc1)N2CCN(Cc3cccs3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P08	compound treatment	1.205	-0.0704	-0.95	1.144	-0.0902	-1.23	-1.5409	-0.9918	1714609	CBDivE_013428	Clc1ccc(cc1)N2CCN(Cc3c[nH]c4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P09	compound treatment	1.23	-0.0454	-0.61	1.157	-0.0772	-1.05	-1.177	-0.9667	1013117	CBDivE_013429	Nc1cccc(NC(=O)c2cccc(N)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P10	compound treatment	0.756	-0.519	-7.01	0.677	-0.557	-7.6	-10.327	-0.9992	1921292	CBDivE_013430	FC(F)(F)c1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P11	compound treatment	1.205	-0.0704	-0.95	1.154	-0.0802	-1.09	-1.4445	-0.9975	1691157	CBDivE_013431	COc1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P12	compound treatment	1.276	6.36E-4	0.01	1.204	-0.0302	-0.41	-0.285	-0.6922	1583575	CBDivE_013432	COC(CNC1CCCc2c1[nH]c3ccc(C)cc23)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P13	compound treatment	1.193	-0.0824	-1.11	1.131	-0.103	-1.41	-1.7807	-0.9932	1921293	CBDivE_013433	OC(=O)CSc1cccc2c(SCC(=O)O)cccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P14	compound treatment	1.281	0.00564	0.08	1.197	-0.0372	-0.51	-0.3048	-0.5944	1921294	CBDivE_013434	OCCSc1c(cc([N+](=O)[O-])c2cccnc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P15	compound treatment	1.202	-0.0734	-0.99	1.156	-0.0782	-1.07	-1.4538	-0.9993	1921295	CBDivE_013435	Nc1ccc(cc1)C(=O)Oc2cccc(OC(=O)c3ccc(N)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P16	compound treatment	1.254	-0.0214	-0.29	1.174	-0.0602	-0.82	-0.7842	-0.9014	1921296	CBDivE_013436	CCn1c(/C=C/N(C)C)c(C=O)c2cc(ccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P17	compound treatment	1.271	-0.00436	-0.06	1.22	-0.0142	-0.19	-0.1785	-0.8823	1921297	CBDivE_013437	Cc1cc(C)n(n1)c2ccc3n[nH]c(=O)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P18	compound treatment	1.317	0.0416	0.56	1.258	0.0238	0.32	0.6268	0.9661	1921298	CBDivE_013438	COCc1[nH]c2ccc(cc2c1c3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P19	compound treatment	1.289	0.0136	0.18	1.207	-0.0272	-0.37	-0.1321	-0.3192	1093273	CBDivE_013439	Cc1cc(C)n(n1)c2ccc(Cl)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.42	P20	compound treatment	1.311	0.0356	0.48	1.268	0.0338	0.46	0.6659	0.9998	1921299	CBDivE_013440	CC1(C)CC(=O)C(=C(C1)NCc2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A01	compound treatment	1.302	0.0334	0.45	1.238	0.0142	0.19	0.4555	0.9283	1921300	CBDivE_013441	CC[n+]1c(/C=C/SC)ccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A02	compound treatment	1.287	0.0184	0.25	1.237	0.0132	0.18	0.3028	0.9872	1509036	CBDivE_013442	Cc1cc(NS(=O)(=O)NC(C)(C)C)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A03	compound treatment	1.312	0.0434	0.59	1.293	0.0692	0.94	1.0812	0.9738	1921301	CBDivE_013443	Cc1ccc(cc1)C(=O)/C=C(/N2CCCCC2)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A04	compound treatment	1.287	0.0184	0.25	1.24	0.0162	0.22	0.3317	0.9982	1921302	CBDivE_013444	CC(C)(C)NS(=O)(=O)Nc1ncccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A05	compound treatment	1.271	0.00244	0.03	1.243	0.0192	0.26	0.208	0.7898	1921303	CBDivE_013445	OCCOCCOc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A06	compound treatment	1.296	0.0274	0.37	1.273	0.0492	0.67	0.7358	0.9608	1921304	CBDivE_013446	C(=C/c1ccccc1)\c2cc([nH]n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A07	compound treatment	1.291	0.0224	0.3	1.219	-0.00484	-0.07	0.1674	0.5403	1274495	CBDivE_013447	Cc1ccc(Cc2cnc(CN3CCOCC3)c(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A08	compound treatment	1.284	0.0154	0.21	1.234	0.0102	0.14	0.2452	0.9804	1921305	CBDivE_013448	COc1cc(cc(OC)c1O)C2NCCc3cc(OC)c(OC)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A09	compound treatment	1.243	-0.0256	-0.34	1.201	-0.0228	-0.31	-0.4641	-0.9987	1921306	CBDivE_013449	NC(=N)SCCON1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A10	compound treatment	1.247	-0.0216	-0.29	1.189	-0.0348	-0.48	-0.5416	-0.9723	1921307	CBDivE_013450	Cc1cc(Br)cc(C)c1c2cc([nH]n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A11	compound treatment	1.286	0.0174	0.24	1.232	0.00816	0.11	0.245	0.9416	1432950	CBDivE_013451	COc1cc(CN2CCN(CC2)c3ccc(Cl)cc3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A12	compound treatment	1.295	0.0264	0.36	1.264	0.0402	0.55	0.6394	0.9784	1122113	CBDivE_013452	Clc1c(sc2ccccc12)C(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A13	compound treatment	1.331	0.0624	0.84	1.291	0.0672	0.92	1.2432	0.9991	1921308	CBDivE_013453	Cc1cc(Cl)nc(n1)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A14	compound treatment	1.3	0.0314	0.42	1.263	0.0392	0.53	0.6775	0.9935	1921309	CBDivE_013454	CCN(CC)C(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A15	compound treatment	1.265	-0.00356	-0.05	1.226	0.00216	0.03	-0.0131	-0.233	1921310	CBDivE_013455	Cc1cc(C)n(n1)c2nc(cc(n2)c3ccc(Br)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A16	compound treatment	1.29	0.0214	0.29	1.291	0.0672	0.92	0.8521	0.8872	1921311	CBDivE_013456	CN(C)CCCOC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A17	compound treatment	1.253	-0.0156	-0.21	1.188	-0.0358	-0.49	-0.494	-0.9288	1270037	CBDivE_013457	Cc1cc(Cc2cc(C)c(N)c(C)c2)cc(C)c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A18	compound treatment	1.336	0.0674	0.91	1.32	0.0962	1.31	1.5705	0.984	1921312	CBDivE_013458	CCN(CC)CCNC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A19	compound treatment	1.239	-0.0296	-0.4	1.174	-0.0498	-0.68	-0.7626	-0.9677	1356582	CBDivE_013459	COc1ccc(cc1)c2nc(nc3ccc4ccccc4c23)c5cccc(OC)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	A20	compound treatment	1.291	0.0224	0.3	1.283	0.0592	0.81	0.7845	0.9104	1332614	CBDivE_013460	CN(C)CCOC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B01	compound treatment	1.255	-0.0136	-0.18	1.211	-0.0128	-0.18	-0.2532	-0.9998	1644454	CBDivE_013461	CCCCC1CC1C(=O)Nc2ncc3C(=O)CC(C)(C)Cc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B02	compound treatment	1.287	0.0184	0.25	1.241	0.0172	0.23	0.3414	0.9995	1294988	CBDivE_013462	Fc1ccccc1C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B03	compound treatment	1.254	-0.0146	-0.2	1.183	-0.0408	-0.56	-0.5327	-0.9021	1921313	CBDivE_013463	FC(F)(F)C(=O)Nc1nc2ccccc2n1CCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B04	compound treatment	1.307	0.0384	0.52	1.253	0.0292	0.4	0.6479	0.9914	1921314	CBDivE_013464	C/C=C/C(=O)Nc1ccccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B05	compound treatment	1.32	0.0514	0.69	1.291	0.0672	0.92	1.1383	0.9906	1684348	CBDivE_013465	C1Cn2cccc2C(=N1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B06	compound treatment	1.29	0.0214	0.29	1.258	0.0342	0.47	0.5339	0.9737	1345098	CBDivE_013466	Clc1ccc(OCC(=O)N2CCCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B07	compound treatment	1.27	0.00144	0.02	1.252	0.0282	0.38	0.2853	0.7418	1591442	CBDivE_013467	Nc1nc(cs1)c2ccc(O)c(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B08	compound treatment	1.3	0.0314	0.42	1.236	0.0122	0.17	0.4172	0.9161	1921315	CBDivE_013468	Brc1cccc(c1)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B09	compound treatment	1.286	0.0174	0.24	1.205	-0.0188	-0.26	-0.0153	-0.044	1465941	CBDivE_013469	C1Cn2cccc2C(N1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B10	compound treatment	1.335	0.0664	0.9	1.32	0.0962	1.31	1.561	0.9828	1921316	CBDivE_013470	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B11	compound treatment	1.274	0.00544	0.07	1.239	0.0152	0.21	0.1981	0.9028	1921317	CBDivE_013471	C1Cn2c(/N=C/c3ccccc3)c(nc2S1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B12	compound treatment	1.272	0.00344	0.05	1.228	0.00416	0.06	0.0729	0.9949	1084174	CBDivE_013472	COc1ccccc1NC(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B13	compound treatment	1.244	-0.0246	-0.33	1.21	-0.0138	-0.19	-0.3677	-0.9644	1921318	CBDivE_013473	O=C(N1CCCC1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B14	compound treatment	1.333	0.0644	0.87	1.284	0.0602	0.82	1.1948	0.9996	1921319	CBDivE_013474	Cc1cc(C)[n+]2ccsc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B15	compound treatment	1.259	-0.00956	-0.13	1.246	0.0222	0.3	0.1225	0.3727	1194749	CBDivE_013475	Cc1ccc(NCC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B16	compound treatment	1.264	-0.00456	-0.06	1.249	0.0252	0.34	0.1991	0.5711	1340816	CBDivE_013476	Clc1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B17	compound treatment	1.313	0.0444	0.6	1.269	0.0452	0.62	0.8594	0.9999	1366867	CBDivE_013477	COc1cccc(NC(=O)Nc2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B18	compound treatment	1.275	0.00644	0.09	1.234	0.0102	0.14	0.1594	0.9746	1009015	CBDivE_013478	CCCCCNC(=O)c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B19	compound treatment	1.258	-0.0106	-0.14	1.229	0.00516	0.07	-0.051	-0.3208	1514036	CBDivE_013479	Fc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	B20	compound treatment	1.292	0.0234	0.32	1.222	-0.00184	-0.03	0.2058	0.649	1921320	CBDivE_013480	Clc1ccc(cc1Cl)C(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C01	compound treatment	1.255	-0.0136	-0.18	1.166	-0.0578	-0.79	-0.6871	-0.8486	1921321	CBDivE_013481	COc1ncc(c(OC)n1)c2cc(nc(OC)n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C02	compound treatment	1.309	0.0404	0.55	1.269	0.0452	0.62	0.8212	0.9982	1921322	CBDivE_013482	CCN(CC)CCCNC(=O)c1sc2ccccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C03	compound treatment	1.282	0.0134	0.18	1.206	-0.0178	-0.24	-0.0438	-0.1445	1221675	CBDivE_013483	COC(C)(C)C#CC(=O)c1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C04	compound treatment	1.269	4.36E-4	0.01	1.229	0.00516	0.07	0.0539	0.7635	1590511	CBDivE_013484	O=C(N1CCCCCC1)c2ccc(cc2)C(=O)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C05	compound treatment	1.272	0.00344	0.05	1.197	-0.0268	-0.37	-0.226	-0.6127	1921323	CBDivE_013485	CC(C)C(O)(/C=C/C(O)(C(C)C)C(C)C)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C06	compound treatment	1.289	0.0204	0.28	1.245	0.0212	0.29	0.399	0.9997	1921324	CBDivE_013486	Brc1cccc(/C=N/c2ccc3nc([nH]c3c2)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C07	compound treatment	1.269	4.36E-4	0.01	1.25	0.0262	0.36	0.2564	0.7187	1921325	CBDivE_013487	CCCCOc1ccc(cc1)c2ncc(C(=O)O)c(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C08	compound treatment	1.292	0.0234	0.32	1.261	0.0372	0.51	0.5819	0.9742	1921326	CBDivE_013488	O/N=C/C(=N/O)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C09	compound treatment	1.268	-5.64E-4	-0.01	1.192	-0.0318	-0.43	-0.3124	-0.7194	1499150	CBDivE_013489	Cc1ccccc1NCC(=O)Nc2c(C)cccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C10	compound treatment	1.3	0.0314	0.42	1.276	0.0522	0.71	0.8029	0.9695	1227410	CBDivE_013490	Cc1cc(O)c(C2=Nc3ccccc3SC(C2)c4ccsc4)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C11	compound treatment	1.265	-0.00356	-0.05	1.226	0.00216	0.03	-0.0131	-0.233	1921327	CBDivE_013491	OCCSc1c(F)c(F)c(SCCO)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C12	compound treatment	1.328	0.0594	0.8	1.274	0.0502	0.68	1.0507	0.9969	1056954	CBDivE_013492	Cc1ccc(cc1)S(=O)(=O)N=S(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C13	compound treatment	1.258	-0.0106	-0.14	1.199	-0.0248	-0.34	-0.3403	-0.926	1558952	CBDivE_013493	Cc1cccc(C)c1NC(=O)CNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C14	compound treatment	1.307	0.0384	0.52	1.306	0.0822	1.12	1.1589	0.9387	1921328	CBDivE_013494	[O-][N+](=O)c1ccccc1Oc2ccccc2/C=N/n3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C15	compound treatment	1.335	0.0664	0.9	1.29	0.0662	0.9	1.2717	1.0	1921329	CBDivE_013495	Cc1cc(C)n(n1)c2nc(cc(n2)c3ccc(C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C16	compound treatment	1.324	0.0554	0.75	1.265	0.0412	0.56	0.9257	0.99	1921330	CBDivE_013496	c1ccc2c(c1)c3ccccc3c4nc5nonc5nc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C17	compound treatment	1.296	0.0274	0.37	1.195	-0.0288	-0.39	-0.0163	-0.0303	1921331	CBDivE_013497	Cc1nn(c(C)c1CC(=O)O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C18	compound treatment	1.328	0.0594	0.8	1.253	0.0292	0.4	0.8482	0.9477	1921332	CBDivE_013498	C/C(=N\NC(=S)Nc1ccccc1)/c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C19	compound treatment	1.269	4.36E-4	0.01	1.186	-0.0378	-0.52	-0.3607	-0.699	1441146	CBDivE_013499	C(N1CCN(CC1)c2ccccc2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	C20	compound treatment	1.242	-0.0266	-0.36	1.222	-0.00184	-0.03	-0.2711	-0.7547	1921333	CBDivE_013500	[O-][N+](=O)c1ccccc1/C=C/C=N/c2ccc3[nH]c(=O)[nH]c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D01	compound treatment	1.276	0.00744	0.1	1.236	0.0122	0.17	0.1882	0.971	1323467	CBDivE_013501	CC1Nc2cc3ccccc3cc2C(=O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D02	compound treatment	1.241	-0.0276	-0.37	1.171	-0.0528	-0.72	-0.7724	-0.9527	1921334	CBDivE_013502	CN(Cc1ccccc1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D03	compound treatment	1.236	-0.0326	-0.44	1.212	-0.0118	-0.16	-0.4248	-0.9076	1921335	CBDivE_013503	Fc1cccc(c1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D04	compound treatment	1.251	-0.0176	-0.24	1.214	-0.00984	-0.13	-0.2624	-0.9637	1921336	CBDivE_013504	CCCCCC(C)NC(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D05	compound treatment	1.249	-0.0196	-0.26	1.202	-0.0218	-0.3	-0.3972	-0.9982	1921337	CBDivE_013505	CCCCCC(C)NC(=O)c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D06	compound treatment	1.266	-0.00256	-0.03	1.251	0.0272	0.37	0.2375	0.6383	1921338	CBDivE_013506	Fc1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D07	compound treatment	1.267	-0.00156	-0.02	1.227	0.00316	0.04	0.0156	0.3244	1921339	CBDivE_013507	Cc1ccc(CNC(=O)c2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D08	compound treatment	1.261	-0.00756	-0.1	1.198	-0.0258	-0.35	-0.3213	-0.8759	1921340	CBDivE_013508	O=C(NCCN1CCOCC1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D09	compound treatment	1.262	-0.00656	-0.09	1.241	0.0172	0.23	0.1029	0.4111	1921341	CBDivE_013509	C(CC/N=C/c1ccc[nH]1)C/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D10	compound treatment	1.25	-0.0186	-0.25	1.216	-0.00784	-0.11	-0.2527	-0.9279	1017383	CBDivE_013510	Cc1ncc(CO)c(CN)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D11	compound treatment	1.266	-0.00256	-0.03	1.21	-0.0138	-0.19	-0.1579	-0.823	1309285	CBDivE_013511	COc1cccc(NC(=O)c2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D12	compound treatment	1.272	0.00344	0.05	1.247	0.0232	0.32	0.2561	0.8023	1921342	CBDivE_013512	CN(C)c1ccc(/C=N/NC(=O)C2=CCN(Cc3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D13	compound treatment	1.312	0.0434	0.59	1.267	0.0432	0.59	0.8305	1.0	1921343	CBDivE_013513	CC/1CCCC\C1=N\NC(=O)CCC(=O)N/N=C\2/CCCCC2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D14	compound treatment	1.298	0.0294	0.4	1.266	0.0422	0.57	0.6874	0.9837	1921344	CBDivE_013514	O=C(N/N=C/c1ccccc1)C2=CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D15	compound treatment	1.218	-0.0506	-0.68	1.173	-0.0508	-0.69	-0.9725	-1.0	1432196	CBDivE_013515	O=C(Cc1ccccc1)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D16	compound treatment	1.282	0.0134	0.18	1.235	0.0112	0.15	0.2358	0.9962	1415037	CBDivE_013516	C1CN(CCN1)C2c3ccccc3-c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D17	compound treatment	1.25	-0.0186	-0.25	1.245	0.0212	0.29	0.027	0.0706	1921345	CBDivE_013517	OC(CO/N=C(/c1ccc(Br)cc1)\c2cccnc2)CN3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D18	compound treatment	1.271	0.00244	0.03	1.202	-0.0218	-0.3	-0.1873	-0.6253	1921346	CBDivE_013518	O=C(NCCCN1CCOCC1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D19	compound treatment	1.26	-0.00856	-0.12	1.219	-0.00484	-0.07	-0.1283	-0.9647	1112707	CBDivE_013519	Clc1ccc(cc1Cl)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	D20	compound treatment	1.281	0.0124	0.17	1.229	0.00516	0.07	0.1684	0.9256	1921347	CBDivE_013520	NC(=O)NC(=O)Nc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E01	compound treatment	1.255	-0.0136	-0.18	1.189	-0.0348	-0.48	-0.4653	-0.914	1921348	CBDivE_013521	COc1ccc(cc1)C2NC(=Nc3ccc4ccccc4c23)c5cccc(OC)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E02	compound treatment	1.311	0.0424	0.57	1.319	0.0952	1.3	1.3224	0.9324	1921349	CBDivE_013522	COC(=O)NC(c1ccc(Br)cc1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E03	compound treatment	1.276	0.00744	0.1	1.223	-8.37E-4	-0.01	0.0629	0.6226	1921350	CBDivE_013523	Brc1ccc(cc1)c2cc(nc(n2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E04	compound treatment	1.279	0.0104	0.14	1.253	0.0292	0.4	0.3808	0.9025	1921351	CBDivE_013524	COc1ccc(/C=N/c2ccc3-c4ccc(\N=C\c5ccc(OC)c(Cl)c5)cc4S(=O)(=O)c3c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E05	compound treatment	1.275	0.00644	0.09	1.203	-0.0208	-0.28	-0.1395	-0.4696	1149863	CBDivE_013525	Cc1cccc(C)c1NC(=O)COc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E06	compound treatment	1.27	0.00144	0.02	1.219	-0.00484	-0.07	-0.0329	-0.4792	1921352	CBDivE_013526	Clc1ccc(/C=N/c2ccc3-c4ccc(\N=C\c5ccc(Cl)c(Cl)c5)cc4S(=O)(=O)c3c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E07	compound treatment	1.273	0.00444	0.06	1.2	-0.0238	-0.33	-0.1875	-0.5674	1921353	CBDivE_013527	CCc1ccccc1NC(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E08	compound treatment	1.28	0.0114	0.15	1.271	0.0472	0.64	0.5639	0.8525	1921354	CBDivE_013528	Oc1ccc2ccccc2c1/C=N/c3ccc4-c5ccc(\N=C\c6c(O)ccc7ccccc67)cc5S(=O)(=O)c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E09	compound treatment	1.278	0.00944	0.13	1.205	-0.0188	-0.26	-0.0916	-0.3196	1108225	CBDivE_013529	CN(C)S(=O)(=O)c1ccc(N)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E10	compound treatment	1.28	0.0114	0.15	1.249	0.0252	0.34	0.3517	0.9349	1921355	CBDivE_013530	[O-][N+](=O)c1cc(/C=N/c2ccc3-c4ccc(\N=C\c5ccc(Cl)c(c5)[N+](=O)[O-])cc4S(=O)(=O)c3c2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E11	compound treatment	1.239	-0.0296	-0.4	1.181	-0.0428	-0.58	-0.6951	-0.9827	1921356	CBDivE_013531	CCC(Br)(Br)C(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E12	compound treatment	1.294	0.0254	0.34	1.257	0.0332	0.45	0.5624	0.9907	1563406	CBDivE_013532	COc1ccccc1C2NCCc3[nH]cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E13	compound treatment	1.256	-0.0126	-0.17	1.164	-0.0598	-0.82	-0.6968	-0.8361	1626998	CBDivE_013533	CC1(C)C(CCC1(C)C(=O)O)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E14	compound treatment	1.264	-0.00456	-0.06	1.269	0.0452	0.62	0.3919	0.6333	1921357	CBDivE_013534	Brc1ccccc1C2OCC3(CO2)COC(OC3)c4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E15	compound treatment	1.265	-0.00356	-0.05	1.172	-0.0518	-0.71	-0.5338	-0.7535	1367680	CBDivE_013535	Cc1ccc(cc1)c2cc(nc(n2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E16	compound treatment	1.303	0.0344	0.46	1.272	0.0482	0.66	0.7929	0.9856	1921358	CBDivE_013536	Oc1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E17	compound treatment	1.26	-0.00856	-0.12	1.21	-0.0138	-0.19	-0.2151	-0.9723	1640925	CBDivE_013537	Cc1cc(Nc2ccc(Br)cc2)nc(n1)c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E18	compound treatment	1.286	0.0174	0.24	1.259	0.0352	0.48	0.5054	0.9463	1921359	CBDivE_013538	Fc1cccc(/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E19	compound treatment	1.254	-0.0146	-0.2	1.208	-0.0158	-0.22	-0.2916	-0.9989	1116743	CBDivE_013539	COC(=O)c1cc(Cl)c(cc1Cl)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	E20	compound treatment	1.288	0.0194	0.26	1.177	-0.0468	-0.64	-0.2662	-0.3856	1921360	CBDivE_013540	Oc1ccc(Br)cc1/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F01	compound treatment	1.232	-0.0366	-0.49	1.161	-0.0628	-0.86	-0.9547	-0.9656	1921361	CBDivE_013541	CC(C)(C)NCC(O)CO/N=C(\c1ccncc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F02	compound treatment	1.224	-0.0446	-0.6	1.201	-0.0228	-0.31	-0.6453	-0.9531	1349484	CBDivE_013542	Clc1ccc(cc1Cl)C(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F03	compound treatment	1.25	-0.0186	-0.25	1.202	-0.0218	-0.3	-0.3877	-0.9963	1275244	CBDivE_013543	COc1ccc2C(OC(=O)c2c1OC)c3ccc(O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F04	compound treatment	1.221	-0.0476	-0.64	1.199	-0.0248	-0.34	-0.6932	-0.9554	1921362	CBDivE_013544	[O-][N+](=O)c1ccc(/C=N/NC(=O)C2=CCN(Cc3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F05	compound treatment	1.274	0.00544	0.07	1.24	0.0162	0.22	0.2077	0.8942	1921363	CBDivE_013545	[O-][N+](=O)c1ccccc1C(=O)NC(Nc2ccc3ccccc3c2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F06	compound treatment	1.238	-0.0306	-0.41	1.172	-0.0518	-0.71	-0.7914	-0.9671	1712820	CBDivE_013546	O=C(NCCc1ccccc1)c2cc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F07	compound treatment	1.281	0.0124	0.17	1.25	0.0262	0.36	0.3709	0.9408	1628256	CBDivE_013547	CN(C1CCS(=O)(=O)C1)C(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F08	compound treatment	1.237	-0.0316	-0.43	1.208	-0.0158	-0.22	-0.4538	-0.9505	1593068	CBDivE_013548	CN1C(N(C)c2ccccc12)c3ccc(O)cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F09	compound treatment	1.238	-0.0306	-0.41	1.208	-0.0158	-0.22	-0.4443	-0.9545	1206220	CBDivE_013549	Cc1ccc(CCSc2cc(c(F)c(c2)C(C)(C)C)C(C)(C)C)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F10	compound treatment	1.317	0.0484	0.65	1.273	0.0492	0.67	0.9361	0.9999	1647796	CBDivE_013550	Cc1ccc(cc1)S(=O)(=O)CCc2nnc(N)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F11	compound treatment	1.322	0.0534	0.72	1.304	0.0802	1.09	1.2827	0.9796	1411949	CBDivE_013551	COc1ccc(cc1)c2csc(=Nc3ccccc3)n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F12	compound treatment	1.317	0.0484	0.65	1.277	0.0532	0.72	0.9747	0.9987	1921364	CBDivE_013552	Cn1c(CO)c(c2ccccc2)c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F13	compound treatment	1.263	-0.00556	-0.08	1.236	0.0122	0.17	0.0642	0.3526	1921365	CBDivE_013553	CC(=C)CNC(=S)Nc1nccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F14	compound treatment	1.266	-0.00256	-0.03	1.21	-0.0138	-0.19	-0.1579	-0.823	1679677	CBDivE_013554	OC(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)c3ccc(cc3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F15	compound treatment	1.226	-0.0426	-0.57	1.242	0.0182	0.25	-0.2309	-0.3692	1921366	CBDivE_013555	Cc1cccc(CC2S/C(=N/N=C/c3cccc(C)c3)/NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F16	compound treatment	1.274	0.00544	0.07	1.249	0.0252	0.34	0.2945	0.8393	1921367	CBDivE_013556	COc1ccc(cc1)n2c(C)c([N+](=O)[O-])c3ccc(OC(=O)C)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F17	compound treatment	1.214	-0.0546	-0.74	1.161	-0.0628	-0.86	-1.1264	-0.9971	1736004	CBDivE_013557	COc1nc(Nc2ccccc2)nc(n1)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F18	compound treatment	1.301	0.0324	0.44	1.237	0.0132	0.18	0.4363	0.9226	1089954	CBDivE_013558	OC(=O)c1ccc(Oc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F19	compound treatment	1.255	-0.0136	-0.18	1.205	-0.0188	-0.26	-0.311	-0.9862	1776739	CBDivE_013559	[O-][N+](=O)c1ccc2[nH]c3c(cccc3c2c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	F20	compound treatment	1.255	-0.0136	-0.18	1.256	0.0322	0.44	0.1807	0.3803	1921368	CBDivE_013560	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G01	compound treatment	1.256	-0.0126	-0.17	1.155	-0.0688	-0.94	-0.7836	-0.8215	1921369	CBDivE_013561	C/C(=N\NC(=S)N1CCOCC1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G02	compound treatment	1.256	-0.0126	-0.17	1.254	0.0302	0.41	0.171	0.3844	1921370	CBDivE_013562	Clc1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G03	compound treatment	1.246	-0.0226	-0.3	1.181	-0.0428	-0.58	-0.6283	-0.9538	1566843	CBDivE_013563	COc1cc(CN2CCN(CC2)c3ccccc3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G04	compound treatment	1.242	-0.0266	-0.36	1.198	-0.0258	-0.35	-0.5025	-1.0	1244650	CBDivE_013564	OC(=O)CN1CC(CC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G05	compound treatment	1.229	-0.0396	-0.53	1.167	-0.0568	-0.78	-0.9255	-0.9834	1921371	CBDivE_013565	CCOC(=O)CCCCCCSc1nc(C)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G06	compound treatment	1.273	0.00444	0.06	1.258	0.0342	0.47	0.3717	0.7914	1921372	CBDivE_013566	[O-][N+](=O)c1ccccc1/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G07	compound treatment	1.272	0.00344	0.05	1.226	0.00216	0.03	0.0536	0.9762	1921373	CBDivE_013567	CCC/C(=N\OCC)/C1=C(C(=O)OC)C(C)(C)CC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G08	compound treatment	1.281	0.0124	0.17	1.245	0.0212	0.29	0.3227	0.9667	1169079	CBDivE_013568	Clc1c(sc2ccccc12)C(=O)NC3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G09	compound treatment	1.247	-0.0216	-0.29	1.193	-0.0308	-0.42	-0.5031	-0.9838	1921374	CBDivE_013569	CC(=CCCC1(C)Oc2ccc(C(=O)C)c(O)c2C=C1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G10	compound treatment	1.276	0.00744	0.1	1.259	0.0352	0.48	0.41	0.8369	1187637	CBDivE_013570	OC(C#CC(O)(c1ccccc1)c2ccccc2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G11	compound treatment	1.276	0.00744	0.1	1.186	-0.0378	-0.52	-0.2939	-0.5592	1620705	CBDivE_013571	CC1CC2=C(CC1(CO)CO)C(C)(C)CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G12	compound treatment	1.304	0.0354	0.48	1.272	0.0482	0.66	0.8024	0.9878	1921375	CBDivE_013572	CCCCCCNS(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G13	compound treatment	1.214	-0.0546	-0.74	1.174	-0.0498	-0.68	-1.0011	-0.9992	1264671	CBDivE_013573	CC(C)(C)C1CCC(CC1)OC(=O)C2CC=CCC2C(=O)OCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G14	compound treatment	1.334	0.0654	0.88	1.326	0.102	1.39	1.6093	0.9758	1620680	CBDivE_013574	O=C(NC1CCC(CC1)NC(=O)c2ccncc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G15	compound treatment	1.285	0.0164	0.22	1.222	-0.00184	-0.03	0.1391	0.6233	1371471	CBDivE_013575	CN(C)CC(O)COc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G16	compound treatment	1.278	0.00944	0.13	1.266	0.0422	0.57	0.4966	0.8432	1921376	CBDivE_013576	O=C(N/N=C/c1ccccc1)c2ccc(o2)C(=O)N/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G17	compound treatment	1.306	0.0374	0.51	1.234	0.0102	0.14	0.4551	0.869	1921377	CBDivE_013577	OC(=O)C1CC=CCC1C(=O)OCC(=C(Cl)Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G18	compound treatment	1.296	0.0274	0.37	1.287	0.0632	0.86	0.8708	0.9288	1921378	CBDivE_013578	FC(F)(F)C1CC2CC1CC2/C=N/NC(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G19	compound treatment	1.318	0.0494	0.67	1.289	0.0652	0.89	1.0999	0.99	1921379	CBDivE_013579	C/C(=N/OC(=O)C1CC21CCC2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	G20	compound treatment	1.302	0.0334	0.45	1.284	0.0602	0.82	0.8991	0.9603	1623817	CBDivE_013580	COc1ccc2c(Cl)c(sc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H01	compound treatment	1.218	-0.0506	-0.68	1.174	-0.0498	-0.68	-0.9629	-1.0	1495176	CBDivE_013581	NNC(=O)CCn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H02	compound treatment	1.233	-0.0356	-0.48	1.213	-0.0108	-0.15	-0.4438	-0.8839	1186	CBDivE_013582	Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H03	compound treatment	1.229	-0.0396	-0.53	1.175	-0.0488	-0.67	-0.8483	-0.994	1024926	CBDivE_013583	C1CN(CCN1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H04	compound treatment	1.234	-0.0346	-0.47	1.189	-0.0348	-0.48	-0.6656	-1.0	1921380	CBDivE_013584	Brc1ccc(o1)C(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H05	compound treatment	1.287	0.0184	0.25	1.271	0.0472	0.64	0.6306	0.9146	1203135	CBDivE_013585	NNC(=O)CCn1c2ccc(Cl)cc2c3cc(Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H06	compound treatment	1.232	-0.0366	-0.49	1.185	-0.0388	-0.53	-0.7233	-0.9994	1485334	CBDivE_013586	O=C(N1CCCN(CC1)C(=O)c2ccco2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H07	compound treatment	1.262	-0.00656	-0.09	1.227	0.00316	0.04	-0.0321	-0.3261	1024926	CBDivE_013587	C1CN(CCN1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H08	compound treatment	1.242	-0.0266	-0.36	1.206	-0.0178	-0.24	-0.4254	-0.9822	1657344	CBDivE_013588	Fc1cccc(c1)C(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H09	compound treatment	1.246	-0.0226	-0.3	1.191	-0.0328	-0.45	-0.5319	-0.9823	1921381	CBDivE_013589	CCOc1ccc(/C=C/[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H10	compound treatment	1.243	-0.0256	-0.34	1.226	0.00216	0.03	-0.223	-0.6443	1921382	CBDivE_013590	O=C(Cc1ccccc1)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H11	compound treatment	1.261	-0.00756	-0.1	1.225	0.00116	0.02	-0.0609	-0.5901	1921383	CBDivE_013591	C/C(=C\c1ccc(Cl)cc1)/[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H12	compound treatment	1.25	-0.0186	-0.25	1.209	-0.0148	-0.2	-0.3202	-0.9944	1921384	CBDivE_013592	Cc1ccc(NCC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H13	compound treatment	1.307	0.0384	0.52	1.278	0.0542	0.74	0.8889	0.985	1921385	CBDivE_013593	CCNC(=O)NN=c1sc2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H14	compound treatment	1.277	0.00844	0.11	1.243	0.0192	0.26	0.2652	0.9306	1921386	CBDivE_013594	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)CCCOc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H15	compound treatment	1.25	-0.0186	-0.25	1.179	-0.0448	-0.61	-0.6094	-0.9224	1345762	CBDivE_013595	OCN1C(=O)c2ccc(F)cc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H16	compound treatment	1.252	-0.0166	-0.22	1.191	-0.0328	-0.45	-0.4746	-0.9484	1921387	CBDivE_013596	COCCCNC(=C1C(=O)c2ccccc2C1=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H17	compound treatment	1.204	-0.0646	-0.87	1.163	-0.0608	-0.83	-1.2025	-0.9997	1921388	CBDivE_013597	COc1ccccc1NC(=C2C(=O)N(C)C(=O)N(C)C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H18	compound treatment	1.238	-0.0306	-0.41	1.202	-0.0218	-0.3	-0.5021	-0.9872	1291441	CBDivE_013598	Fc1ccccc1C(=O)Nc2nc3ccccc3n2CCN4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H19	compound treatment	1.231	-0.0376	-0.51	1.201	-0.0228	-0.31	-0.5785	-0.9727	1921389	CBDivE_013599	COC(=O)c1ccccc1NC=C2C(=O)N(C)C(=O)N(C)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	H20	compound treatment	1.282	0.0134	0.18	1.271	0.0472	0.64	0.5829	0.8724	1363114	CBDivE_013600	CCC(=O)Nc1nc2ccccc2n1CCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I01	compound treatment	1.255	-0.0136	-0.18	1.231	0.00716	0.1	-0.0603	-0.2908	1921390	CBDivE_013601	CNN=C1c2nn(Cc3ccccc3)nc2C(=NNC)c4nn(Cc5ccccc5)nc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I02	compound treatment	1.282	0.0134	0.18	1.27	0.0462	0.63	0.5733	0.8752	1921391	CBDivE_013602	Clc1ccc(cc1Cl)C(=O)N/N=C/C2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I03	compound treatment	1.264	-0.00456	-0.06	1.22	-0.00384	-0.05	-0.0805	-0.9967	1399679	CBDivE_013603	Cc1ccc(NC(=O)C2CC=CCC2C(=O)OCC3CCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I04	compound treatment	1.242	-0.0266	-0.36	1.245	0.0212	0.29	-0.0493	-0.1072	1921392	CBDivE_013604	Brc1ccc(o1)C(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I05	compound treatment	1.302	0.0334	0.45	1.278	0.0542	0.74	0.8412	0.972	1921393	CBDivE_013605	CN1CCOCCOCCOCCOCCOCCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I06	compound treatment	1.237	-0.0316	-0.43	1.209	-0.0148	-0.2	-0.4442	-0.9421	1280971	CBDivE_013606	Clc1ccc(cc1)C(=O)Nc2ccc3-c4ccc(NC(=O)c5ccc(Cl)cc5)cc4S(=O)(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I07	compound treatment	1.283	0.0144	0.19	1.189	-0.0348	-0.48	-0.1982	-0.386	1921394	CBDivE_013607	FC(F)(F)COP(=O)(OCC(F)(F)F)OC(c1ccccc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I08	compound treatment	1.252	-0.0166	-0.22	1.238	0.0142	0.19	-0.0214	-0.0726	1921395	CBDivE_013608	O=C(N/N=C/C1CC2CCC1C2)C3CC4CCC3C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I09	compound treatment	1.267	-0.00156	-0.02	1.184	-0.0398	-0.54	-0.399	-0.734	1921396	CBDivE_013609	Brc1ccc(NC(=O)C2CC=CCC2C(=O)OCC3CCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I10	compound treatment	1.273	0.00444	0.06	1.258	0.0342	0.47	0.3717	0.7914	1921397	CBDivE_013610	Fc1cccc(c1)c2nc3cc(/N=C/C=C/c4ccc(Br)cc4)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I11	compound treatment	1.263	-0.00556	-0.08	1.179	-0.0448	-0.61	-0.4854	-0.788	1921398	CBDivE_013611	CC(O)CC(C)(C)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I12	compound treatment	1.301	0.0324	0.44	1.235	0.0112	0.15	0.4171	0.9002	1341347	CBDivE_013612	Clc1ccc(C(=O)Nc2ccc3-c4ccc(NC(=O)c5ccc(Cl)cc5Cl)cc4S(=O)(=O)c3c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I13	compound treatment	1.329	0.0604	0.82	1.253	0.0292	0.4	0.8577	0.9455	1921399	CBDivE_013613	[O-][N+](=O)c1ccc(Nc2ccccc2Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I14	compound treatment	1.272	0.00344	0.05	1.226	0.00216	0.03	0.0536	0.9762	1921400	CBDivE_013614	FC(F)(F)C1CC2CC(/C=N/NC(=O)c3cccc4ccccc34)C1C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I15	compound treatment	1.258	-0.0106	-0.14	1.165	-0.0588	-0.8	-0.6681	-0.8199	1921401	CBDivE_013615	Clc1ccccc1/C=N/Nc2cc(nc(n2)c3ccc(Br)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I16	compound treatment	1.263	-0.00556	-0.08	1.257	0.0332	0.45	0.2667	0.5818	1921402	CBDivE_013616	[O-][N+](=O)c1cc2OCOc2cc1/C=N/c3ccc4-c5ccc(\N=C\c6cc7OCOc7cc6[N+](=O)[O-])cc5S(=O)(=O)c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I17	compound treatment	1.304	0.0354	0.48	1.208	-0.0158	-0.22	0.1853	0.3533	1921403	CBDivE_013617	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I18	compound treatment	1.278	0.00944	0.13	1.251	0.0272	0.37	0.3519	0.8985	1212195	CBDivE_013618	Clc1ccc(cc1Cl)C(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I19	compound treatment	1.259	-0.00956	-0.13	1.184	-0.0398	-0.54	-0.4754	-0.8514	1921404	CBDivE_013619	Clc1cccc(/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	I20	compound treatment	1.268	-5.64E-4	-0.01	1.235	0.0112	0.15	0.1023	0.6709	1921405	CBDivE_013620	CCCCNC(=O)c1cccc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J01	compound treatment	1.28	0.0114	0.15	1.193	-0.0308	-0.42	-0.1883	-0.4203	1921406	CBDivE_013621	CN1C(=O)NC(=O)/C(=C\C=C\c2ccccc2)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J02	compound treatment	1.261	-0.00756	-0.1	1.221	-0.00284	-0.04	-0.0995	-0.9118	1921246	CBDivE_013622	Cc1cc(C)c(NC(=O)CN2CCN3CCCC3C2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J03	compound treatment	1.262	-0.00656	-0.09	1.233	0.00916	0.12	0.0257	0.168	1193592	CBDivE_013623	CC(Nc1cccc(Cl)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J04	compound treatment	1.234	-0.0346	-0.47	1.197	-0.0268	-0.37	-0.5885	-0.9928	1921407	CBDivE_013624	C/C(=N/NS(=O)(=O)c1ccc(C)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J05	compound treatment	1.258	-0.0106	-0.14	1.21	-0.0138	-0.19	-0.2342	-0.9904	1711600	CBDivE_013625	CCCC(Nc1cccc(Cl)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J06	compound treatment	1.242	-0.0266	-0.36	1.205	-0.0188	-0.26	-0.435	-0.9867	1921408	CBDivE_013626	Clc1cccc(NC(=O)N2CCOCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J07	compound treatment	1.242	-0.0266	-0.36	1.212	-0.0118	-0.16	-0.3675	-0.9351	1150476	CBDivE_013627	CC(C)C(Nc1cccc(Cl)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J08	compound treatment	1.279	0.0104	0.14	1.206	-0.0178	-0.24	-0.0724	-0.2578	1921409	CBDivE_013628	C/C(=N\Nc1ccccc1)/C(=N\O)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J09	compound treatment	1.256	-0.0126	-0.17	1.24	0.0162	0.22	0.036	0.1295	1921410	CBDivE_013629	CCOC(=O)CSc1cn2CCCc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J10	compound treatment	1.231	-0.0376	-0.51	1.193	-0.0308	-0.42	-0.6557	-0.9957	1921411	CBDivE_013630	COc1cccc(/C=N/NC(=N)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J11	compound treatment	1.278	0.00944	0.13	1.232	0.00816	0.11	0.1687	0.9978	1434827	CBDivE_013631	CC(C)C(Nc1ccc(C)cc1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J12	compound treatment	1.265	-0.00356	-0.05	1.179	-0.0448	-0.61	-0.4663	-0.7604	1921412	CBDivE_013632	NC(=S)N/N=C/c1ccc(o1)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J13	compound treatment	1.25	-0.0186	-0.25	1.199	-0.0248	-0.34	-0.4166	-0.989	1075924	CBDivE_013633	Fc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J14	compound treatment	1.223	-0.0456	-0.61	1.174	-0.0498	-0.68	-0.9152	-0.9987	1921413	CBDivE_013634	CC(=O)Nc1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J15	compound treatment	1.279	0.0104	0.14	1.227	0.00316	0.04	0.13	0.8832	1921414	CBDivE_013635	CC1CCCC(C)N1C(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J16	compound treatment	1.248	-0.0206	-0.28	1.163	-0.0608	-0.83	-0.7828	-0.8949	1921415	CBDivE_013636	O=C(C(c1ccccc1)c2ccccc2)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J17	compound treatment	1.246	-0.0226	-0.3	1.18	-0.0438	-0.6	-0.6379	-0.951	1921416	CBDivE_013637	COc1ccccc1NC(=O)/C=C/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J18	compound treatment	1.293	0.0244	0.33	1.225	0.00116	0.02	0.2443	0.7403	1921417	CBDivE_013638	CC(C)N(C(C)C)C(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J19	compound treatment	1.254	-0.0146	-0.2	1.212	-0.0118	-0.16	-0.2531	-0.9952	1083862	CBDivE_013639	CCOc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	J20	compound treatment	1.27	0.00144	0.02	1.179	-0.0448	-0.61	-0.4186	-0.6844	1921418	CBDivE_013640	CC(C)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K01	compound treatment	1.29	0.0214	0.29	1.221	-0.00284	-0.04	0.1771	0.6071	1921419	CBDivE_013641	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K02	compound treatment	1.278	0.00944	0.13	1.231	0.00716	0.1	0.1591	0.9914	1921420	CBDivE_013642	OC(=O)/C=C/1\OC(=O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K03	compound treatment	1.264	-0.00456	-0.06	1.216	-0.00784	-0.11	-0.1191	-0.9657	1601307	CBDivE_013643	Clc1ccc(cc1)S(=O)(=O)N(C(=O)c2ccccc2)c3ccccc3OC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K04	compound treatment	1.26	-0.00856	-0.12	1.208	-0.0158	-0.22	-0.2344	-0.957	1685225	CBDivE_013644	C1Cc2c([nH]c3ccccc23)-c4nonc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K05	compound treatment	1.281	0.0124	0.17	1.212	-0.0118	-0.16	0.0045	0.0193	1921421	CBDivE_013645	CCCN(CCC)S(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K06	compound treatment	1.293	0.0244	0.33	1.296	0.0722	0.98	0.9289	0.8951	1921422	CBDivE_013646	COc1ccc(/C=N/Cc2ccccc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K07	compound treatment	1.236	-0.0326	-0.44	1.18	-0.0438	-0.6	-0.7333	-0.9885	1921423	CBDivE_013647	CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K08	compound treatment	1.265	-0.00356	-0.05	1.232	0.00816	0.11	0.0447	0.3687	1921424	CBDivE_013648	CCCCC/C(=N\NC(=O)c1ccccc1I)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K09	compound treatment	1.23	-0.0386	-0.52	1.173	-0.0508	-0.69	-0.8581	-0.99	1303796	CBDivE_013649	COc1ccccc1NC(=O)CCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K10	compound treatment	1.278	0.00944	0.13	1.268	0.0442	0.6	0.5158	0.8381	1921425	CBDivE_013650	CCCC/C(=N\NC(=O)c1ccccc1I)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K11	compound treatment	1.263	-0.00556	-0.08	1.18	-0.0438	-0.6	-0.4758	-0.7897	1708709	CBDivE_013651	Nc1ccc(C2=CCCc3nonc23)c4nonc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K12	compound treatment	1.29	0.0214	0.29	1.249	0.0252	0.34	0.4471	0.9964	1921426	CBDivE_013652	COc1ccccc1N2C(=O)CC(N3CCOCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K13	compound treatment	1.282	0.0134	0.18	1.212	-0.0118	-0.16	0.014	0.0578	1178621	CBDivE_013653	COn1c2CCCCc2c3c1ccc4nonc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K14	compound treatment	1.357	0.0884	1.19	1.314	0.0902	1.23	1.713	0.9999	1713929	CBDivE_013654	O=C(Nn1cnnc1)c2ccc(cc2)C(=O)Nn3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K15	compound treatment	1.306	0.0374	0.51	1.171	-0.0528	-0.72	-0.1524	-0.1732	1360440	CBDivE_013655	c1c([nH]c2ccc3nonc3c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K16	compound treatment	1.316	0.0474	0.64	1.243	0.0192	0.26	0.6373	0.9219	1921427	CBDivE_013656	CCOC(=O)C(Cc1ccccc1)/C(=N\Nc2nc3ccccc3[nH]c2=S)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K17	compound treatment	1.331	0.0624	0.84	1.212	-0.0118	-0.16	0.4815	0.5614	1921428	CBDivE_013657	c1ccc(cc1)c2nn(c3ccccc3)c4ncc5[nH]c6ccccc6c5c24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K18	compound treatment	1.294	0.0254	0.34	1.254	0.0302	0.41	0.5335	0.9959	1921429	CBDivE_013658	Cc1cc(C)[n+]2cc(Br)ccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K19	compound treatment	1.27	0.00144	0.02	1.205	-0.0188	-0.26	-0.1679	-0.6519	1921430	CBDivE_013659	CN(/N=C/c1cccnc1)c2cc(nc(n2)c3ccc(Br)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	K20	compound treatment	1.299	0.0304	0.41	1.249	0.0252	0.34	0.533	0.996	3021871	CBDivE_013660	CC[n+]1c(C)sc2cc(C)ccc12.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L01	compound treatment	1.267	-0.00156	-0.02	1.235	0.0112	0.15	0.0927	0.6033	1648063	CBDivE_013661	Clc1ccc(cc1)S(=O)(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L02	compound treatment	1.253	-0.0156	-0.21	1.205	-0.0188	-0.26	-0.3301	-0.995	1921432	CBDivE_013662	COc1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L03	compound treatment	1.258	-0.0106	-0.14	1.213	-0.0108	-0.15	-0.2053	-0.9998	1184291	CBDivE_013663	COc1ccc(CC(=O)Nc2c(C)cccc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L04	compound treatment	1.249	-0.0196	-0.26	1.194	-0.0298	-0.41	-0.4743	-0.978	1921433	CBDivE_013664	Cc1ccc(cc1[N+](=O)[O-])C2(CC3CC4CC(Br)(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L05	compound treatment	1.241	-0.0276	-0.37	1.186	-0.0378	-0.52	-0.6278	-0.9871	1921434	CBDivE_013665	FC(F)(F)c1cccc(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L06	compound treatment	1.286	0.0174	0.24	1.234	0.0102	0.14	0.2643	0.9682	1921435	CBDivE_013666	Clc1ccccc1NC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L07	compound treatment	1.254	-0.0146	-0.2	1.206	-0.0178	-0.24	-0.3109	-0.9944	1921436	CBDivE_013667	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L08	compound treatment	1.209	-0.0596	-0.8	1.137	-0.0868	-1.18	-1.4055	-0.9822	1489814	CBDivE_013668	Cc1nc2ccccc2n1S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L09	compound treatment	1.261	-0.00756	-0.1	1.243	0.0192	0.26	0.1126	0.4014	1556917	CBDivE_013669	Fc1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L10	compound treatment	1.251	-0.0176	-0.24	1.156	-0.0678	-0.93	-0.8217	-0.8605	1210854	CBDivE_013670	CCc1ccccc1NC(=O)COc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L11	compound treatment	1.204	-0.0646	-0.87	1.149	-0.0748	-1.02	-1.3375	-0.9969	1921437	CBDivE_013671	Cc1c(C(=O)/C=C/c2ccccc2Cl)c3cc(O)ccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L12	compound treatment	1.257	-0.0116	-0.16	1.234	0.0102	0.14	-0.0123	-0.059	1304026	CBDivE_013672	CCOc1ccc(NC(=O)Cc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L13	compound treatment	1.321	0.0524	0.71	1.256	0.0322	0.44	0.8103	0.9736	1921438	CBDivE_013673	Cc1c(C(=O)/C=C/c2ccccc2F)c3cc(O)ccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L14	compound treatment	1.279	0.0104	0.14	1.231	0.00716	0.1	0.1686	0.9841	1297852	CBDivE_013674	CCN(C(=O)COc1ccc(Cl)cc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L15	compound treatment	1.224	-0.0446	-0.6	1.173	-0.0508	-0.69	-0.9153	-0.9975	1207405	CBDivE_013675	CC(C)C(Nc1ccccc1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L16	compound treatment	1.277	0.00844	0.11	1.209	-0.0148	-0.2	-0.0626	-0.2696	1617839	CBDivE_013676	COC(=O)c1ccc(NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L17	compound treatment	1.282	0.0134	0.18	1.228	0.00416	0.06	0.1683	0.8861	1921439	CBDivE_013677	CC(Nc1cccc(Br)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L18	compound treatment	1.243	-0.0256	-0.34	1.141	-0.0828	-1.13	-1.0426	-0.8828	1921440	CBDivE_013678	O=C(N1CCOCC1)c2ccc(cc2)C(=O)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L19	compound treatment	1.222	-0.0466	-0.63	1.163	-0.0608	-0.83	-1.0308	-0.9906	1152769	CBDivE_013679	CCCC(Nc1ccccc1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	L20	compound treatment	1.276	0.00744	0.1	1.209	-0.0148	-0.2	-0.0721	-0.3194	1921441	CBDivE_013680	CC(C)c1ccc(NC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M01	compound treatment	1.311	0.0424	0.57	1.317	0.0932	1.27	1.3031	0.9352	1921442	CBDivE_013681	Oc1ccc(/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M02	compound treatment	1.223	-0.0456	-0.61	1.259	0.0352	0.48	-0.0956	-0.1226	1921443	CBDivE_013682	O=C1C2C(N(CN3C(C1C3c4ccccc4)c5ccccc5)C2c6ccccc6)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M03	compound treatment	1.256	-0.0126	-0.17	1.229	0.00516	0.07	-0.0701	-0.3818	1921444	CBDivE_013683	[O-][N+](=O)c1ccccc1/C=N\Nc2nc(cc(n2)c3ccc(F)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M04	compound treatment	1.26	-0.00856	-0.12	1.278	0.0542	0.74	0.4406	0.5893	1117903	CBDivE_013684	Cc1cc(cc(C)c1O)c2ncccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M05	compound treatment	1.243	-0.0256	-0.34	1.204	-0.0198	-0.27	-0.4351	-0.9928	1921445	CBDivE_013685	Oc1ccccc1/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M06	compound treatment	1.248	-0.0206	-0.28	1.199	-0.0248	-0.34	-0.4357	-0.9951	1921446	CBDivE_013686	CC1=CC(=O)N(CCc2c[nH]c3ccc(OCc4ccccc4)cc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M07	compound treatment	1.249	-0.0196	-0.26	1.19	-0.0338	-0.46	-0.5129	-0.9649	1921447	CBDivE_013687	O(c1ccccc1)c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M08	compound treatment	1.274	0.00544	0.07	1.237	0.0132	0.18	0.1788	0.922	1182564	CBDivE_013688	COc1ccc(OC)c(c1)C2CC(=NCCS2)c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M09	compound treatment	1.264	-0.00456	-0.06	1.235	0.0112	0.15	0.0641	0.3904	1921448	CBDivE_013689	CN(N)c1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M10	compound treatment	1.272	0.00344	0.05	1.235	0.0112	0.15	0.1404	0.8824	1373167	CBDivE_013690	COc1cccc(C2CC(=NCCS2)c3c(O)cc(C)oc3=O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M11	compound treatment	1.278	0.00944	0.13	1.197	-0.0268	-0.37	-0.1688	-0.4356	1921449	CBDivE_013691	Oc1ccc(I)nc1c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M12	compound treatment	1.269	4.36E-4	0.01	1.255	0.0312	0.42	0.3046	0.7168	1921450	CBDivE_013692	OCCSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M13	compound treatment	1.263	-0.00556	-0.08	1.206	-0.0178	-0.24	-0.2251	-0.8842	1222359	CBDivE_013693	Clc1c(sc2ccccc12)C(=O)NCCN3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M14	compound treatment	1.319	0.0504	0.68	1.303	0.0792	1.08	1.2444	0.9752	1921451	CBDivE_013694	CC(C)NS(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M15	compound treatment	1.267	-0.00156	-0.02	1.228	0.00416	0.06	0.0252	0.4164	1921452	CBDivE_013695	CN1CCN(CCCNC(=O)c2sc3ccccc3c2Cl)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M16	compound treatment	1.278	0.00944	0.13	1.238	0.0142	0.19	0.2266	0.9795	1333995	CBDivE_013696	c1ccc2c(c1)[nH]c3c2ccc4nonc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M17	compound treatment	1.265	-0.00356	-0.05	1.221	-0.00284	-0.04	-0.0614	-0.9942	1634239	CBDivE_013697	O=C(CCCC(=O)Nc1cccc2ccccc12)Nc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M18	compound treatment	1.261	-0.00756	-0.1	1.223	-8.37E-4	-0.01	-0.0802	-0.7813	1179680	CBDivE_013698	CCOC(=O)c1c(C)nc(C)cc1N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M19	compound treatment	1.253	-0.0156	-0.21	1.2	-0.0238	-0.33	-0.3783	-0.9776	1775207	CBDivE_013699	COc1ccc(cc1)N2CCN(C2c3ccc(cc3)[N+](=O)[O-])c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	M20	compound treatment	1.29	0.0214	0.29	1.273	0.0492	0.67	0.6785	0.9293	1679488	CBDivE_013700	COc1ccc2[nH]cc(CCN(Cc3ccccc3)Cc4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N01	compound treatment	1.236	-0.0326	-0.44	1.268	0.0442	0.6	0.1152	0.1545	1921453	CBDivE_013701	Brc1cccc(NCN2C(=O)CCC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N02	compound treatment	1.239	-0.0296	-0.4	1.202	-0.0218	-0.3	-0.4926	-0.9896	1126384	CBDivE_013702	CCOc1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N03	compound treatment	1.214	-0.0546	-0.74	1.153	-0.0708	-0.97	-1.2035	-0.991	1672744	CBDivE_013703	O=C1CCC(=O)N1CNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N04	compound treatment	1.228	-0.0406	-0.55	1.183	-0.0408	-0.56	-0.7807	-1.0	1921454	CBDivE_013704	Brc1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N05	compound treatment	1.246	-0.0226	-0.3	1.194	-0.0298	-0.41	-0.5029	-0.9898	1147350	CBDivE_013705	Clc1cccc(NCN2C(=O)CCC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N06	compound treatment	1.208	-0.0606	-0.82	1.156	-0.0678	-0.93	-1.2319	-0.9981	1291293	CBDivE_013706	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N07	compound treatment	1.229	-0.0396	-0.53	1.21	-0.0138	-0.19	-0.5108	-0.9024	1293583	CBDivE_013707	CC(Nc1ccccc1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N08	compound treatment	1.192	-0.0766	-1.03	1.184	-0.0398	-0.54	-1.1145	-0.955	1921455	CBDivE_013708	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)/C=C/c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N09	compound treatment	1.208	-0.0606	-0.82	1.208	-0.0158	-0.22	-0.7304	-0.8643	1921456	CBDivE_013709	CC(C)C(Nc1cccc(Br)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N10	compound treatment	1.244	-0.0246	-0.33	1.211	-0.0128	-0.18	-0.3581	-0.9555	1131321	CBDivE_013710	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N11	compound treatment	1.235	-0.0336	-0.45	1.188	-0.0358	-0.49	-0.6657	-0.9993	1921457	CBDivE_013711	CCCC(Nc1cccc(Br)c1)N2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N12	compound treatment	1.256	-0.0126	-0.17	1.185	-0.0388	-0.53	-0.4943	-0.889	1484155	CBDivE_013712	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N13	compound treatment	1.266	-0.00256	-0.03	1.233	0.00916	0.12	0.0639	0.4928	1921458	CBDivE_013713	[O-][N+](=O)c1cccc(/C=C/C(=O)N2CCCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N14	compound treatment	1.246	-0.0226	-0.3	1.194	-0.0298	-0.41	-0.5029	-0.9898	1457185	CBDivE_013714	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N15	compound treatment	1.213	-0.0556	-0.75	1.168	-0.0558	-0.76	-1.0684	-1.0	1461686	CBDivE_013715	CC(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N16	compound treatment	1.267	-0.00156	-0.02	1.187	-0.0368	-0.5	-0.3701	-0.7362	1433723	CBDivE_013716	CC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N17	compound treatment	1.23	-0.0386	-0.52	1.162	-0.0618	-0.84	-0.9641	-0.9731	1880443	CBDivE_013717	CC(C)c1ccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N18	compound treatment	1.277	0.00844	0.11	1.205	-0.0188	-0.26	-0.1012	-0.3601	1732977	CBDivE_013718	CC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(Cl)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N19	compound treatment	1.259	-0.00956	-0.13	1.247	0.0232	0.32	0.1321	0.3872	1921459	CBDivE_013719	CC(C)C[N+](=NOCON=[N+]([O-])CC(C)C)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	N20	compound treatment	1.279	0.0104	0.14	1.215	-0.00884	-0.12	0.0143	0.0774	1725540	CBDivE_013720	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O01	compound treatment	1.291	0.0224	0.3	1.245	0.0212	0.29	0.4181	0.9997	1921460	CBDivE_013721	COc1ccc(cc1Br)c2nc3cc(/N=C/C=C/c4ccccc4[N+](=O)[O-])ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O02	compound treatment	1.317	0.0484	0.65	1.309	0.0852	1.16	1.2832	0.963	1614912	CBDivE_013722	C1Cc2nnc(cc2-c3nonc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O03	compound treatment	1.318	0.0494	0.67	1.273	0.0492	0.67	0.9456	1.0	1921461	CBDivE_013723	COc1ccc(cc1Br)c2nc3cc(/N=C/c4c5ccccc5cc6ccccc46)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O04	compound treatment	1.32	0.0514	0.69	1.288	0.0642	0.87	1.1093	0.9934	1561364	CBDivE_013724	COC1(OC)c2nonc2C(OC)(OC)c3nonc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O05	compound treatment	1.332	0.0634	0.86	1.258	0.0342	0.47	0.9345	0.9591	1921462	CBDivE_013725	Cc1ccc(OCC(=O)N/N=C/c2ccc(O)c(I)c2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O06	compound treatment	1.257	-0.0116	-0.16	1.215	-0.00884	-0.12	-0.1955	-0.9919	1921463	CBDivE_013726	Cc1ccc2c(c1)c3CCCc4nccn2c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O07	compound treatment	1.266	-0.00256	-0.03	1.226	0.00216	0.03	-0.0036	-0.0793	1921464	CBDivE_013727	COc1cc(Br)cc(/C=N/c2ccc3-c4ccc(\N=C\c5cc(Br)cc(OC)c5O)cc4S(=O)(=O)c3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O08	compound treatment	1.277	0.00844	0.11	1.21	-0.0138	-0.19	-0.053	-0.2403	1921465	CBDivE_013728	CN(C)CCCO/N=C(\c1ccccc1)/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O09	compound treatment	1.318	0.0494	0.67	1.308	0.0842	1.15	1.2831	0.9666	1921466	CBDivE_013729	Clc1ccc(/C=C/C=N/c2cccc(c2)c3nc4ccccc4s3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O10	compound treatment	1.303	0.0344	0.46	1.263	0.0392	0.53	0.7061	0.9976	1921467	CBDivE_013730	CN(C)/C=N/c1ccc2nonc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O11	compound treatment	1.272	0.00344	0.05	1.202	-0.0218	-0.3	-0.1778	-0.5899	1921468	CBDivE_013731	COc1cccc(/C=N/c2ccc3-c4ccc(\N=C\c5cccc(OC)c5O)cc4S(=O)(=O)c3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O12	compound treatment	1.308	0.0394	0.53	1.293	0.0692	0.94	1.0431	0.9633	1676721	CBDivE_013732	CN1CC(=Cc2c1ccc3nonc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O13	compound treatment	1.28	0.0114	0.15	1.227	0.00316	0.04	0.1396	0.8714	1921469	CBDivE_013733	O=S1(=O)c2cc(/N=C/C=C/c3ccccc3)ccc2-c4ccc(/N=C/C=C/c5ccccc5)cc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O14	compound treatment	1.293	0.0244	0.33	1.277	0.0532	0.72	0.7457	0.9364	1775606	CBDivE_013734	[O-][N+](=O)c1cccc(c1)C(Nc2ccccn2)n3cnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O15	compound treatment	1.302	0.0334	0.45	1.246	0.0222	0.3	0.5327	0.981	1921470	CBDivE_013735	[O-][N+](=O)c1cccc(/C=C/C=N/c2ccc3-c4ccc(\N=C\C=C\c5cccc(c5)[N+](=O)[O-])cc4S(=O)(=O)c3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O16	compound treatment	1.305	0.0364	0.49	1.261	0.0372	0.51	0.7059	0.9999	1921471	CBDivE_013736	CCOC(=O)c1cc2c(C)nn(c3ccccc3)c2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O17	compound treatment	1.295	0.0264	0.36	1.237	0.0132	0.18	0.3791	0.9495	1476024	CBDivE_013737	S=C(CN1CCCC1=S)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O18	compound treatment	1.282	0.0134	0.18	1.226	0.00216	0.03	0.149	0.8115	1610566	CBDivE_013738	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O19	compound treatment	1.287	0.0184	0.25	1.233	0.00916	0.12	0.2642	0.9493	1921472	CBDivE_013739	CCOC(=O)N/N=C(\C)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	O20	compound treatment	1.372	0.103	1.4	1.352	0.128	1.75	2.2225	0.9938	1313471	CBDivE_013740	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P01	compound treatment	1.281	0.0124	0.17	1.243	0.0192	0.26	0.3034	0.977	1921473	CBDivE_013741	CN1C(=O)N(C)C(=O)C(=C(Nc2cccc(c2)[N+](=O)[O-])c3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P02	compound treatment	1.243	-0.0256	-0.34	1.208	-0.0158	-0.22	-0.3966	-0.9746	1921474	CBDivE_013742	C=CCN(CC=C)C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P03	compound treatment	1.253	-0.0156	-0.21	1.245	0.0212	0.29	0.0556	0.1558	1921475	CBDivE_013743	CON=[N+]([O-])C(Cc1ccccc1F)[N+](=NOC)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P04	compound treatment	1.19	-0.0786	-1.06	1.13	-0.0938	-1.28	-1.6543	-0.9956	1505454	CBDivE_013744	O=C1CCC(=O)N1CCSC(=S)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P05	compound treatment	1.306	0.0374	0.51	1.247	0.0232	0.32	0.5805	0.9745	1921476	CBDivE_013745	CC(=O)C1=C(C)NC(=S)NC1c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P06	compound treatment	1.269	4.36E-4	0.01	1.204	-0.0198	-0.27	-0.1871	-0.6916	1452967	CBDivE_013746	O=C1CCCN1CCSC(=S)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P07	compound treatment	1.233	-0.0356	-0.48	1.189	-0.0348	-0.48	-0.6752	-1.0	1921477	CBDivE_013747	Cc1[nH]c2ccccc2c1C(=O)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P08	compound treatment	1.166	-0.103	-1.38	1.105	-0.119	-1.62	-2.1243	-0.9969	1145984	CBDivE_013748	Fc1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P09	compound treatment	1.216	-0.0526	-0.71	1.155	-0.0688	-0.94	-1.1652	-0.9904	1921478	CBDivE_013749	C/C(=N\O)/C(=N/NC(=O)c1ccccc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P10	compound treatment	0.733	-0.536	-7.23	0.739	-0.485	-6.61	-9.7839	-0.999	1921479	CBDivE_013750	S=C(N/N=C/c1cc2ccccc2[nH]1)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P11	compound treatment	1.189	-0.0796	-1.07	1.173	-0.0508	-0.69	-1.2492	-0.9776	1269647	CBDivE_013751	CN1C2CCC1CC(C2)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P12	compound treatment	1.255	-0.0136	-0.18	1.202	-0.0218	-0.3	-0.34	-0.9727	1921480	CBDivE_013752	ICCOC(=O)NCCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P13	compound treatment	1.174	-0.0946	-1.28	1.102	-0.122	-1.66	-2.0769	-0.9915	1921481	CBDivE_013753	Clc1ccc2C(=O)/C(=C/3\Sc4c(ccc5cccc(Cl)c45)C3=O)/Sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P14	compound treatment	1.271	0.00244	0.03	1.196	-0.0278	-0.38	-0.2452	-0.6435	1347770	CBDivE_013754	CCn1cc(C(=O)O)c(=O)c2c(N)c(F)c(N3CCNCC3)c(F)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P15	compound treatment	1.197	-0.0716	-0.97	1.149	-0.0748	-1.02	-1.4043	-0.9996	1921482	CBDivE_013755	Cc1cccc(NC(=O)NC(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P16	compound treatment	1.255	-0.0136	-0.18	1.172	-0.0518	-0.71	-0.6292	-0.8618	1921483	CBDivE_013756	O=C(/C=C/c1ccccc1)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P17	compound treatment	1.266	-0.00256	-0.03	1.211	-0.0128	-0.18	-0.1482	-0.8308	1921484	CBDivE_013757	Clc1cccc(NC(=O)N2CCCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P18	compound treatment	1.258	-0.0106	-0.14	1.227	0.00316	0.04	-0.0703	-0.472	1129213	CBDivE_013758	Clc1ccc(OCC(=O)N2CCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P19	compound treatment	1.258	-0.0106	-0.14	1.21	-0.0138	-0.19	-0.2342	-0.9904	1115461	CBDivE_013759	Clc1cccc(NC(=O)N2CCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.43	P20	compound treatment	1.302	0.0334	0.45	1.271	0.0472	0.64	0.7737	0.9849	1921485	CBDivE_013760	O=C(/C=C/c1ccccc1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A01	compound treatment	1.269	0.00323	0.04	1.218	-0.00441	-0.06	-0.0117	-0.1581	1364251	CBDivE_013761	CCc1ccccc1NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A02	compound treatment	1.267	0.00123	0.02	1.238	0.0156	0.21	0.162	0.7598	1921486	CBDivE_013762	[O-][N+](=O)c1ccc(/C=N\Nc2ncnc3sc4CCCCc4c23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A03	compound treatment	1.316	0.0502	0.68	1.237	0.0146	0.2	0.6198	0.8777	1638176	CBDivE_013763	Cc1c(Cl)cccc1NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A04	compound treatment	1.302	0.0362	0.49	1.218	-0.00441	-0.06	0.3031	0.6155	1774395	CBDivE_013764	O=C(Sc1ccc(Oc2ccc(SC(=O)c3ccccc3)cc2)cc1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A05	compound treatment	1.287	0.0212	0.29	1.213	-0.00941	-0.13	0.1118	0.3562	1683269	CBDivE_013765	COc1ccc(CC(=O)Nc2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A06	compound treatment	1.312	0.0462	0.62	1.271	0.0486	0.66	0.9095	0.9995	1148361	CBDivE_013766	COc1cc(cc(OC)c1OC)C(=O)NC(C(C)C)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A07	compound treatment	1.29	0.0242	0.33	1.225	0.00259	0.04	0.2561	0.779	1921487	CBDivE_013767	Clc1ccc(OCCCC(=O)N2CCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A08	compound treatment	1.281	0.0152	0.21	1.238	0.0156	0.21	0.2956	0.9999	1921488	CBDivE_013768	Cc1ccc(OC(=O)/C=C/c2ccccc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A09	compound treatment	1.234	-0.0318	-0.43	1.186	-0.0364	-0.5	-0.6542	-0.9973	1559030	CBDivE_013769	COc1ccc(cc1OC)C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A10	compound treatment	1.28	0.0142	0.19	1.163	-0.0594	-0.81	-0.4371	-0.5251	1921489	CBDivE_013770	CCOC(=O)CCNc1n[nH]c(=S)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A11	compound treatment	1.287	0.0212	0.29	1.192	-0.0304	-0.41	-0.0907	-0.18	1424484	CBDivE_013771	CN1CCC2C(C1)c3cc(C)ccc3N2C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A12	compound treatment	1.3	0.0342	0.46	1.259	0.0366	0.5	0.6793	0.9992	1239892	CBDivE_013772	OC(=O)C#CC(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A13	compound treatment	1.307	0.0412	0.56	1.258	0.0356	0.49	0.7365	0.9977	1295506	CBDivE_013773	O=c1c2CCCOc2[nH]c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A14	compound treatment	1.312	0.0462	0.62	1.271	0.0486	0.66	0.9095	0.9995	1921490	CBDivE_013774	O=C(Nc1ccccc1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A15	compound treatment	1.266	2.26E-4	0.0	1.205	-0.0174	-0.24	-0.1657	-0.698	1607440	CBDivE_013775	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A16	compound treatment	1.296	0.0302	0.41	1.273	0.0506	0.69	0.7762	0.9685	1873863	CBDivE_013776	Cc1ccc(N=c2scc(c3ccc(Br)cc3)n2CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A17	compound treatment	1.259	-0.00677	-0.09	1.176	-0.0464	-0.63	-0.5121	-0.8009	1921491	CBDivE_013777	Cc1cc(=N)c2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A18	compound treatment	1.314	0.0482	0.65	1.293	0.0706	0.96	1.1407	0.9818	1921492	CBDivE_013778	CC(C)C(N1C(=O)c2ccccc2C1=O)C(=O)NNC(=O)C(C(C)C)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A19	compound treatment	1.232	-0.0338	-0.46	1.16	-0.0624	-0.85	-0.9239	-0.9571	1338970	CBDivE_013779	CN1CCN(CC1)C(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	A20	compound treatment	1.276	0.0102	0.14	1.241	0.0186	0.25	0.2768	0.9591	1921493	CBDivE_013780	O=C(Oc1ccccc1)c2ccc(cc2)C(=O)c3ccc(cc3)C(=O)Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B01	compound treatment	1.263	-0.00277	-0.04	1.215	-0.00741	-0.1	-0.0979	-0.9087	1921494	CBDivE_013781	CC1CCCC(C)N1C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B02	compound treatment	1.268	0.00223	0.03	1.244	0.0216	0.29	0.2294	0.7752	1921495	CBDivE_013782	CC(C)c1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B03	compound treatment	1.258	-0.00777	-0.1	1.179	-0.0434	-0.59	-0.4927	-0.8196	1476540	CBDivE_013783	COc1ccc(cc1OC)C(=O)Nc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B04	compound treatment	1.313	0.0472	0.64	1.235	0.0126	0.17	0.5719	0.8668	1239790	CBDivE_013784	O=C(N1CCCCCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B05	compound treatment	1.313	0.0472	0.64	1.27	0.0476	0.65	0.9094	1.0	1921496	CBDivE_013785	Brc1cccc(c1)C(=O)Nc2cccc3C(=O)c4ccccc4C(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B06	compound treatment	1.301	0.0352	0.48	1.254	0.0316	0.43	0.6407	0.9988	1686765	CBDivE_013786	Clc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B07	compound treatment	1.297	0.0312	0.42	1.245	0.0226	0.31	0.5157	0.9882	1480825	CBDivE_013787	COC(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B08	compound treatment	1.31	0.0442	0.6	1.224	0.00159	0.02	0.4372	0.7324	1270265	CBDivE_013788	Clc1ccc(cc1)S(=O)(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B09	compound treatment	1.283	0.0172	0.23	1.183	-0.0394	-0.54	-0.2157	-0.3684	1561352	CBDivE_013789	NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B10	compound treatment	1.346	0.0802	1.08	1.305	0.0826	1.13	1.5617	0.9998	1921497	CBDivE_013790	CC(=O)Nc1cccc(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B11	compound treatment	1.264	-0.00177	-0.02	1.219	-0.00341	-0.05	-0.0498	-0.9524	1921498	CBDivE_013791	C/C=C/C(=O)N1CCN(CC1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B12	compound treatment	1.289	0.0232	0.31	1.23	0.00759	0.1	0.2948	0.8933	1921499	CBDivE_013792	COc1ccc(cc1)C(OC[C@H]2O[C@H]([C@@H](O)[C@@H]2O)n3ccc(=O)[nH]c3=O)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B13	compound treatment	1.236	-0.0298	-0.4	1.179	-0.0434	-0.59	-0.7026	-0.9822	1921500	CBDivE_013793	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)COc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B14	compound treatment	1.333	0.0672	0.91	1.269	0.0466	0.64	1.0906	0.9848	1458288	CBDivE_013794	NS(=O)(=O)c1ccc(NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B15	compound treatment	1.274	0.00823	0.11	1.255	0.0326	0.44	0.3927	0.8573	1921501	CBDivE_013795	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B16	compound treatment	1.287	0.0212	0.29	1.208	-0.0144	-0.2	0.0636	0.183	1382644	CBDivE_013796	Cc1nc2ccccc2n1C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B17	compound treatment	1.304	0.0382	0.52	1.247	0.0246	0.34	0.6018	0.9783	1921502	CBDivE_013797	Ic1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B18	compound treatment	1.277	0.0112	0.15	1.207	-0.0154	-0.21	-0.0415	-0.1602	1921503	CBDivE_013798	CN1CCN(CC1)C(=O)CCCOc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B19	compound treatment	1.279	0.0132	0.18	1.197	-0.0254	-0.35	-0.1188	-0.3049	1921504	CBDivE_013799	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	B20	compound treatment	1.273	0.00723	0.1	1.221	-0.00141	-0.02	0.0554	0.5572	1298129	CBDivE_013800	NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C01	compound treatment	1.232	-0.0338	-0.46	1.198	-0.0244	-0.33	-0.5575	-0.9881	1504125	CBDivE_013801	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C02	compound treatment	1.262	-0.00377	-0.05	1.254	0.0316	0.43	0.2686	0.6192	1921505	CBDivE_013802	COc1cc(/C=N/c2ccc(cc2)S(=O)(=O)N)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C03	compound treatment	1.287	0.0212	0.29	1.204	-0.0184	-0.25	0.025	0.0656	1921506	CBDivE_013803	NS(=O)(=O)c1ccc(NC(=O)c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C04	compound treatment	1.271	0.00523	0.07	1.239	0.0166	0.23	0.2098	0.8854	1921507	CBDivE_013804	FC(F)(F)C(F)(F)C(=O)NCCNC(=O)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C05	compound treatment	1.27	0.00423	0.06	1.15	-0.0724	-0.99	-0.6579	-0.6652	1921508	CBDivE_013805	C(c1c[nH]c2ccccc12)n3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C06	compound treatment	1.276	0.0102	0.14	1.222	-4.08E-4	-0.01	0.0936	0.6781	1209158	CBDivE_013806	O=C(N1CCN(CN2CCN(CC2)C(=O)c3ccccc3)CC1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C07	compound treatment	1.286	0.0202	0.27	1.226	0.00359	0.05	0.2276	0.8209	1921509	CBDivE_013807	COc1ccc(cc1OC)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C08	compound treatment	1.286	0.0202	0.27	1.244	0.0216	0.29	0.4011	0.9993	1721556	CBDivE_013808	O=C(CSc1nc2ccccc2[nH]1)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C09	compound treatment	1.268	0.00223	0.03	1.194	-0.0284	-0.39	-0.2527	-0.6503	1127057	CBDivE_013809	COc1ccc(CC(=O)Nc2cccc(Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C10	compound treatment	1.281	0.0152	0.21	1.254	0.0316	0.43	0.4499	0.9426	1254573	CBDivE_013810	NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C11	compound treatment	1.283	0.0172	0.23	1.222	-4.08E-4	-0.01	0.1604	0.69	1921510	CBDivE_013811	CCN(C(=O)c1ccc(cc1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C12	compound treatment	1.312	0.0462	0.62	1.277	0.0546	0.74	0.9674	0.9961	1921511	CBDivE_013812	CCn1cc(C(=O)O)c(=O)c([N+](=O)[O-])c1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C13	compound treatment	1.273	0.00723	0.1	1.189	-0.0334	-0.46	-0.2532	-0.5435	1600843	CBDivE_013813	COc1ccc(CC(=O)Nc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C14	compound treatment	1.322	0.0562	0.76	1.265	0.0426	0.58	0.947	0.9913	1604010	CBDivE_013814	CCN(CC)S(=O)(=O)c1cc(ccc1C)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C15	compound treatment	1.312	0.0462	0.62	1.269	0.0466	0.64	0.8902	1.0	1921512	CBDivE_013815	OCC12COC3N2C(OC1)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C16	compound treatment	1.327	0.0612	0.83	1.262	0.0396	0.54	0.9658	0.9788	1121166	CBDivE_013816	COc1ccc(CC(=O)Nc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C17	compound treatment	1.275	0.00923	0.12	1.17	-0.0524	-0.71	-0.4173	-0.5753	1921513	CBDivE_013817	CC1=CC2=NCC(O)CN2C=C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C18	compound treatment	1.324	0.0582	0.79	1.239	0.0166	0.23	0.7154	0.8752	1491503	CBDivE_013818	COc1cc(cc(OC)c1OC)C(=O)NC(C)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C19	compound treatment	1.265	-7.74E-4	-0.01	1.181	-0.0414	-0.56	-0.4067	-0.7201	1169800	CBDivE_013819	C=CCN(CC=C)C(=O)C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	C20	compound treatment	1.228	-0.0378	-0.51	1.21	-0.0124	-0.17	-0.48	-0.8939	1921514	CBDivE_013820	Nc1ccccc1Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D01	compound treatment	1.266	2.26E-4	0.0	1.197	-0.0254	-0.35	-0.2428	-0.7009	1921515	CBDivE_013821	C/C=C/C(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D02	compound treatment	1.246	-0.0198	-0.27	1.146	-0.0764	-1.04	-0.9254	-0.8604	1921516	CBDivE_013822	Cc1cc(C)n(n1)C(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D03	compound treatment	1.256	-0.00977	-0.13	1.19	-0.0324	-0.44	-0.4057	-0.8798	1921517	CBDivE_013823	O=C(/C=C/c1ccccc1)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D04	compound treatment	1.272	0.00623	0.08	1.218	-0.00441	-0.06	0.0169	0.1635	1921518	CBDivE_013824	COc1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D05	compound treatment	1.264	-0.00177	-0.02	1.22	-0.00241	-0.03	-0.0401	-0.9879	1921519	CBDivE_013825	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D06	compound treatment	1.266	2.26E-4	0.0	1.247	0.0246	0.34	0.2393	0.7135	1519308	CBDivE_013826	Fc1cccc(NC(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D07	compound treatment	1.27	0.00423	0.06	1.22	-0.00241	-0.03	0.0171	0.2599	1777565	CBDivE_013827	CC(=O)Nc1cccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D08	compound treatment	1.255	-0.0108	-0.15	1.19	-0.0324	-0.44	-0.4153	-0.8926	1525775	CBDivE_013828	COc1cc(cc(OC)c1OC)C(=O)ON2C(=O)CCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D09	compound treatment	1.284	0.0182	0.25	1.239	0.0166	0.23	0.3339	0.9991	1921520	CBDivE_013829	Brc1cccc(c1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D10	compound treatment	1.251	-0.0148	-0.2	1.218	-0.00441	-0.06	-0.1834	-0.8811	1921521	CBDivE_013830	Cc1c(Cl)cccc1NC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D11	compound treatment	1.263	-0.00277	-0.04	1.193	-0.0294	-0.4	-0.31	-0.7698	1227163	CBDivE_013831	COc1cc(cc(OC)c1OC)C(=O)n2c(C)nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D12	compound treatment	1.282	0.0162	0.22	1.242	0.0196	0.27	0.3437	0.9951	1921522	CBDivE_013832	CCNC(=O)N(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D13	compound treatment	1.309	0.0432	0.58	1.262	0.0396	0.54	0.7941	0.9993	1921523	CBDivE_013833	CNC(=O)Oc1c(Cl)cc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D14	compound treatment	1.312	0.0462	0.62	1.267	0.0446	0.61	0.8709	0.9999	1007899	CBDivE_013834	O=C(Oc1ccc2ccccc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D15	compound treatment	1.221	-0.0448	-0.6	1.156	-0.0664	-0.91	-1.0674	-0.9806	1921524	CBDivE_013835	CC(C)OP(=O)(OC(C)C)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D16	compound treatment	1.311	0.0452	0.61	1.243	0.0206	0.28	0.63	0.938	1426981	CBDivE_013836	COc1ccc(CC(=O)Nc2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D17	compound treatment	1.263	-0.00277	-0.04	1.201	-0.0214	-0.29	-0.2329	-0.7913	1112990	CBDivE_013837	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D18	compound treatment	1.276	0.0102	0.14	1.22	-0.00241	-0.03	0.0743	0.5242	1921525	CBDivE_013838	Clc1ccc(Cl)c(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D19	compound treatment	1.251	-0.0148	-0.2	1.19	-0.0324	-0.44	-0.4534	-0.9353	1006282	CBDivE_013839	Nc1ccc(CCc2ccc(N)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	D20	compound treatment	1.284	0.0182	0.25	1.238	0.0156	0.21	0.3242	0.9974	1010359	CBDivE_013840	Oc1cccc2C(=O)c3ccccc3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E01	compound treatment	1.24	-0.0258	-0.35	1.181	-0.0414	-0.56	-0.6451	-0.9729	1473482	CBDivE_013841	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E02	compound treatment	1.303	0.0372	0.5	1.297	0.0746	1.02	1.0744	0.9471	1921526	CBDivE_013842	Cc1ccc(cc1C)S(=O)(=O)c2ccc(C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E03	compound treatment	1.256	-0.00977	-0.13	1.204	-0.0184	-0.25	-0.2707	-0.9548	1142382	CBDivE_013843	CCc1ccccc1NC(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E04	compound treatment	1.28	0.0142	0.19	1.201	-0.0214	-0.29	-0.0707	-0.2024	1409820	CBDivE_013844	CCCc1ccc(OCC(=O)Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E05	compound treatment	1.282	0.0162	0.22	1.209	-0.0134	-0.18	0.0255	0.0894	1921527	CBDivE_013845	CC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E06	compound treatment	1.27	0.00423	0.06	1.208	-0.0144	-0.2	-0.0986	-0.482	1464668	CBDivE_013846	CC(=O)Nc1ccc(cc1)C(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E07	compound treatment	1.276	0.0102	0.14	1.215	-0.00741	-0.1	0.0261	0.1528	1921528	CBDivE_013847	COc1ccccc1NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E08	compound treatment	1.286	0.0202	0.27	1.259	0.0366	0.5	0.5458	0.9597	1921529	CBDivE_013848	CC(=O)n1cc(C(C[N+](=O)[O-])SC(C[N+](=O)[O-])c2cn(C(=O)C)c3ccccc23)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E09	compound treatment	1.291	0.0252	0.34	1.23	0.00759	0.1	0.3138	0.8823	1921530	CBDivE_013849	Cc1cc(C)n(n1)C(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E10	compound treatment	1.295	0.0292	0.39	1.245	0.0226	0.31	0.4966	0.9926	1921531	CBDivE_013850	FC(F)(F)c1cccc(c1)S(=O)(=O)NC(=O)Cc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E11	compound treatment	1.226	-0.0398	-0.54	1.188	-0.0344	-0.47	-0.7112	-0.9978	1232367	CBDivE_013851	Clc1ccc(Cl)c(NC(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E12	compound treatment	1.306	0.0402	0.54	1.249	0.0266	0.36	0.6401	0.9808	1008681	CBDivE_013852	COc1cc(cc(OC)c1OC)C(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E13	compound treatment	1.252	-0.0138	-0.19	1.151	-0.0714	-0.97	-0.8199	-0.8271	1487531	CBDivE_013853	CC(=O)Nc1cccc(NC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E14	compound treatment	1.279	0.0132	0.18	1.279	0.0566	0.77	0.6719	0.8482	1921532	CBDivE_013854	Cc1cc(C)nc(NC(=O)NS(=O)(=O)N2CCOCC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E15	compound treatment	1.269	0.00323	0.04	1.193	-0.0294	-0.4	-0.2528	-0.6267	1921533	CBDivE_013855	Clc1ccc(NC(=O)c2ccccc2Br)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E16	compound treatment	1.275	0.00923	0.12	1.239	0.0166	0.23	0.248	0.9604	1921534	CBDivE_013856	CCCCCNC(=O)Nc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E17	compound treatment	1.238	-0.0278	-0.37	1.188	-0.0344	-0.47	-0.5967	-0.9938	1921535	CBDivE_013857	CCN(C(=O)c1ccco1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E18	compound treatment	1.299	0.0332	0.45	1.215	-0.00741	-0.1	0.2455	0.5344	1921536	CBDivE_013858	Cc1ccccc1S(=O)(=O)NC(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E19	compound treatment	1.233	-0.0328	-0.44	1.163	-0.0594	-0.81	-0.8855	-0.9594	1921537	CBDivE_013859	Clc1cccc(NC(=O)c2ccccc2Br)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	E20	compound treatment	1.282	0.0162	0.22	1.287	0.0646	0.88	0.7776	0.8568	1579690	CBDivE_013860	CCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F01	compound treatment	1.228	-0.0378	-0.51	1.147	-0.0754	-1.03	-1.0875	-0.9476	1921538	CBDivE_013861	Brc1ccc2OCCOCCOCCOCCOCCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F02	compound treatment	1.247	-0.0188	-0.25	1.188	-0.0344	-0.47	-0.5109	-0.9581	1036847	CBDivE_013862	S=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F03	compound treatment	1.249	-0.0168	-0.23	1.195	-0.0274	-0.37	-0.4243	-0.9711	1921539	CBDivE_013863	CCOC(=O)CC(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F04	compound treatment	1.233	-0.0328	-0.44	1.199	-0.0234	-0.32	-0.5383	-0.9872	1921540	CBDivE_013864	CCOc1ccc(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F05	compound treatment	1.281	0.0152	0.21	1.223	5.92E-4	0.01	0.151	0.7344	1921541	CBDivE_013865	[O-][N+](=O)c1cc(C/2=NOC(=O)\C2=C/3\CCCN3)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F06	compound treatment	1.267	0.00123	0.02	1.192	-0.0304	-0.41	-0.2815	-0.6784	1921542	CBDivE_013866	COc1ccc(cc1)C(OC[C@H]2O[C@H](C[C@@H]2OS(=O)(=O)C)n3cc(C)c(=O)[nH]c3=O)(c4ccccc4)c5ccc(OC)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F07	compound treatment	1.259	-0.00677	-0.09	1.242	0.0196	0.27	0.1243	0.4402	1921543	CBDivE_013867	CCOC(=O)c1c2CCCn2c3cc(Cl)c(cc3c1=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F08	compound treatment	1.263	-0.00277	-0.04	1.213	-0.00941	-0.13	-0.1172	-0.8768	1921544	CBDivE_013868	COc1ccc(cc1)C(OC[C@H]2O[C@@H]3[C@@H](Oc4nc(=O)ccn34)[C@@H]2O)(c5ccccc5)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F09	compound treatment	1.241	-0.0248	-0.33	1.187	-0.0354	-0.48	-0.5777	-0.9839	1921545	CBDivE_013869	[O-][N+](=O)c1cc(c2ccnn2c3ccccc3)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F10	compound treatment	1.322	0.0562	0.76	1.265	0.0426	0.58	0.947	0.9913	1921546	CBDivE_013870	CN(C)/C=C/C(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F11	compound treatment	1.321	0.0552	0.75	1.304	0.0816	1.11	1.3136	0.981	1010441	CBDivE_013871	[O-][N+](=O)c1ccc(cc1)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F12	compound treatment	1.311	0.0452	0.61	1.274	0.0516	0.7	0.9289	0.9975	1479751	CBDivE_013872	CCOC(=O)c1c2CCCn2c3cc(Cl)ccc3c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F13	compound treatment	1.258	-0.00777	-0.1	1.221	-0.00141	-0.02	-0.0877	-0.8228	1921547	CBDivE_013873	COc1ccc(cc1OC)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F14	compound treatment	1.24	-0.0258	-0.35	1.172	-0.0504	-0.69	-0.7319	-0.9501	1608742	CBDivE_013874	COc1cc(cc(OC)c1OC)C(=O)N(C(C)C)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F15	compound treatment	1.221	-0.0448	-0.6	1.228	0.00559	0.08	-0.3732	-0.613	1921548	CBDivE_013875	Clc1ccc(C2=NOC(=O)C2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F16	compound treatment	1.275	0.00923	0.12	1.248	0.0256	0.35	0.3348	0.9035	1782310	CBDivE_013876	CN1C=CC(=C/C=C\2/C=Nc3ccccc23)C=C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F17	compound treatment	1.222	-0.0438	-0.59	1.163	-0.0594	-0.81	-0.9904	-0.9879	1921549	CBDivE_013877	CN(C(=O)C)c1ccc(cc1)[N+](C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F18	compound treatment	1.267	0.00123	0.02	1.245	0.0226	0.31	0.2295	0.744	1921550	CBDivE_013878	OS(=O)(=O)C1Cc2ccccc2N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F19	compound treatment	1.256	-0.00977	-0.13	1.202	-0.0204	-0.28	-0.29	-0.9418	1267308	CBDivE_013879	CC[N+](C)(C)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	F20	compound treatment	1.257	-0.00877	-0.12	1.249	0.0266	0.36	0.1727	0.4528	1921551	CBDivE_013880	O=C(Nc1ccc(N=Nc2ccccc2)cc1)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G01	compound treatment	1.221	-0.0448	-0.6	1.177	-0.0454	-0.62	-0.865	-0.9999	3022010	CBDivE_013881	CC(N)c1ccccc1.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G02	compound treatment	1.249	-0.0168	-0.23	1.255	0.0326	0.44	0.1543	0.3093	1921552	CBDivE_013882	CC(=O)NNC(=O)c1cccc2cc[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G03	compound treatment	1.247	-0.0188	-0.25	1.171	-0.0514	-0.7	-0.6748	-0.9053	1921553	CBDivE_013883	Clc1ccc(NC(=O)/C=C/c2ccccc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G04	compound treatment	1.243	-0.0228	-0.31	1.222	-4.08E-4	-0.01	-0.2212	-0.7198	1921554	CBDivE_013884	[O-][N+](=O)c1cn(c2ccc(Cl)cc2)c3cc(Cl)ccc3c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G05	compound treatment	1.244	-0.0218	-0.29	1.203	-0.0194	-0.26	-0.3948	-0.9986	1921555	CBDivE_013885	COc1ccc(/C=N/c2ccc(O)c(c2)C(=O)O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G06	compound treatment	1.288	0.0222	0.3	1.249	0.0266	0.36	0.4684	0.9955	1921556	CBDivE_013886	CC1CCCC(C)N1C(=O)CCCOc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G07	compound treatment	1.272	0.00623	0.08	1.226	0.00359	0.05	0.094	0.9671	1921557	CBDivE_013887	O=C(/C=C/c1ccccc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G08	compound treatment	1.257	-0.00877	-0.12	1.237	0.0146	0.2	0.057	0.2462	1921558	CBDivE_013888	CSc1ncc2c(=O)c3CCCN(C)c3[nH]c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G09	compound treatment	1.254	-0.0118	-0.16	1.185	-0.0374	-0.51	-0.473	-0.8854	1921559	CBDivE_013889	COC(=O)CC1N(CC#Cc2ccccc2)CCNC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G10	compound treatment	1.286	0.0202	0.27	1.263	0.0406	0.55	0.5843	0.9469	1921560	CBDivE_013890	COc1ccc(CC(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G11	compound treatment	1.258	-0.00777	-0.1	1.183	-0.0394	-0.54	-0.4541	-0.8295	1921561	CBDivE_013891	C1CCN(C1)C2(CCCCC2)c3nnnn3C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G12	compound treatment	1.288	0.0222	0.3	1.278	0.0556	0.76	0.7481	0.9176	1461062	CBDivE_013892	NS(=O)(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G13	compound treatment	1.237	-0.0288	-0.39	1.156	-0.0664	-0.91	-0.9148	-0.9285	1315737	CBDivE_013893	Cc1ccc(NC(c2ccccc2)c3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G14	compound treatment	1.323	0.0572	0.77	1.318	0.0956	1.3	1.4676	0.9687	1197455	CBDivE_013894	CCc1ccccc1NC(=O)Cc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G15	compound treatment	1.259	-0.00677	-0.09	1.211	-0.0114	-0.16	-0.1746	-0.9679	1685028	CBDivE_013895	Clc1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G16	compound treatment	1.283	0.0172	0.23	1.26	0.0376	0.51	0.5268	0.936	1464574	CBDivE_013896	COc1ccc(CC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G17	compound treatment	1.303	0.0372	0.5	1.239	0.0166	0.23	0.5151	0.9352	1645586	CBDivE_013897	COc1ccc(CC(=O)N2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G18	compound treatment	1.313	0.0472	0.64	1.262	0.0396	0.54	0.8323	0.9966	1786460	CBDivE_013898	OC1CCNC2CCCCC12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G19	compound treatment	1.327	0.0612	0.83	1.313	0.0906	1.24	1.4576	0.9808	1921562	CBDivE_013899	[O-][N+](=O)c1ccc(N/N=C/c2ccc(o2)c3cccc(c3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	G20	compound treatment	1.276	0.0102	0.14	1.285	0.0626	0.85	0.7011	0.8109	1921563	CBDivE_013900	CC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H01	compound treatment	1.216	-0.0498	-0.67	1.152	-0.0704	-0.96	-1.1537	-0.9847	1286843	CBDivE_013901	CCOc1ccc(NC(=S)Nc2ccc(OCC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H02	compound treatment	1.22	-0.0458	-0.62	1.214	-0.00841	-0.11	-0.5177	-0.8243	1183443	CBDivE_013902	CC(C)OC(=O)C(C)Nc1ccc(F)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H03	compound treatment	1.265	-7.74E-4	-0.01	1.177	-0.0454	-0.62	-0.4452	-0.7189	3107365	CBDivE_013903	OC(C(O)C(=O)O)C(=O)O.c1ccncc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H04	compound treatment	1.245	-0.0208	-0.28	1.189	-0.0334	-0.46	-0.5203	-0.9728	1921564	CBDivE_013904	COc1ccc(cc1)C(OCC2OC(C(OC3CCCCO3)C2O)n4cnc5c(=O)n(C)c(N)nc45)(c6ccccc6)c7ccc(OC)cc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H05	compound treatment	1.262	-0.00377	-0.05	1.243	0.0206	0.28	0.1626	0.5696	1921565	CBDivE_013905	Clc1ccc(OCCCC(=O)N2CCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H06	compound treatment	1.094	-0.172	-2.32	1.18	-0.0424	-0.58	-2.0475	-0.8573	1921566	CBDivE_013906	Cc1cc(cc(C)c1[N+](=O)[O-])[N+](C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H07	compound treatment	1.247	-0.0188	-0.25	1.228	0.00559	0.08	-0.1252	-0.4732	1253001	CBDivE_013907	COc1ccccc1N2CCN(CC2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H08	compound treatment	1.256	-0.00977	-0.13	1.204	-0.0184	-0.25	-0.2707	-0.9548	798703	CBDivE_013908	C[N+](C)(C)c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H09	compound treatment	1.246	-0.0198	-0.27	1.186	-0.0364	-0.5	-0.5397	-0.9576	1081081	CBDivE_013909	C1CNCCNCCCNCCNC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H10	compound treatment	1.239	-0.0268	-0.36	1.226	0.00359	0.05	-0.2208	-0.6057	1921567	CBDivE_013910	Cc1cc(cc(C)c1N)[N+](C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H11	compound treatment	1.265	-7.74E-4	-0.01	1.234	0.0116	0.16	0.1044	0.6589	1921568	CBDivE_013911	Cc1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H12	compound treatment	1.251	-0.0148	-0.2	1.221	-0.00141	-0.02	-0.1545	-0.7716	1921569	CBDivE_013912	Cc1cc(ccc1N)[N+](C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H13	compound treatment	1.334	0.0682	0.92	1.284	0.0616	0.84	1.2447	0.999	1104227	CBDivE_013913	CCC(C)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H14	compound treatment	1.271	0.00523	0.07	1.267	0.0446	0.61	0.4798	0.7838	1188428	CBDivE_013914	CN1CCN(CC1)C(=O)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H15	compound treatment	1.254	-0.0118	-0.16	1.177	-0.0454	-0.62	-0.5502	-0.8606	1921570	CBDivE_013915	Cc1sc(=O)[nH]c1C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H16	compound treatment	1.254	-0.0118	-0.16	1.214	-0.00841	-0.11	-0.1934	-0.9872	1188329	CBDivE_013916	NS(=O)(=O)c1ccc(NC(=O)c2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H17	compound treatment	1.228	-0.0378	-0.51	1.165	-0.0574	-0.78	-0.9139	-0.9784	1921571	CBDivE_013917	CC(C)c1ccc(NC(=O)c2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H18	compound treatment	1.256	-0.00977	-0.13	1.208	-0.0144	-0.2	-0.2322	-0.9812	1781222	CBDivE_013918	CC1CCCC(C)N1C(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H19	compound treatment	1.251	-0.0148	-0.2	1.207	-0.0154	-0.21	-0.2895	-0.9997	1921572	CBDivE_013919	Clc1ccc(Cl)c(NC(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	H20	compound treatment	1.301	0.0352	0.48	1.226	0.00359	0.05	0.3707	0.7759	1430023	CBDivE_013920	CC(C)(C)c1cc(cc(c1F)C(C)(C)C)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I01	compound treatment	1.228	-0.0378	-0.51	1.206	-0.0164	-0.22	-0.5185	-0.9317	1491950	CBDivE_013921	C1CCC(CC1)Nc2nnnn2C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I02	compound treatment	1.278	0.0122	0.16	1.264	0.0416	0.57	0.5177	0.8764	1921573	CBDivE_013922	CCOC(=O)CC(=O)c1cc(Cl)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I03	compound treatment	1.262	-0.00377	-0.05	1.238	0.0156	0.21	0.1143	0.523	1921574	CBDivE_013923	CCN(CC)CC#CC(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I04	compound treatment	1.259	-0.00677	-0.09	1.24	0.0176	0.24	0.105	0.4091	1921575	CBDivE_013924	C/C(=N/O)/c1ccc(NS(=O)(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I05	compound treatment	1.309	0.0432	0.58	1.291	0.0686	0.94	1.0737	0.9741	1921576	CBDivE_013925	CN(C)CC#CCC(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I06	compound treatment	1.232	-0.0338	-0.46	1.198	-0.0244	-0.33	-0.5575	-0.9881	1921577	CBDivE_013926	CN/1C=CC=C\C1=C/C=C\2/C=Nc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I07	compound treatment	1.271	0.00523	0.07	1.217	-0.00541	-0.07	-0.0023	-0.0225	1638410	CBDivE_013927	Clc1nc2ccccc2c3[nH]c4ccccc4c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I08	compound treatment	1.258	-0.00777	-0.1	1.229	0.00659	0.09	-0.0106	-0.0767	1308581	CBDivE_013928	CCN1CCc2[nH]c3ccccc3c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I09	compound treatment	1.266	2.26E-4	0.0	1.189	-0.0334	-0.46	-0.32	-0.7024	1921578	CBDivE_013929	COC/1=Nc2ccccc2\C1=C/NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I10	compound treatment	1.265	-7.74E-4	-0.01	1.264	0.0416	0.57	0.3937	0.694	1326973	CBDivE_013930	O=S(=O)(c1ccc2ocnc2c1)c3ccc4ocnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I11	compound treatment	1.246	-0.0198	-0.27	1.207	-0.0154	-0.21	-0.3372	-0.993	1005861	CBDivE_013931	Oc1ccccc1c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I12	compound treatment	1.276	0.0102	0.14	1.243	0.0206	0.28	0.2961	0.9464	1921579	CBDivE_013932	CC12CC2(C)C(=O)N(C1=O)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I13	compound treatment	1.319	0.0532	0.72	1.261	0.0386	0.53	0.8799	0.9883	1921580	CBDivE_013933	Oc1ccc(/N=C/C=C/c2ccccc2[N+](=O)[O-])cc1c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I14	compound treatment	1.28	0.0142	0.19	1.247	0.0246	0.34	0.3728	0.9649	878	CBDivE_013934	CC(=O)NS(=O)(=O)c1ccc(N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I15	compound treatment	1.238	-0.0278	-0.37	1.196	-0.0264	-0.36	-0.5196	-0.9998	1243345	CBDivE_013935	O=C1N(CCSC(=S)N2CCCC2)Cc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I16	compound treatment	1.296	0.0302	0.41	1.297	0.0746	1.02	1.0076	0.9194	1154816	CBDivE_013936	CC(NC(=S)c1cccnc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I17	compound treatment	1.294	0.0282	0.38	1.206	-0.0164	-0.22	0.111	0.2514	1463503	CBDivE_013937	N(C(c1ccccc1)c2ccncc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I18	compound treatment	1.293	0.0272	0.37	1.244	0.0216	0.29	0.4679	0.994	1921581	CBDivE_013938	CCN(C(=O)c1ccc(cc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I19	compound treatment	1.256	-0.00977	-0.13	1.23	0.00759	0.1	-0.02	-0.1195	1432230	CBDivE_013939	Cc1sc2ncnc(Nc3ccc(C)c(C)c3)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	I20	compound treatment	1.293	0.0272	0.37	1.22	-0.00241	-0.03	0.2365	0.6413	1921582	CBDivE_013940	Cc1cc(C)n(n1)C(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J01	compound treatment	1.252	-0.0138	-0.19	1.196	-0.0264	-0.36	-0.386	-0.9526	1921583	CBDivE_013941	CCOC(=O)N[C@@H](C)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J02	compound treatment	1.264	-0.00177	-0.02	1.217	-0.00541	-0.07	-0.0691	-0.8909	1330870	CBDivE_013942	CC(C)(C)c1cc(SCCc2ccccn2)cc(c1F)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J03	compound treatment	1.279	0.0132	0.18	1.226	0.00359	0.05	0.1608	0.8691	1180335	CBDivE_013943	Clc1ccc(OCC(=O)Nc2ccccc2Br)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J04	compound treatment	1.233	-0.0328	-0.44	1.191	-0.0314	-0.43	-0.6155	-0.9999	1921584	CBDivE_013944	Oc1cccc2C(=O)c3cccc(OC(=O)C4CC4c5ccccc5)c3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J05	compound treatment	1.271	0.00523	0.07	1.233	0.0106	0.14	0.152	0.9456	1921585	CBDivE_013945	COc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J06	compound treatment	1.245	-0.0208	-0.28	1.222	-4.08E-4	-0.01	-0.2021	-0.721	1019664	CBDivE_013946	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J07	compound treatment	1.265	-7.74E-4	-0.01	1.212	-0.0104	-0.14	-0.1077	-0.7571	1921586	CBDivE_013947	[O-][N+](=O)c1cccc(c1)c2nnc3ccc(Cl)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J08	compound treatment	1.297	0.0312	0.42	1.223	5.92E-4	0.01	0.3036	0.7205	1774521	CBDivE_013948	[O-][N+](=O)c1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J09	compound treatment	1.214	-0.0518	-0.7	1.16	-0.0624	-0.85	-1.0957	-0.9952	1229355	CBDivE_013949	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3S2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J10	compound treatment	1.262	-0.00377	-0.05	1.185	-0.0374	-0.51	-0.3967	-0.7738	1921587	CBDivE_013950	C/C(=N\O)/c1ccc2C3c4ccccc4C(c5ccccc35)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J11	compound treatment	1.214	-0.0518	-0.7	1.166	-0.0564	-0.77	-1.0378	-0.9988	1631529	CBDivE_013951	O=C1CCCC2=C1Sc3ccccc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J12	compound treatment	1.247	-0.0188	-0.25	1.132	-0.0904	-1.23	-1.0508	-0.8349	1921588	CBDivE_013952	C/C(=C\c1ccccc1)/C(=O)/C=C\c2ccc(/C=C\C(=O)\C(=C\c3ccccc3)\C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J13	compound treatment	1.239	-0.0268	-0.36	1.207	-0.0154	-0.21	-0.404	-0.9668	1727162	CBDivE_013953	COc1cc2CCN3C[C@@H]4N(CCc5cc(OC)c(OC)cc45)C[C@@H]3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J14	compound treatment	1.236	-0.0298	-0.4	1.197	-0.0254	-0.35	-0.529	-0.9973	1475587	CBDivE_013954	COc1ccc(cc1)C(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J15	compound treatment	1.273	0.00723	0.1	1.224	0.00159	0.02	0.0843	0.8439	1921589	CBDivE_013955	CCOC(=O)c1c(/C=C/N(C)C)oc2ccc(O)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J16	compound treatment	1.242	-0.0238	-0.32	1.196	-0.0264	-0.36	-0.4814	-0.9983	3107368	CBDivE_013956	CCCC1=NCCn2cccc12.OC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J17	compound treatment	1.267	0.00123	0.02	1.196	-0.0264	-0.36	-0.2429	-0.6739	1033664	CBDivE_013957	CCOc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J18	compound treatment	1.281	0.0152	0.21	1.247	0.0246	0.34	0.3824	0.9723	1921591	CBDivE_013958	CC(=O)c1ccc(N2CCCCC2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J19	compound treatment	1.248	-0.0178	-0.24	1.206	-0.0164	-0.22	-0.3278	-0.9994	1360839	CBDivE_013959	N1C=Nc2ccccc2-c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	J20	compound treatment	1.264	-0.00177	-0.02	1.212	-0.0104	-0.14	-0.1173	-0.8149	1921592	CBDivE_013960	[O-][N+](=O)c1ccccc1C(=O)NC(NC(=S)Nc2cccc3ccccc23)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K01	compound treatment	1.264	-0.00177	-0.02	1.237	0.0146	0.2	0.1238	0.6176	1921593	CBDivE_013961	CCn1c(C)c(c2ccccc2)c3cc(ccc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K02	compound treatment	1.247	-0.0188	-0.25	1.235	0.0126	0.17	-0.0577	-0.1885	1921594	CBDivE_013962	C/C(=N/O)/c1cc(CN2CCOCC2)c(O)c(O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K03	compound treatment	1.259	-0.00677	-0.09	1.206	-0.0164	-0.22	-0.2228	-0.922	1921595	CBDivE_013963	Clc1cccc(/C=N/c2ccc3oc(nc3c2)c4ccccc4Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K04	compound treatment	1.237	-0.0288	-0.39	1.206	-0.0164	-0.22	-0.4327	-0.9657	1591442	CBDivE_013964	Nc1nc(cs1)c2ccc(O)c(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K05	compound treatment	1.272	0.00623	0.08	1.237	0.0146	0.2	0.2001	0.9264	1921596	CBDivE_013965	Fc1ccc(cc1)C2=N/C(=C\c3ccccc3)/C(=O)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K06	compound treatment	1.292	0.0262	0.35	1.302	0.0796	1.09	1.0176	0.8914	1921597	CBDivE_013966	O/N=C\c1cc(CN2CCCCC2)c(O)c(O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K07	compound treatment	1.226	-0.0398	-0.54	1.228	0.00559	0.08	-0.3255	-0.6006	1921598	CBDivE_013967	Fc1ccc(cc1)C2=N/C(=C\c3ccco3)/C(=O)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K08	compound treatment	1.243	-0.0228	-0.31	1.243	0.0206	0.28	-0.0187	-0.0449	1921599	CBDivE_013968	NC1=NN=C(CS1)c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K09	compound treatment	1.224	-0.0418	-0.56	1.201	-0.0214	-0.29	-0.6049	-0.9531	1921600	CBDivE_013969	Oc1ccccc1N/C=C\2/C(=O)CNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K10	compound treatment	1.266	2.26E-4	0.0	1.242	0.0196	0.27	0.1911	0.7151	1048670	CBDivE_013970	CC(SC(=S)N1CCOCC1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K11	compound treatment	1.258	-0.00777	-0.1	1.179	-0.0434	-0.59	-0.4927	-0.8196	1568073	CBDivE_013971	Cc1ccc2[nH]c3C(CCCc3c2c1)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K12	compound treatment	1.323	0.0572	0.77	1.264	0.0416	0.57	0.9469	0.9885	1921601	CBDivE_013972	CSC(=S)N/N=C/c1cc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K13	compound treatment	1.286	0.0202	0.27	1.207	-0.0154	-0.21	0.0444	0.1289	1259621	CBDivE_013973	CCn1cc(C(=O)O)c(=O)c2cc(F)c(cc12)N3CCN(CC3)C(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K14	compound treatment	1.315	0.0492	0.66	1.323	0.101	1.37	1.4395	0.9446	1921602	CBDivE_013974	COc1ccc(N/C=C/2\CCOC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K15	compound treatment	1.28	0.0142	0.19	1.178	-0.0444	-0.61	-0.2925	-0.4604	1921603	CBDivE_013975	C1CN(CCO1)c2ccc(/N=C/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K16	compound treatment	1.326	0.0602	0.81	1.268	0.0456	0.62	1.0141	0.9913	1921604	CBDivE_013976	OC(=O)/C=C/C(=O)NCC1CCC(CC1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K17	compound treatment	1.313	0.0472	0.64	1.26	0.0376	0.51	0.813	0.9942	1921605	CBDivE_013977	C[N+](C)(C)c1ccc(/C=N/N=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K18	compound treatment	1.295	0.0292	0.39	1.264	0.0416	0.57	0.6798	0.9842	1921606	CBDivE_013978	CCOC1Oc2ccc(OS(=O)(=O)C)cc2C1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K19	compound treatment	1.273	0.00723	0.1	1.223	5.92E-4	0.01	0.0746	0.7631	1921607	CBDivE_013979	CC(C)c1ccc(NC(=O)/C=C\C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	K20	compound treatment	1.276	0.0102	0.14	1.259	0.0366	0.5	0.4504	0.87	1369616	CBDivE_013980	Clc1ccc(NC(=O)c2ccc(cc2)c3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L01	compound treatment	1.259	-0.00677	-0.09	1.233	0.0106	0.14	0.0375	0.2195	1921608	CBDivE_013981	CN(NC(=O)CN1CCCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L02	compound treatment	1.249	-0.0168	-0.23	1.194	-0.0284	-0.39	-0.4339	-0.9672	1921609	CBDivE_013982	CCn1c2ccccc2c3cc(/C=N/c4cccc(CO)c4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L03	compound treatment	1.25	-0.0158	-0.21	1.221	-0.00141	-0.02	-0.164	-0.7678	1921610	CBDivE_013983	CCN(CC)C(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L04	compound treatment	1.246	-0.0198	-0.27	1.202	-0.0204	-0.28	-0.3854	-0.9998	1921611	CBDivE_013984	CCn1c2ccccc2c3cc(/C=N/c4ccc(\N=C\c5ccc6n(CC)c7ccccc7c6c5)cc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L05	compound treatment	1.254	-0.0118	-0.16	1.169	-0.0534	-0.73	-0.6273	-0.8415	1921612	CBDivE_013985	Fc1c(F)c(F)c(/C=N/Nc2cc(nc(n2)c3ccc(Br)cc3)c4ccccc4)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L06	compound treatment	1.282	0.0162	0.22	1.245	0.0226	0.31	0.3726	0.986	1921613	CBDivE_013986	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccc4I)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L07	compound treatment	1.232	-0.0338	-0.46	1.208	-0.0144	-0.2	-0.4611	-0.9293	1921614	CBDivE_013987	N/N=C/1\CCCc2c1[nH]c3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L08	compound treatment	1.237	-0.0288	-0.39	1.157	-0.0654	-0.89	-0.9052	-0.9305	1776958	CBDivE_013988	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc2ccccc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L09	compound treatment	1.275	0.00923	0.12	1.262	0.0396	0.54	0.4698	0.8479	1921615	CBDivE_013989	Cc1ccc2[nH]c3/C(=N/c4ccccc4)/CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L10	compound treatment	1.233	-0.0328	-0.44	1.175	-0.0474	-0.65	-0.7698	-0.9828	1921616	CBDivE_013990	OS(=O)(=O)c1ccc(N/N=C/C=N/Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L11	compound treatment	1.214	-0.0518	-0.7	1.148	-0.0744	-1.01	-1.2114	-0.9834	1921617	CBDivE_013991	C/C(=N\NC(=O)c1ccnn1C)/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L12	compound treatment	1.265	-7.74E-4	-0.01	1.257	0.0346	0.47	0.3262	0.6913	1921618	CBDivE_013992	COC(=O)CCCC/C(=N\O)/c1[nH]c(=O)[nH]c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L13	compound treatment	1.285	0.0192	0.26	1.263	0.0406	0.55	0.5748	0.9403	1921619	CBDivE_013993	OC(=O)/C=C\C(=O)Nc1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L14	compound treatment	1.265	-7.74E-4	-0.01	1.23	0.00759	0.1	0.0658	0.6326	1921620	CBDivE_013994	CCCN1CC2C(N(N=C2/C(=C/c3ccc(C)o3)/C1)/C(=C\C(=O)OCC)/C)c4ccc(C)o4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L15	compound treatment	1.215	-0.0508	-0.68	1.186	-0.0364	-0.5	-0.8354	-0.9875	1775188	CBDivE_013995	Cn1ncc([N+](=O)[O-])c1C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L16	compound treatment	1.279	0.0132	0.18	1.235	0.0126	0.17	0.2476	0.9998	1921621	CBDivE_013996	[O-][N+](=O)c1ccccc1S(=O)(=O)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L17	compound treatment	1.282	0.0162	0.22	1.217	-0.00541	-0.07	0.1026	0.4444	1921622	CBDivE_013997	O=C(Nc1ccc2ccccc2c1)c3ccc(cc3)C(=O)Nc4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L18	compound treatment	1.207	-0.0588	-0.79	1.135	-0.0874	-1.19	-1.4035	-0.9804	1921623	CBDivE_013998	COc1ccc(OC)c(N/N=C/2\CCCNC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L19	compound treatment	1.219	-0.0468	-0.63	1.164	-0.0584	-0.8	-1.0094	-0.9933	1921624	CBDivE_013999	Fc1ccc(/C=N/Nc2nc(nc(n2)N3CCOCC3)N(c4ccccc4)c5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	L20	compound treatment	1.274	0.00823	0.11	1.201	-0.0214	-0.29	-0.128	-0.4097	1921625	CBDivE_014000	CNc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(OCC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M01	compound treatment	1.286	0.0202	0.27	1.348	0.126	1.71	1.404	0.8096	1921626	CBDivE_014001	COc1cccc(/C=N/N=N[N+](C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M02	compound treatment	1.215	-0.0508	-0.68	1.272	0.0496	0.68	-0.0062	-0.0064	1921627	CBDivE_014002	OC1CC(N(Cc2ccccc2)C1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M03	compound treatment	1.26	-0.00577	-0.08	1.252	0.0296	0.4	0.2303	0.5603	1921628	CBDivE_014003	Clc1ccc(NC(=O)c2cccc(Br)c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M04	compound treatment	1.275	0.00923	0.12	1.282	0.0596	0.81	0.6626	0.806	1921629	CBDivE_014004	Cc1ccc(N/C=C(/C2=CC(=O)C=CC2=O)\[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M05	compound treatment	1.247	-0.0188	-0.25	1.227	0.00459	0.06	-0.1348	-0.5167	1921630	CBDivE_014005	O=C(/C=C/c1ccccc1)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M06	compound treatment	1.216	-0.0498	-0.67	1.168	-0.0544	-0.74	-0.9994	-0.9988	1921631	CBDivE_014006	CCCCOC(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M07	compound treatment	1.244	-0.0218	-0.29	1.198	-0.0244	-0.33	-0.4431	-0.9981	1921632	CBDivE_014007	CC1CCCC(C)N1C(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M08	compound treatment	1.25	-0.0158	-0.21	1.212	-0.0104	-0.14	-0.2508	-0.9806	1921633	CBDivE_014008	CCN(CC)Cc1c(C(=O)C)c2cc(O)ccc2n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M09	compound treatment	1.273	0.00723	0.1	1.224	0.00159	0.02	0.0843	0.8439	1921634	CBDivE_014009	Clc1ccccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M10	compound treatment	1.251	-0.0148	-0.2	1.266	0.0436	0.59	0.2794	0.4456	1921635	CBDivE_014010	Cc1c(Cl)cccc1NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M11	compound treatment	1.271	0.00523	0.07	1.223	5.92E-4	0.01	0.0556	0.783	1921636	CBDivE_014011	C/C=C/C(=O)Nc1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M12	compound treatment	1.267	0.00123	0.02	1.246	0.0236	0.32	0.2392	0.7425	1921637	CBDivE_014012	NC1=C(C(=O)c2ccccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M13	compound treatment	1.233	-0.0328	-0.44	1.227	0.00459	0.06	-0.2684	-0.601	1921638	CBDivE_014013	Clc1cccc(NC(=O)c2cccc(Br)c2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M14	compound treatment	1.297	0.0312	0.42	1.33	0.108	1.47	1.3353	0.8748	1166578	CBDivE_014014	Clc1ccc(cc1)c2nnc3ccc(nn23)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M15	compound treatment	1.253	-0.0128	-0.17	1.23	0.00759	0.1	-0.0486	-0.242	1921639	CBDivE_014015	c1cc(oc1c2nc3ccccc3[nH]2)c4nc5ccccc5[nH]4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M16	compound treatment	1.253	-0.0128	-0.17	1.233	0.0106	0.14	-0.0197	-0.0877	1921640	CBDivE_014016	Clc1ccc(NC(=S)NNc2ccc(=S)[nH]n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M17	compound treatment	1.271	0.00523	0.07	1.245	0.0226	0.31	0.2677	0.847	1921641	CBDivE_014017	Nc1cc(ccc1Br)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M18	compound treatment	1.27	0.00423	0.06	1.23	0.00759	0.1	0.1135	0.9605	1507078	CBDivE_014018	Clc1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M19	compound treatment	1.252	-0.0138	-0.19	1.224	0.00159	0.02	-0.116	-0.6203	1314463	CBDivE_014019	O=C1CCC(=O)N1CCSC(=S)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	M20	compound treatment	1.279	0.0132	0.18	1.258	0.0356	0.49	0.4694	0.9077	1921642	CBDivE_014020	Cc1c(Cl)cccc1NC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N01	compound treatment	1.249	-0.0168	-0.23	1.286	0.0636	0.87	0.4532	0.5056	1921643	CBDivE_014021	CCN(CC)CC(=O)Nc1ccc2N=C(c3ccccc3)c4cc(NC(=O)CN(CC)CC)ccc4N=C(c5ccccc5)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N02	compound treatment	1.238	-0.0278	-0.37	1.248	0.0256	0.35	-0.0182	-0.0355	1921644	CBDivE_014022	O=C(Cc1ccc2sc(nc2c1)c3ccccc3)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N03	compound treatment	1.212	-0.0538	-0.73	1.159	-0.0634	-0.86	-1.1244	-0.9962	1267877	CBDivE_014023	COc1ccc(c2nc3cnccc3[nH]2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N04	compound treatment	1.225	-0.0408	-0.55	1.171	-0.0514	-0.7	-0.8847	-0.9928	1466780	CBDivE_014024	O=C(CSc1n[nH]c(=O)[nH]c1=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N05	compound treatment	1.23	-0.0358	-0.48	1.205	-0.0174	-0.24	-0.5091	-0.9466	1921645	CBDivE_014025	COc1cc2c3C(=O)NNCc3n(C)c2cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N06	compound treatment	1.222	-0.0438	-0.59	1.164	-0.0584	-0.8	-0.9808	-0.9892	1163199	CBDivE_014026	Cc1ccc2[nH]c3C(O)CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N07	compound treatment	1.219	-0.0468	-0.63	1.206	-0.0164	-0.22	-0.6044	-0.9028	1603402	CBDivE_014027	COc1ccc(cc1)N2C(=O)CCc3c(cc(cc23)N(C)C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N08	compound treatment	1.186	-0.0798	-1.08	1.183	-0.0394	-0.54	-1.141	-0.9485	1921646	CBDivE_014028	COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2ccc(cc2)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N09	compound treatment	1.198	-0.0678	-0.91	1.216	-0.00641	-0.09	-0.7083	-0.7712	1921647	CBDivE_014029	Cc1cc(C)n(n1)C2=NNC(C=C2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N10	compound treatment	1.242	-0.0238	-0.32	1.233	0.0106	0.14	-0.1247	-0.3544	1921648	CBDivE_014030	COC(=O)c1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N11	compound treatment	1.223	-0.0428	-0.58	1.183	-0.0394	-0.54	-0.788	-0.9994	1921649	CBDivE_014031	Cc1cc2cc(ccc2n1Cc3ccccc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N12	compound treatment	1.244	-0.0218	-0.29	1.176	-0.0464	-0.63	-0.6552	-0.9391	1921650	CBDivE_014032	CC1(C)CC=C(c2ccc(/C=C/3\CCC/C(=C\c4ccc(s4)C5=CC(C)(C)NC(C)(C)C5)/C3=O)s2)C(C)(C)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N13	compound treatment	1.268	0.00223	0.03	1.245	0.0226	0.31	0.2391	0.7724	1921651	CBDivE_014033	Cc1cc(ccc1/N=C/c2cccc([N+](=O)[O-])c2O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N14	compound treatment	1.25	-0.0158	-0.21	1.203	-0.0194	-0.26	-0.3376	-0.9942	1725866	CBDivE_014034	CC(Cc1c[nH]c2ccccc12)NC(=O)C3CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N15	compound treatment	1.231	-0.0348	-0.47	1.182	-0.0404	-0.55	-0.7213	-0.9968	1921652	CBDivE_014035	CCN(CC)CC#CC(O)(c1ccccc1)c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N16	compound treatment	1.266	2.26E-4	0.0	1.204	-0.0184	-0.25	-0.1753	-0.6985	1921653	CBDivE_014036	CCOC(=O)/C(=C(\NCc1ccccc1)/c2ccccc2)/C3=C(Cl)C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N17	compound treatment	1.241	-0.0248	-0.33	1.163	-0.0594	-0.81	-0.8092	-0.9233	1921654	CBDivE_014037	OC(=O)c1ccc(cc1/N=C/c2cccc(\C=N\c3cc(ccc3C(=O)O)[N+](=O)[O-])c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N18	compound treatment	1.262	-0.00377	-0.05	1.199	-0.0234	-0.32	-0.2617	-0.8097	1921655	CBDivE_014038	[O-][N+](=O)c1ccc(N/N=C/c2cccc(\C=N\Nc3ccc(cc3)[N+](=O)[O-])c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N19	compound treatment	1.259	-0.00677	-0.09	1.251	0.0286	0.39	0.2111	0.5271	1921656	CBDivE_014039	Brc1ccc2c(c1)c3CCCc4nccn2c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	N20	compound treatment	1.262	-0.00377	-0.05	1.202	-0.0204	-0.28	-0.2328	-0.8228	1783683	CBDivE_014040	COc1cccc(c1)c2c(no[n+]2[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O01	compound treatment	1.275	0.00923	0.12	1.218	-0.00441	-0.06	0.0455	0.3293	1921657	CBDivE_014041	Cc1cc(O)c(C2=NCCSC(C2)c3ccsc3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O02	compound treatment	1.315	0.0492	0.66	1.299	0.0766	1.04	1.2081	0.9761	1921658	CBDivE_014042	COc1ccc(cc1)n2c(CN3CCOCC3)c(C(=O)C)c4cc(O)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O03	compound treatment	1.318	0.0522	0.7	1.279	0.0566	0.77	1.0439	0.999	1921659	CBDivE_014043	CC(OS(=O)(=O)c1ccccc1)C(F)(F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O04	compound treatment	1.305	0.0392	0.53	1.278	0.0556	0.76	0.9102	0.9846	1921660	CBDivE_014044	Clc1ccc2nnc(c3ccccc3)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O05	compound treatment	1.305	0.0392	0.53	1.253	0.0306	0.42	0.6692	0.9931	1921661	CBDivE_014045	Cn1ncc([N+](=O)[O-])c1C(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O06	compound treatment	1.246	-0.0198	-0.27	1.21	-0.0124	-0.17	-0.3083	-0.9759	1087074	CBDivE_014046	CCCCCC(=O)NCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O07	compound treatment	1.266	2.26E-4	0.0	1.232	0.00959	0.13	0.0946	0.7234	1921662	CBDivE_014047	CN1CCN(Cc2n[nH]c(=S)n2c3ccc4ccccc4c3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O08	compound treatment	1.273	0.00723	0.1	1.231	0.00859	0.12	0.1518	0.9958	1194848	CBDivE_014048	Clc1ccc(cc1)C(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O09	compound treatment	1.306	0.0402	0.54	1.288	0.0656	0.89	1.0162	0.9713	1404067	CBDivE_014049	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2nn(C)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O10	compound treatment	1.288	0.0222	0.3	1.274	0.0516	0.7	0.7095	0.9277	1921663	CBDivE_014050	CC(=O)Nc1cccc(NC(=O)c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O11	compound treatment	1.269	0.00323	0.04	1.204	-0.0184	-0.25	-0.1467	-0.5759	1921664	CBDivE_014051	Clc1cccc(/C=N/c2ccc(cc2)c3nc4ccccc4s3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O12	compound treatment	1.294	0.0282	0.38	1.312	0.0896	1.22	1.1331	0.8855	1465954	CBDivE_014052	COc1ccc(CC(=O)Nc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O13	compound treatment	1.273	0.00723	0.1	1.244	0.0216	0.29	0.2771	0.8935	1302198	CBDivE_014053	CC(=O)Nc1ccc2oc(nc2c1)c3cccc(I)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O14	compound treatment	1.277	0.0112	0.15	1.278	0.0556	0.76	0.6431	0.8319	1921665	CBDivE_014054	Clc1ccc(OCCCC(=O)N2CCOCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O15	compound treatment	1.309	0.0432	0.58	1.243	0.0206	0.28	0.6109	0.9439	1046807	CBDivE_014055	OC(=O)CNc1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O16	compound treatment	1.283	0.0172	0.23	1.256	0.0336	0.46	0.4882	0.9505	1230059	CBDivE_014056	NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O17	compound treatment	1.299	0.0332	0.45	1.218	-0.00441	-0.06	0.2745	0.6069	1921666	CBDivE_014057	Fc1ccc(cc1)C2=N/C(=C\c3ccccc3F)/C(=O)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O18	compound treatment	1.291	0.0252	0.34	1.234	0.0116	0.16	0.3524	0.9392	1921667	CBDivE_014058	CCOC(=O)/C(=C\N(C)C)/C(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O19	compound treatment	1.266	2.26E-4	0.0	1.234	0.0116	0.16	0.1139	0.7206	1921668	CBDivE_014059	[O-][N+](=O)c1ccccc1/C=C/C=C/2\Sc3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	O20	compound treatment	1.338	0.0722	0.97	1.345	0.123	1.67	1.8711	0.967	1921669	CBDivE_014060	CCOC(=O)c1c2CCCCCn2c3cc(Cl)c(cc3c1=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P01	compound treatment	1.269	0.00323	0.04	1.248	0.0256	0.35	0.2775	0.7892	1921670	CBDivE_014061	O=C(CN1CCCCC1)NN(Cc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P02	compound treatment	1.249	-0.0168	-0.23	1.207	-0.0154	-0.21	-0.3086	-0.9993	1921671	CBDivE_014062	Cc1cc(C)n(n1)c2[nH]nc(C)c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P03	compound treatment	1.257	-0.00877	-0.12	1.248	0.0256	0.35	0.1631	0.4425	1921672	CBDivE_014063	CN1CCC(=CC1)/C=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P04	compound treatment	1.182	-0.0838	-1.13	1.124	-0.0984	-1.34	-1.748	-0.9964	1691263	CBDivE_014064	O=C(Nc1cccc2ccccc12)N3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P05	compound treatment	1.304	0.0382	0.52	1.258	0.0356	0.49	0.7078	0.9995	1921673	CBDivE_014065	Oc1ccc2ccccc2c1/C=N/CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P06	compound treatment	1.271	0.00523	0.07	1.219	-0.00341	-0.05	0.017	0.2013	1921674	CBDivE_014066	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P07	compound treatment	1.211	-0.0548	-0.74	1.188	-0.0344	-0.47	-0.8543	-0.976	1921675	CBDivE_014067	Cc1ccc2[nH]c3C(CCCc3c2c1)N(Cc4ccccc4)C(=O)CCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P08	compound treatment	1.185	-0.0808	-1.09	1.137	-0.0854	-1.16	-1.5941	-0.9994	1921676	CBDivE_014068	CCC/C(=N\NC(=O)CN1CCOCC1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P09	compound treatment	1.203	-0.0628	-0.85	1.157	-0.0654	-0.89	-1.2295	-0.9997	1561724	CBDivE_014069	OC(=O)CCSC(=S)N1CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P10	compound treatment	0.889	-0.377	-5.08	0.729	-0.493	-6.73	-8.3518	-0.9904	1173781	CBDivE_014070	CC1(C)CC(CC(C)(C)N1)NC(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P11	compound treatment	1.2	-0.0658	-0.89	1.148	-0.0744	-1.01	-1.3449	-0.9978	1248149	CBDivE_014071	CC1(C)CC(=O)C2=C(C1)NCC(=O)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P12	compound treatment	1.236	-0.0298	-0.4	1.201	-0.0214	-0.29	-0.4904	-0.9877	1921677	CBDivE_014072	Clc1ccc(OCC(=O)NNC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P13	compound treatment	1.186	-0.0798	-1.08	1.122	-0.1	-1.37	-1.7292	-0.9929	1921678	CBDivE_014073	CCn1c(C)c(C=O)c2cc(ccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P14	compound treatment	1.29	0.0242	0.33	1.199	-0.0234	-0.32	0.0054	0.0118	1921679	CBDivE_014074	OC(=O)C1CSC(N1)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P15	compound treatment	1.197	-0.0688	-0.93	1.141	-0.0814	-1.11	-1.441	-0.996	1921680	CBDivE_014075	Cc1c(/C=N/O)c2cc(ccc2n1C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P16	compound treatment	1.25	-0.0158	-0.21	1.178	-0.0444	-0.61	-0.5787	-0.9015	3107416	CBDivE_014076	CC(N)C1CC2CCC1C2.OC(=O)CC1(CC2CC3CC(Br)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P17	compound treatment	1.263	-0.00277	-0.04	1.204	-0.0184	-0.25	-0.204	-0.8037	1921682	CBDivE_014077	CC1(C)CC(=O)C(=C(C1)Nc2ccccc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P18	compound treatment	1.261	-0.00477	-0.06	1.237	0.0146	0.2	0.0952	0.455	1112100	CBDivE_014078	COc1ccc(cc1)C(=O)Oc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P19	compound treatment	1.244	-0.0218	-0.29	1.205	-0.0174	-0.24	-0.3756	-0.9944	1921683	CBDivE_014079	Oc1ccc2cc(ccc2c1/C=N/c3ccc(cc3)c4nc5ccccc5s4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.44	P20	compound treatment	1.293	0.0272	0.37	1.284	0.0616	0.84	0.8536	0.9312	1921684	CBDivE_014080	Oc1c(C(=O)NCC/N=C/c2ccc(Br)cc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A01	compound treatment	1.254	-0.00501	-0.07	1.215	-8.12E-4	-0.01	-0.0556	-0.8121	1921685	CBDivE_014081	FC(F)(F)C(F)(F)C(=O)Nc1ccc(cc1)c2ccc(NC(=O)C(F)(F)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A02	compound treatment	1.264	0.00499	0.07	1.225	0.00919	0.13	0.1362	0.9575	1071750	CBDivE_014082	O=C(CCCc1ccccc1)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A03	compound treatment	1.325	0.066	0.89	1.271	0.0552	0.75	1.1616	0.9965	1921686	CBDivE_014083	Oc1cc2oc(=O)ccc2cc1OS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A04	compound treatment	1.298	0.039	0.53	1.219	0.00319	0.04	0.4027	0.763	1003514	CBDivE_014084	COc1cc(cc(OC)c1OC)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A05	compound treatment	1.293	0.034	0.46	1.203	-0.0128	-0.17	0.2007	0.409	1921687	CBDivE_014085	CCOC(CCl)/S(=N\S(=O)(=O)c1ccccc1)/c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A06	compound treatment	1.293	0.034	0.46	1.27	0.0542	0.74	0.8467	0.9737	1921688	CBDivE_014086	CC(C)(C)NC(=O)c1ccc(cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A07	compound treatment	1.277	0.018	0.24	1.224	0.00819	0.11	0.2505	0.9379	1921689	CBDivE_014087	FC(F)(F)C(F)(F)C(=O)Nc1ccc(NC(=O)C(F)(F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A08	compound treatment	1.274	0.015	0.2	1.257	0.0412	0.56	0.5401	0.9048	1008505	CBDivE_014088	O=Nn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A09	compound treatment	1.26	9.87E-4	0.01	1.197	-0.0188	-0.26	-0.172	-0.6695	1921690	CBDivE_014089	C[N+](C)(C)Cc1ccc(cc1O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A10	compound treatment	1.26	9.87E-4	0.01	1.195	-0.0208	-0.28	-0.1913	-0.6732	1921691	CBDivE_014090	CC(C)OP(=O)(Nc1ccc(Cl)cc1C)OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A11	compound treatment	1.288	0.029	0.39	1.254	0.0382	0.52	0.6447	0.99	1016087	CBDivE_014091	C[N+](C)(C)c1ccc(C=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A12	compound treatment	1.279	0.02	0.27	1.223	0.00719	0.1	0.26	0.9061	1050575	CBDivE_014092	CC1OCC2OC(O)C(O)C(O)C2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A13	compound treatment	1.302	0.043	0.58	1.274	0.0582	0.79	0.9711	0.9881	1921692	CBDivE_014093	CCO/C=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A14	compound treatment	1.291	0.032	0.43	1.288	0.0722	0.98	1.0012	0.9315	1921693	CBDivE_014094	OCCCCCCOC(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A15	compound treatment	1.264	0.00499	0.07	1.199	-0.0168	-0.23	-0.1145	-0.4794	1050973	CBDivE_014095	Cc1ccc2[nH]cc(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A16	compound treatment	1.285	0.026	0.35	1.256	0.0402	0.55	0.6354	0.9767	1921694	CBDivE_014096	Cc1cc(C)n(n1)C(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A17	compound treatment	1.251	-0.00801	-0.11	1.213	-0.00281	-0.04	-0.1035	-0.9028	1921695	CBDivE_014097	CC(NC(=S)NC(c1ccccc1)(c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A18	compound treatment	1.314	0.055	0.74	1.315	0.0992	1.35	1.481	0.96	1116108	CBDivE_014098	CC1(C)OC2C(CO)OC(C2O1)n3ccc(=O)[nH]c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A19	compound treatment	1.237	-0.022	-0.3	1.195	-0.0208	-0.28	-0.4107	-0.9997	1921696	CBDivE_014099	C[N+](C)(C)Cc1c(O)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	A20	compound treatment	1.284	0.025	0.34	1.265	0.0492	0.67	0.7127	0.9493	1005873	CBDivE_014100	C=CC[N+]1(CN2CN3CN(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B01	compound treatment	1.26	9.87E-4	0.01	1.21	-0.00581	-0.08	-0.0466	-0.5801	1921697	CBDivE_014101	Cc1cc(C)nc(NC(=O)NS(=O)(=O)N2CCCCC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B02	compound treatment	1.269	0.00999	0.13	1.231	0.0152	0.21	0.2417	0.9783	1921698	CBDivE_014102	NC12CCc3nonc3C2(O)CC(=[N+]1[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B03	compound treatment	1.247	-0.012	-0.16	1.201	-0.0148	-0.2	-0.2574	-0.994	1026470	CBDivE_014103	Brc1ccc2C(=O)NC(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B04	compound treatment	1.305	0.046	0.62	1.252	0.0362	0.49	0.7876	0.9936	1026484	CBDivE_014104	[O-][N+](=O)c1ccccc1NCNc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B05	compound treatment	1.315	0.056	0.76	1.278	0.0622	0.85	1.1337	0.9983	1921699	CBDivE_014105	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N2CCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B06	compound treatment	1.293	0.034	0.46	1.247	0.0312	0.43	0.6249	0.9993	1921700	CBDivE_014106	NNC(=O)c1nc(cc(n1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B07	compound treatment	1.267	0.00799	0.11	1.24	0.0242	0.33	0.3094	0.8917	1921701	CBDivE_014107	COc1ccc(CCNC(=O)N2C(=O)c3ccccc3C2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B08	compound treatment	1.274	0.015	0.2	1.244	0.0282	0.38	0.4148	0.955	1921702	CBDivE_014108	CC(=O)Nc1ccc(cc1)/C(=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B09	compound treatment	1.256	-0.00301	-0.04	1.228	0.0122	0.17	0.0888	0.5189	1203284	CBDivE_014109	Cc1cc(C)nc(n1)n2c(Nc3ccccc3)cc(=O)c4c(C)n(c5ccccc5)c(=O)nc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B10	compound treatment	1.314	0.055	0.74	1.297	0.0812	1.11	1.3074	0.981	1921703	CBDivE_014110	CC1=CC(C)(C)NC(=S)N1c2ccc(cc2)C(=O)/C=C/c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B11	compound treatment	1.247	-0.012	-0.16	1.231	0.0152	0.21	0.0319	0.1211	1015355	CBDivE_014111	CCOC(=O)c1c(C)c(C(=O)OCC)n(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B12	compound treatment	1.263	0.00399	0.05	1.222	0.00619	0.08	0.0977	0.9764	1921704	CBDivE_014112	CC(C)c1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B13	compound treatment	1.231	-0.028	-0.38	1.182	-0.0338	-0.46	-0.5932	-0.9951	1921705	CBDivE_014113	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B14	compound treatment	1.306	0.047	0.63	1.295	0.0792	1.08	1.2118	0.9678	1076344	CBDivE_014114	C(c1ccccc1)[N+]2(CCN3CC2)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B15	compound treatment	1.249	-0.01	-0.14	1.227	0.0112	0.15	0.0124	0.0607	1921706	CBDivE_014115	CC(=O)C(N=Nc1ccc(Br)cc1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B16	compound treatment	1.254	-0.00501	-0.07	1.247	0.0312	0.43	0.2529	0.5873	1921707	CBDivE_014116	CCNc1nc(OCC(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B17	compound treatment	1.294	0.035	0.47	1.27	0.0542	0.74	0.8563	0.9766	1921708	CBDivE_014117	Ic1ccc(NN=Nc2ccc(I)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B18	compound treatment	1.281	0.022	0.3	1.222	0.00619	0.08	0.2694	0.8736	1921709	CBDivE_014118	COc1cc(NC(=O)/C=C/C)c(OC)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B19	compound treatment	1.253	-0.00601	-0.08	1.223	0.00719	0.1	0.012	0.094	1054388	CBDivE_014119	C[N+](C)(C)c1ccc(cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	B20	compound treatment	1.265	0.00599	0.08	1.232	0.0162	0.22	0.2132	0.907	1921710	CBDivE_014120	COc1ccc(NC(=O)/C=C/C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C01	compound treatment	1.15	-0.109	-1.47	1.18	-0.0358	-0.49	-1.3852	-0.8939	1921711	CBDivE_014121	S=C(NCc1ccccc1)NC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C02	compound treatment	1.266	0.00699	0.09	1.272	0.0562	0.77	0.6084	0.7882	1142573	CBDivE_014122	CC(NC(=O)c1ccc(cc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C03	compound treatment	1.202	-0.057	-0.77	1.197	-0.0188	-0.26	-0.7253	-0.8945	1921712	CBDivE_014123	OC(=O)c1ccc(NC(=O)C(F)(F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C04	compound treatment	1.293	0.034	0.46	1.241	0.0252	0.34	0.5671	0.9899	1003036	CBDivE_014124	CCOC(=O)c1[nH]c(C)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C05	compound treatment	1.279	0.02	0.27	1.202	-0.0138	-0.19	0.0575	0.1748	1921713	CBDivE_014125	Cc1ccc(cc1)S(=O)(=O)OC[C@H]2O[C@H](C[C@@H]2O)n3cnc4c(=O)[nH]c(NC(=O)c5ccccc5)nc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C06	compound treatment	1.281	0.022	0.3	1.227	0.0112	0.15	0.3176	0.9522	1779480	CBDivE_014126	CN1CCN(CC1)C(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C07	compound treatment	1.272	0.013	0.18	1.234	0.0182	0.25	0.2993	0.9855	1413314	CBDivE_014127	COc1ccc(CC(=O)Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C08	compound treatment	1.286	0.027	0.36	1.249	0.0332	0.45	0.5775	0.9942	1921714	CBDivE_014128	C/C=C/C(=O)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C09	compound treatment	1.232	-0.027	-0.36	1.197	-0.0188	-0.26	-0.4391	-0.9852	1009853	CBDivE_014129	COc1ccc(N=[N+]([O-])c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C10	compound treatment	1.266	0.00699	0.09	1.256	0.0402	0.55	0.4542	0.8167	1921715	CBDivE_014130	Clc1cccc(NC(=O)/C=C/c2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C11	compound treatment	1.27	0.011	0.15	1.235	0.0192	0.26	0.2898	0.9638	1921716	CBDivE_014131	CC[N+](C)(CC)CC(=O)Nc1c(C)cccc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C12	compound treatment	1.296	0.037	0.5	1.27	0.0542	0.74	0.8753	0.9817	1921717	CBDivE_014132	OCCCCCCOC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C13	compound treatment	1.25	-0.00901	-0.12	1.169	-0.0468	-0.64	-0.5374	-0.8269	1921718	CBDivE_014133	CN1C(=O)/C(=C/2\SC(=S)N(C2=O)c3ccc(cc3)C(=O)O)/c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C14	compound treatment	1.31	0.051	0.69	1.258	0.0422	0.58	0.8932	0.9961	1921719	CBDivE_014134	Brc1cccc(c1)C(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C15	compound treatment	1.315	0.056	0.76	1.266	0.0502	0.68	1.018	0.9988	1921720	CBDivE_014135	Brc1ccc(cc1)C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C16	compound treatment	1.284	0.025	0.34	1.253	0.0372	0.51	0.5969	0.9803	1697308	CBDivE_014136	CN1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C17	compound treatment	1.263	0.00399	0.05	1.186	-0.0298	-0.41	-0.2494	-0.6082	1921721	CBDivE_014137	CC(CNC(=O)C(F)(F)C(F)(F)F)NC(=O)C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C18	compound treatment	1.305	0.046	0.62	1.251	0.0352	0.48	0.778	0.9919	1703505	CBDivE_014138	Clc1ccc(OCC(=O)N2CCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C19	compound treatment	1.228	-0.031	-0.42	1.166	-0.0498	-0.68	-0.7761	-0.9729	1921722	CBDivE_014139	CC1=[N+]([O-])C(N2CCOCC2)C(O)(C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	C20	compound treatment	1.242	-0.017	-0.23	1.191	-0.0248	-0.34	-0.4015	-0.9821	1494588	CBDivE_014140	COc1ccccc1NC(=O)c2cc(OC)c(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D01	compound treatment	1.298	0.039	0.53	1.239	0.0232	0.32	0.5955	0.9704	1921723	CBDivE_014141	COc1ccc(cc1)c2sc(cc2CC(=O)O)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D02	compound treatment	1.239	-0.02	-0.27	1.215	-8.12E-4	-0.01	-0.1987	-0.7355	1921724	CBDivE_014142	CCOC(=O)c1ccc(Nc2nc(NC)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D03	compound treatment	1.228	-0.031	-0.42	1.206	-0.00981	-0.13	-0.3904	-0.8889	1921725	CBDivE_014143	Oc1ccc(Cl)cc1/C=N/CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D04	compound treatment	1.268	0.00899	0.12	1.214	-0.00181	-0.02	0.0683	0.5517	1921726	CBDivE_014144	Oc1c(Br)cc(Cl)cc1/C=C/2\Sc3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D05	compound treatment	1.258	-0.00101	-0.01	1.211	-0.00481	-0.07	-0.0561	-0.8364	1921727	CBDivE_014145	CC[N+](CC)(CC)Cc1ccc(o1)C(O)(C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D06	compound treatment	1.252	-0.00701	-0.09	1.218	0.00219	0.03	-0.0458	-0.4617	1015360	CBDivE_014146	CCOC(=O)C(N=Nc1ccccc1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D07	compound treatment	1.253	-0.00601	-0.08	1.234	0.0182	0.25	0.118	0.4523	1921728	CBDivE_014147	CC(C)N(C(C)C)C(=O)CCCOc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D08	compound treatment	1.251	-0.00801	-0.11	1.209	-0.00681	-0.09	-0.1421	-0.9972	1334728	CBDivE_014148	NC(=O)c1cc(ccc1O)c2csc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D09	compound treatment	1.275	0.016	0.22	1.238	0.0222	0.3	0.3665	0.9862	1921729	CBDivE_014149	O=C/1NC(=S)S\C1=C\2/OC(=O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D10	compound treatment	1.23	-0.029	-0.39	1.204	-0.0118	-0.16	-0.3907	-0.923	1710588	CBDivE_014150	CC(=O)Nc1nc(cs1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D11	compound treatment	1.244	-0.015	-0.2	1.182	-0.0338	-0.46	-0.4692	-0.9318	1654518	CBDivE_014151	CC(=O)Nc1cccc(NC(=O)c2ccccc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D12	compound treatment	1.264	0.00499	0.07	1.246	0.0302	0.41	0.3387	0.8119	1407090	CBDivE_014152	COc1cccc(c1)c2nnc(o2)c3cc(Cl)cc(Cl)c3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D13	compound treatment	1.309	0.05	0.67	1.275	0.0592	0.81	1.0476	0.996	1921730	CBDivE_014153	CCC(C)NC(=S)NC(c1ccccc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D14	compound treatment	1.278	0.019	0.26	1.259	0.0432	0.59	0.5976	0.9305	1921731	CBDivE_014154	Nc1ccccc1/C=N/CCC\N=C\c2ccccc2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D15	compound treatment	1.214	-0.045	-0.61	1.187	-0.0288	-0.39	-0.7072	-0.9778	1315656	CBDivE_014155	COc1ccc(CC(=O)Nc2ccc(cc2)C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D16	compound treatment	1.284	0.025	0.34	1.229	0.0132	0.18	0.3655	0.9567	1921732	CBDivE_014156	CC1(C)CC(=O)C(N=Nc2ccccc2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D17	compound treatment	1.269	0.00999	0.13	1.226	0.0102	0.14	0.1935	0.9999	1646192	CBDivE_014157	COc1ccc(CC(=O)N(Cc2ccccc2)Cc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D18	compound treatment	1.262	0.00299	0.04	1.22	0.00419	0.06	0.0689	0.9854	1048683	CBDivE_014158	Clc1ccc(NN=Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D19	compound treatment	1.275	0.016	0.22	1.221	0.00519	0.07	0.2025	0.8923	1653440	CBDivE_014159	COc1ccc(CC(=O)Nc2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	D20	compound treatment	1.264	0.00499	0.07	1.24	0.0242	0.33	0.2808	0.8342	1921733	CBDivE_014160	COc1ccc(cc1)c2sc(cc2CC(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E01	compound treatment	1.207	-0.052	-0.7	1.16	-0.0558	-0.76	-1.0343	-0.9992	1921734	CBDivE_014161	O/N=C/1\CCCC2=[N+]([O-])C3(CCCCC3C21O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E02	compound treatment	1.285	0.026	0.35	1.296	0.0802	1.09	1.0211	0.8892	1921735	CBDivE_014162	CN1CCN(CC1)C(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E03	compound treatment	1.267	0.00799	0.11	1.224	0.00819	0.11	0.1551	0.9998	1921736	CBDivE_014163	N=C1N(Cc2ccccc2)Cc3ccccc3C41CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E04	compound treatment	1.277	0.018	0.24	1.251	0.0352	0.48	0.5109	0.9501	1921737	CBDivE_014164	Brc1ccc(cc1)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E05	compound treatment	1.248	-0.011	-0.15	1.207	-0.00881	-0.12	-0.19	-0.9945	1082929	CBDivE_014165	Nc1cc2nc3ccccc3sc2cc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E06	compound treatment	1.251	-0.00801	-0.11	1.222	0.00619	0.08	-0.0168	-0.1223	1921738	CBDivE_014166	Cc1cccc(C)c1NC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E07	compound treatment	1.259	-1.25E-5	0.0	1.213	-0.00281	-0.04	-0.0272	-0.7102	1779116	CBDivE_014167	CCOC(=O)CCc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E08	compound treatment	1.261	0.00199	0.03	1.255	0.0392	0.53	0.3968	0.7417	1013660	CBDivE_014168	Clc1ccccc1C(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E09	compound treatment	1.27	0.011	0.15	1.252	0.0362	0.49	0.4538	0.8806	1921739	CBDivE_014169	CCCOC(=O)CCNc1n[nH]c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E10	compound treatment	1.272	0.013	0.18	1.26	0.0442	0.6	0.55	0.8764	1921740	CBDivE_014170	Clc1ccc(NC(=O)/C=C/c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E11	compound treatment	1.224	-0.035	-0.47	1.174	-0.0418	-0.57	-0.7372	-0.9956	1921741	CBDivE_014171	[O-][N+](=O)c1cc(ccc1N2CCCCC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E12	compound treatment	1.287	0.028	0.38	1.264	0.0482	0.66	0.7316	0.9654	1921742	CBDivE_014172	Clc1ccc(Cl)c(NC(=O)/C=C/c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E13	compound treatment	1.254	-0.00501	-0.07	1.202	-0.0138	-0.19	-0.181	-0.9045	1921743	CBDivE_014173	CC(C)c1ccc(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E14	compound treatment	1.258	-0.00101	-0.01	1.283	0.0672	0.92	0.6382	0.6965	1921744	CBDivE_014174	[O-][N+](=O)c1ccccc1C(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E15	compound treatment	1.249	-0.01	-0.14	1.166	-0.0498	-0.68	-0.5758	-0.8314	1921745	CBDivE_014175	OC1CN=CC(=CN1c2ccncc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E16	compound treatment	1.269	0.00999	0.13	1.253	0.0372	0.51	0.4539	0.865	1921746	CBDivE_014176	Cc1cc(C)n(n1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E17	compound treatment	1.234	-0.025	-0.34	1.18	-0.0358	-0.49	-0.5839	-0.9837	1590083	CBDivE_014177	COC(=O)c1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E18	compound treatment	1.287	0.028	0.38	1.24	0.0242	0.33	0.5002	0.9977	1777045	CBDivE_014178	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E19	compound treatment	1.257	-0.00201	-0.03	1.201	-0.0148	-0.2	-0.162	-0.795	1921747	CBDivE_014179	CC(=O)Nc1ccc(NC(=S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	E20	compound treatment	1.299	0.04	0.54	1.28	0.0642	0.88	1.0004	0.973	1921748	CBDivE_014180	S=C(NNc1ccccc1)NC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F01	compound treatment	1.231	-0.028	-0.38	1.173	-0.0428	-0.58	-0.68	-0.9778	1573369	CBDivE_014181	COc1ccc(CC(=O)Nc2cccc(Cl)c2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F02	compound treatment	1.229	-0.03	-0.4	1.187	-0.0288	-0.39	-0.5641	-0.9999	1921749	CBDivE_014182	CC1=[N+]([O-])C2(N)CCc3nonc3C2(O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F03	compound treatment	1.24	-0.019	-0.26	1.172	-0.0438	-0.6	-0.6038	-0.9287	1921750	CBDivE_014183	COc1ccc(CC(=O)Nc2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F04	compound treatment	1.223	-0.036	-0.49	1.172	-0.0438	-0.6	-0.766	-0.9947	1921751	CBDivE_014184	ClC(Cl)(Cl)C(NC(=O)c1cccnc1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F05	compound treatment	1.278	0.019	0.26	1.227	0.0112	0.15	0.289	0.9694	1570173	CBDivE_014185	CCc1ccccc1NC(=O)c2cc(OC)c(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F06	compound treatment	1.247	-0.012	-0.16	1.18	-0.0358	-0.49	-0.4599	-0.8938	1921752	CBDivE_014186	O=C1N(C[n+]2ccccc2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F07	compound treatment	1.271	0.012	0.16	1.227	0.0112	0.15	0.2222	0.9996	1571921	CBDivE_014187	COc1ccccc1NC(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F08	compound treatment	1.223	-0.036	-0.49	1.183	-0.0328	-0.45	-0.6599	-0.9992	1921753	CBDivE_014188	[O-][N+](=O)c1ccc(/C=C/C=N/c2ccc3[nH]c(=O)[nH]c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F09	compound treatment	1.247	-0.012	-0.16	1.216	1.88E-4	0.0	-0.1128	-0.6958	1500659	CBDivE_014189	NS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F10	compound treatment	1.305	0.046	0.62	1.291	0.0752	1.03	1.1637	0.971	1191854	CBDivE_014190	OC(=O)c1cc(nc2ccccc12)C3CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F11	compound treatment	1.326	0.067	0.9	1.318	0.102	1.39	1.6244	0.978	1921754	CBDivE_014191	Cc1c(Cl)c(C)c(C=O)c(O)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F12	compound treatment	1.348	0.089	1.2	1.311	0.0952	1.3	1.7667	0.9992	1921755	CBDivE_014192	C(=N/c1nc[nH]n1)\c2ccc(C#Cc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F13	compound treatment	1.245	-0.014	-0.19	1.203	-0.0128	-0.17	-0.2572	-0.9992	1165417	CBDivE_014193	CC(C)COc1ccc2n3CCNC4CCCc(c43)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F14	compound treatment	1.264	0.00499	0.07	1.199	-0.0168	-0.23	-0.1145	-0.4794	1472221	CBDivE_014194	Cc1ccc(NC(c2ccccc2)c3ccc4cccnc4c3O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F15	compound treatment	1.222	-0.037	-0.5	1.183	-0.0328	-0.45	-0.6695	-0.9985	1921756	CBDivE_014195	OC(CNCC(O)COc1ccc(F)cc1)COc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F16	compound treatment	1.262	0.00299	0.04	1.237	0.0212	0.29	0.2328	0.798	1551838	CBDivE_014196	CC(C)NCC(O)C1COc2ccccc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F17	compound treatment	1.204	-0.055	-0.74	1.186	-0.0298	-0.41	-0.8122	-0.9599	1921757	CBDivE_014197	CC1(C)N=C/2C(=[N+]1[O-])CCC\C2=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F18	compound treatment	1.265	0.00599	0.08	1.245	0.0292	0.4	0.3386	0.8336	1011185	CBDivE_014198	Nc1ccc2nc3ccc(N)cc3[n+](c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F19	compound treatment	1.249	-0.01	-0.14	1.179	-0.0368	-0.5	-0.4505	-0.8666	1376524	CBDivE_014199	O=C(CC1(CC2CC3CC(C2)C1)C3)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	F20	compound treatment	1.269	0.00999	0.13	1.251	0.0352	0.48	0.4346	0.8719	1534081	CBDivE_014200	COc1cccc(C2NCCc3cc(OC)c(OC)cc23)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G01	compound treatment	1.251	-0.00801	-0.11	1.191	-0.0248	-0.34	-0.3157	-0.8888	1921758	CBDivE_014201	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G02	compound treatment	1.243	-0.016	-0.22	1.204	-0.0118	-0.16	-0.2666	-0.9895	1921759	CBDivE_014202	CC(=O)Nc1ccc(NC(=O)C(F)(F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G03	compound treatment	1.238	-0.021	-0.28	1.165	-0.0508	-0.69	-0.6904	-0.9222	1444423	CBDivE_014203	CN1CCN(CC1)C(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G04	compound treatment	1.231	-0.028	-0.38	1.229	0.0132	0.18	-0.1401	-0.3346	1921760	CBDivE_014204	CC(=O)Nc1ccc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G05	compound treatment	1.215	-0.044	-0.59	1.162	-0.0538	-0.73	-0.9387	-0.9945	1703578	CBDivE_014205	O=C(Nc1ccccc1)Nc2ccccc2NC(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G06	compound treatment	1.258	-0.00101	-0.01	1.227	0.0112	0.15	0.0982	0.6412	1921761	CBDivE_014206	COC(=O)CCN(N=O)c1cccc(c1)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G07	compound treatment	1.271	0.012	0.16	1.238	0.0222	0.3	0.3283	0.9569	1741040	CBDivE_014207	Cc1ccc(NC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G08	compound treatment	1.256	-0.00301	-0.04	1.24	0.0242	0.33	0.2045	0.6153	1019887	CBDivE_014208	OC1(C(=O)Nc2ccccc21)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G09	compound treatment	1.248	-0.011	-0.15	1.192	-0.0238	-0.32	-0.3347	-0.9372	1921762	CBDivE_014209	O=C(NCc1ccccc1)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G10	compound treatment	1.257	-0.00201	-0.03	1.232	0.0162	0.22	0.1369	0.6155	1921763	CBDivE_014210	C=CCCC(=O)NCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G11	compound treatment	1.236	-0.023	-0.31	1.169	-0.0468	-0.64	-0.6709	-0.9452	1005564	CBDivE_014211	CC(=O)Nc1ccc(cc1)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G12	compound treatment	1.269	0.00999	0.13	1.28	0.0642	0.88	0.7142	0.8065	1014464	CBDivE_014212	CCOP(=O)(Nc1ccccc1)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G13	compound treatment	1.238	-0.021	-0.28	1.162	-0.0538	-0.73	-0.7193	-0.9144	1665208	CBDivE_014213	O=C(Oc1cccc2ccccc12)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G14	compound treatment	1.321	0.062	0.84	1.323	0.107	1.46	1.6249	0.9649	1013636	CBDivE_014214	OC(=O)c1cc2ccccc2oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G15	compound treatment	1.273	0.014	0.19	1.194	-0.0218	-0.3	-0.0769	-0.2183	1921764	CBDivE_014215	CON/C(=C/1\NC(c2ccccc2)c3ccccc3C(=O)N1)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G16	compound treatment	1.254	-0.00501	-0.07	1.234	0.0182	0.25	0.1276	0.4962	1720564	CBDivE_014216	CC1(C)CC(CC(C)(C)N1)NC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G17	compound treatment	1.282	0.023	0.31	1.25	0.0342	0.47	0.5489	0.9804	1921765	CBDivE_014217	[O-][N+](=O)c1cccc(/C=C/C(=O)Nc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G18	compound treatment	1.291	0.032	0.43	1.237	0.0212	0.29	0.5094	0.981	3023202	CBDivE_014218	CC(N)C1CC2CCC1C2.OC(=O)COc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G19	compound treatment	1.313	0.054	0.73	1.263	0.0472	0.64	0.97	0.9981	1218659	CBDivE_014219	O=C(c1ccc(cc1)c2ccccc2)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	G20	compound treatment	1.288	0.029	0.39	1.305	0.0892	1.22	1.1365	0.8896	1775556	CBDivE_014220	COc1ccc(cc1)c2csc(=Nc3cccc(C)c3)n2c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H01	compound treatment	1.209	-0.05	-0.67	1.153	-0.0628	-0.86	-1.0827	-0.993	1921766	CBDivE_014221	CC(/N=C/c1ccccc1O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H02	compound treatment	1.211	-0.048	-0.65	1.193	-0.0228	-0.31	-0.678	-0.9435	1921767	CBDivE_014222	Oc1ccccc1/C=N/CCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H03	compound treatment	1.241	-0.018	-0.24	1.186	-0.0298	-0.41	-0.4593	-0.9697	1921768	CBDivE_014223	Cc1nn2c(n[n+]3c(C)cc(C)nc23)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H04	compound treatment	1.228	-0.031	-0.42	1.198	-0.0178	-0.24	-0.4676	-0.9665	1921769	CBDivE_014224	CC(C)(C)C(=O)N(Cc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H05	compound treatment	1.275	0.016	0.22	1.224	0.00819	0.11	0.2315	0.953	1921770	CBDivE_014225	CC(C)(C)NS(=O)(=O)c1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H06	compound treatment	1.114	-0.145	-1.96	1.157	-0.0588	-0.8	-1.9504	-0.9225	1921771	CBDivE_014226	CC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H07	compound treatment	1.273	0.014	0.19	1.241	0.0252	0.34	0.3763	0.9602	1009294	CBDivE_014227	Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H08	compound treatment	1.245	-0.014	-0.19	1.176	-0.0398	-0.54	-0.5176	-0.9003	1032451	CBDivE_014228	CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H09	compound treatment	1.232	-0.027	-0.36	1.197	-0.0188	-0.26	-0.4391	-0.9852	1921772	CBDivE_014229	CCc1nn2cc(nc2s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H10	compound treatment	1.233	-0.026	-0.35	1.222	0.00619	0.08	-0.1885	-0.5222	1921773	CBDivE_014230	CC(C)Nc1nc(OCC(F)(F)F)nc(n1)N(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H11	compound treatment	1.228	-0.031	-0.42	1.2	-0.0158	-0.22	-0.4483	-0.9525	1005868	CBDivE_014231	O=C(NNc1ccccc1)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H12	compound treatment	1.238	-0.021	-0.28	1.202	-0.0138	-0.19	-0.3336	-0.9803	1921774	CBDivE_014232	CC/C(=C/c1sc2ccc3ccccc3c2[n+]1C)/SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H13	compound treatment	1.285	0.026	0.35	1.292	0.0762	1.04	0.9825	0.8961	1010916	CBDivE_014233	CN(C)c1ccc(N=Nc2ccc(cc2)S(=O)(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H14	compound treatment	1.281	0.022	0.3	1.252	0.0362	0.49	0.5587	0.9703	1879042	CBDivE_014234	Cn1c(CN2CCOCC2)nc(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H15	compound treatment	1.253	-0.00601	-0.08	1.2	-0.0158	-0.22	-0.2098	-0.9108	1921775	CBDivE_014235	CCC/C(=C\1/C(=O)CC(C)(C)C(C(=O)OC)C1=O)/NNc2nc3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H16	compound treatment	1.255	-0.00401	-0.05	1.209	-0.00681	-0.09	-0.104	-0.967	1706806	CBDivE_014236	CC(=O)NCCc1c[nH]c2ccc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H17	compound treatment	1.228	-0.031	-0.42	1.17	-0.0458	-0.62	-0.7376	-0.981	1921776	CBDivE_014237	COc1ccc(Cc2nc(C)ccc2OC(=O)C3(CC4CC5CC(C4)C3)C5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H18	compound treatment	1.25	-0.00901	-0.12	1.131	-0.0848	-1.16	-0.9038	-0.7772	1147103	CBDivE_014238	COC(=O)Nc1ccc(cc1)S(=O)(=O)NCCc2c[nH]c3ccc(OC)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H19	compound treatment	1.228	-0.031	-0.42	1.221	0.00519	0.07	-0.2458	-0.5793	1921777	CBDivE_014239	COc1cccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	H20	compound treatment	1.269	0.00999	0.13	1.27	0.0542	0.74	0.6178	0.8225	1921778	CBDivE_014240	Cc1cc(O)c(C2=NCCSC(C2)c3cccc(I)c3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I01	compound treatment	1.233	-0.026	-0.35	1.211	-0.00481	-0.07	-0.2945	-0.825	1921779	CBDivE_014241	Cc1cccc(c1)C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I02	compound treatment	1.261	0.00199	0.03	1.231	0.0152	0.21	0.1654	0.792	1341270	CBDivE_014242	O=C(Nc1ccc2OCOc2c1)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I03	compound treatment	1.264	0.00499	0.07	1.22	0.00419	0.06	0.088	0.9967	1206414	CBDivE_014243	CCc1ccccc1NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I04	compound treatment	1.254	-0.00501	-0.07	1.209	-0.00681	-0.09	-0.1135	-0.9878	1921780	CBDivE_014244	CC(C)(C)c1cc(/C=N/O)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I05	compound treatment	1.335	0.076	1.03	1.267	0.0512	0.7	1.2184	0.9825	1921781	CBDivE_014245	Cc1cccc(c1)C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I06	compound treatment	1.22	-0.039	-0.53	1.18	-0.0358	-0.49	-0.7175	-0.9993	1243882	CBDivE_014246	CN(C)CCOC(=O)c1oc2c3OCCOc3ccc2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I07	compound treatment	1.269	0.00999	0.13	1.198	-0.0178	-0.24	-0.0765	-0.2753	1921782	CBDivE_014247	[O-][N+](=O)c1ccc(CC(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I08	compound treatment	1.247	-0.012	-0.16	1.215	-8.12E-4	-0.01	-0.1224	-0.7537	1921783	CBDivE_014248	O=C(NCCc1n[nH]c(CCN2C(=O)c3ccccc3C2=O)n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I09	compound treatment	1.268	0.00899	0.12	1.222	0.00619	0.08	0.1454	0.9843	1921784	CBDivE_014249	Cc1cccc(c1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I10	compound treatment	1.267	0.00799	0.11	1.251	0.0352	0.48	0.4155	0.8449	1921785	CBDivE_014250	C1Cc2nn3c(c2C1)n4nc5CCCc5c4n6nc7CCCc7c36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I11	compound treatment	1.235	-0.024	-0.32	1.134	-0.0818	-1.12	-1.0179	-0.8762	1359939	CBDivE_014251	CCOc1ccc(NC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I12	compound treatment	1.285	0.026	0.35	1.279	0.0632	0.86	0.8572	0.9215	1776091	CBDivE_014252	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I13	compound treatment	1.329	0.07	0.94	1.257	0.0412	0.56	1.0648	0.9692	1921786	CBDivE_014253	Cc1ccc(/C=N/C(=N\NC(=O)c2ccccc2)/c3ccccc3)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I14	compound treatment	1.294	0.035	0.47	1.24	0.0242	0.33	0.567	0.9846	1921787	CBDivE_014254	Cc1cc(C)c(NC(=O)C2CCCN2N)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I15	compound treatment	1.251	-0.00801	-0.11	1.144	-0.0718	-0.98	-0.7689	-0.7804	1593944	CBDivE_014255	C(N1CCOCC1)n2c3ccccc3c4nc5ccccc5nc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I16	compound treatment	1.282	0.023	0.31	1.232	0.0162	0.22	0.3754	0.9861	1921788	CBDivE_014256	CCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I17	compound treatment	1.295	0.036	0.49	1.21	-0.00581	-0.08	0.2873	0.5839	1921789	CBDivE_014257	NCCCC1(CC2CC3CC(O)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I18	compound treatment	1.279	0.02	0.27	1.22	0.00419	0.06	0.2311	0.8383	1722186	CBDivE_014258	COc1cc(C#CC(C)(C)O)c(OC)cc1C#CC(C)(C)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I19	compound treatment	1.266	0.00699	0.09	1.21	-0.00581	-0.08	0.0106	0.0862	1584268	CBDivE_014259	O=C(NCc1ccccn1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	I20	compound treatment	1.258	-0.00101	-0.01	1.236	0.0202	0.28	0.185	0.6712	1921790	CBDivE_014260	Cc1cc(C)nc(NC(=O)NS(=O)(=O)Nc2c(C)cccc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J01	compound treatment	1.25	-0.00901	-0.12	1.228	0.0122	0.17	0.0315	0.1532	1921791	CBDivE_014261	CSC(=S)N/N=C/1\CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J02	compound treatment	1.238	-0.021	-0.28	1.18	-0.0358	-0.49	-0.5458	-0.9665	1921792	CBDivE_014262	CCOC(=O)c1c(C)c(C)sc1/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J03	compound treatment	1.262	0.00299	0.04	1.223	0.00719	0.1	0.0978	0.9229	1776084	CBDivE_014263	CCC1CCCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J04	compound treatment	1.243	-0.016	-0.22	1.171	-0.0448	-0.61	-0.5848	-0.9024	1560284	CBDivE_014264	C(C#Cc1ccc(C#CCN2CCOCC2)cc1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J05	compound treatment	1.242	-0.017	-0.23	1.177	-0.0388	-0.53	-0.5365	-0.9301	1921793	CBDivE_014265	OS(=O)(=O)c1ccc(N/N=C/c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J06	compound treatment	1.246	-0.013	-0.18	1.197	-0.0188	-0.26	-0.3055	-0.9829	1591645	CBDivE_014266	Cc1ccc2n3CCNC4CCc(c43)c(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J07	compound treatment	1.246	-0.013	-0.18	1.2	-0.0158	-0.22	-0.2766	-0.9948	1921794	CBDivE_014267	CCOC(=O)C(N=Nc1ccc(cc1)[N+](=O)[O-])C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J08	compound treatment	1.272	0.013	0.18	1.225	0.00919	0.13	0.2125	0.9865	1307123	CBDivE_014268	COc1ccc(NC2CC(=O)N(C2=O)c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J09	compound treatment	1.258	-0.00101	-0.01	1.235	0.0192	0.26	0.1754	0.6693	1921795	CBDivE_014269	[O-][N+](=O)c1ccc(N/N=C\2/c3ccccc3-c4nc5ccccc5nc24)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J10	compound treatment	1.244	-0.015	-0.2	1.189	-0.0268	-0.37	-0.4017	-0.9612	1921796	CBDivE_014270	ClCC(=O)NCCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J11	compound treatment	1.283	0.024	0.32	1.236	0.0202	0.28	0.4235	0.9968	1921797	CBDivE_014271	Oc1ccc(Cl)cc1/C=N/NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J12	compound treatment	1.258	-0.00101	-0.01	1.191	-0.0248	-0.34	-0.2489	-0.7351	1473441	CBDivE_014272	O=C(OC1=C(C(=O)c2ccccc12)c3ccccc3)c4cc5ccccc5oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J13	compound treatment	1.228	-0.031	-0.42	1.184	-0.0318	-0.43	-0.6026	-0.9998	1921798	CBDivE_014273	CC(C)(C)NCC1(CO)SC(=NC1=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J14	compound treatment	1.219	-0.04	-0.54	1.151	-0.0648	-0.88	-1.0066	-0.972	1921799	CBDivE_014274	OCCCNC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J15	compound treatment	1.281	0.022	0.3	1.237	0.0212	0.29	0.414	0.9999	1170019	CBDivE_014275	CC(=O)NCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J16	compound treatment	1.23	-0.029	-0.39	1.164	-0.0518	-0.71	-0.7764	-0.9612	1921800	CBDivE_014276	C1Oc2ccc(/C=N/Nc3ccccn3)cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J17	compound treatment	1.253	-0.00601	-0.08	1.222	0.00619	0.08	0.0023	0.0198	1921801	CBDivE_014277	CSC(=S)N/N=C/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J18	compound treatment	1.288	0.029	0.39	1.22	0.00419	0.06	0.3169	0.8019	1921802	CBDivE_014278	NS(=O)(=O)c1ccc(NCCCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J19	compound treatment	1.227	-0.032	-0.43	1.187	-0.0288	-0.39	-0.5832	-0.9989	1061085	CBDivE_014279	NCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	J20	compound treatment	1.231	-0.028	-0.38	1.19	-0.0258	-0.35	-0.5161	-0.9994	1441630	CBDivE_014280	CCOC(=O)C(C)Oc1cc2occ(c3nc(C)cs3)c(=O)c2cc1CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K01	compound treatment	1.245	-0.014	-0.19	1.193	-0.0228	-0.31	-0.3536	-0.9715	1921803	CBDivE_014281	COc1ccc(/C=C/2\Nc3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K02	compound treatment	1.278	0.019	0.26	1.245	0.0292	0.4	0.4626	0.9773	1198794	CBDivE_014282	Oc1c(C(CC(=O)c2ccc(cc2)c3ccccc3)c4ccccc4)c(=O)oc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K03	compound treatment	1.261	0.00199	0.03	1.165	-0.0508	-0.69	-0.471	-0.6792	1920147	CBDivE_014283	NC1=NN=C(CS1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K04	compound treatment	1.223	-0.036	-0.49	1.19	-0.0258	-0.35	-0.5924	-0.9875	1387263	CBDivE_014284	O=C(CCCN1C(=O)c2ccccc2C1=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K05	compound treatment	1.282	0.023	0.31	1.192	-0.0238	-0.32	-0.0103	-0.023	1362607	CBDivE_014285	Fc1c(F)c(Oc2ccc3C(=O)NC(=O)c3c2)c(F)c(F)c1Oc4ccc5C(=O)NC(=O)c5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K06	compound treatment	1.298	0.039	0.53	1.276	0.0602	0.82	0.9523	0.9769	1779478	CBDivE_014286	CN1CCN(CC1)C(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K07	compound treatment	1.218	-0.041	-0.55	1.174	-0.0418	-0.57	-0.7944	-0.9999	1679862	CBDivE_014287	COc1cccc(c1)C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K08	compound treatment	1.247	-0.012	-0.16	1.221	0.00519	0.07	-0.0646	-0.3651	1921804	CBDivE_014288	Oc1ccc(cc1)C(=O)N/N=C/c2cc(Cl)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K09	compound treatment	1.235	-0.024	-0.32	1.167	-0.0488	-0.67	-0.6997	-0.9452	1921805	CBDivE_014289	NCC1(CC2CC3C1)CC(C2)(C3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K10	compound treatment	1.273	0.014	0.19	1.269	0.0532	0.73	0.6463	0.8624	1921806	CBDivE_014290	Oc1c(C(=O)NCCCCCC/N=C/c2ccccc2)c(=O)oc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K11	compound treatment	1.264	0.00499	0.07	1.178	-0.0378	-0.52	-0.317	-0.6097	1921807	CBDivE_014291	COc1ccc(cc1)/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K12	compound treatment	1.264	0.00499	0.07	1.212	-0.00381	-0.05	0.0108	0.1273	1921808	CBDivE_014292	OS(=O)(=O)CCC[n+]1c(/C=C/Nc2ccccc2)oc3ccc(cc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K13	compound treatment	1.269	0.00999	0.13	1.194	-0.0218	-0.3	-0.115	-0.3523	1776089	CBDivE_014293	COc1ccc(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K14	compound treatment	1.327	0.068	0.92	1.338	0.122	1.67	1.8267	0.9604	1285147	CBDivE_014294	COC(=O)c1ccccc1NC(=O)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K15	compound treatment	1.261	0.00199	0.03	1.186	-0.0298	-0.41	-0.2685	-0.659	1311922	CBDivE_014295	CN1CCc2oc3ccc(N)cc3c2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K16	compound treatment	1.285	0.026	0.35	1.255	0.0392	0.53	0.6258	0.9791	1921809	CBDivE_014296	CS(=O)(=O)c1ccc2cc(ccc2c1)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K17	compound treatment	1.295	0.036	0.49	1.247	0.0312	0.43	0.644	0.9978	1921810	CBDivE_014297	Cc1cc(C)nc(NC(=O)NS(=O)(=O)N(Cc2ccccc2)c3ccccn3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K18	compound treatment	1.296	0.037	0.5	1.231	0.0152	0.21	0.4993	0.9242	1706330	CBDivE_014298	CN(C)CCCn1c(csc1=Nc2ccccc2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K19	compound treatment	1.254	-0.00501	-0.07	1.155	-0.0608	-0.83	-0.6342	-0.7622	1405772	CBDivE_014299	Oc1ccc(CCc2ncccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	K20	compound treatment	1.264	0.00499	0.07	1.237	0.0212	0.29	0.2519	0.8491	1873877	CBDivE_014300	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)c2csc(=Nc3ccccc3)n2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L01	compound treatment	1.25	-0.00901	-0.12	1.23	0.0142	0.19	0.0508	0.2225	1921811	CBDivE_014301	OC(=O)c1ccccc1c2c3cc(I)c(O)cc3oc4cc(=O)c(I)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L02	compound treatment	1.225	-0.034	-0.46	1.161	-0.0548	-0.75	-0.853	-0.9726	1921812	CBDivE_014302	COc1cccc([C@H]2NCC[C@@]3(O)CCCC[C@H]23)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L03	compound treatment	1.25	-0.00901	-0.12	1.204	-0.0118	-0.16	-0.1999	-0.9904	1260263	CBDivE_014303	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nc(C)cc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L04	compound treatment	1.235	-0.024	-0.32	1.175	-0.0408	-0.56	-0.6226	-0.9668	1921813	CBDivE_014304	CN(CCS(=O)(=O)O)C(=O)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L05	compound treatment	1.236	-0.023	-0.31	1.16	-0.0558	-0.76	-0.7577	-0.9218	1921814	CBDivE_014305	COc1ccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(OC(C(F)(F)F)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L06	compound treatment	1.276	0.017	0.23	1.212	-0.00381	-0.05	0.1253	0.5332	1921815	CBDivE_014306	COc1cc(ccc1O)[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L07	compound treatment	1.224	-0.035	-0.47	1.183	-0.0328	-0.45	-0.6504	-0.9996	1921816	CBDivE_014307	FC(F)(F)COc1nc(Nc2ccccc2Nc3nc(OCC(F)(F)F)nc(OCC(F)(F)F)n3)nc(OCC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L08	compound treatment	1.216	-0.043	-0.58	1.136	-0.0798	-1.09	-1.1799	-0.9566	1921817	CBDivE_014308	COc1ccc(OC)c(c1)[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L09	compound treatment	1.263	0.00399	0.05	1.24	0.0242	0.33	0.2713	0.8117	1061354	CBDivE_014309	OC(=O)CCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L10	compound treatment	1.231	-0.028	-0.38	1.182	-0.0338	-0.46	-0.5932	-0.9951	1188664	CBDivE_014310	Cc1cc(O)c(C2=NCCSC(C2)c3cccnc3)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L11	compound treatment	1.229	-0.03	-0.4	1.173	-0.0428	-0.58	-0.6991	-0.984	1562439	CBDivE_014311	OCCc1c(c2ccccc2)n(Cc3ccccc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L12	compound treatment	1.242	-0.017	-0.23	1.223	0.00719	0.1	-0.093	-0.3726	1921818	CBDivE_014312	COc1cc(cc(OC)c1O)[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L13	compound treatment	1.278	0.019	0.26	1.25	0.0342	0.47	0.5108	0.9602	1879563	CBDivE_014313	CC(NC(=O)c1ccc(cc1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L14	compound treatment	1.238	-0.021	-0.28	1.221	0.00519	0.07	-0.1504	-0.5148	1437106	CBDivE_014314	CC1(C)CC2(CC3(C1)Nc4ccccc4S3)Nc5ccccc5S2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L15	compound treatment	1.202	-0.057	-0.77	1.14	-0.0758	-1.03	-1.2749	-0.9894	1921819	CBDivE_014315	COc1ccccc1NC2CCN(C2=O)c3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L16	compound treatment	1.245	-0.014	-0.19	1.219	0.00319	0.04	-0.1029	-0.5306	1921820	CBDivE_014316	CCCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N2CCNCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L17	compound treatment	1.278	0.019	0.26	1.221	0.00519	0.07	0.2312	0.8698	1921821	CBDivE_014317	CSc1ccc2ccccc2[n+]1CCCS(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L18	compound treatment	1.241	-0.018	-0.24	1.184	-0.0318	-0.43	-0.4786	-0.9625	1921822	CBDivE_014318	CC(=O)Oc1ccc(cc1)C2(C(=O)Nc3ccccc32)c4ccc(OC(=O)C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L19	compound treatment	1.226	-0.033	-0.45	1.163	-0.0528	-0.72	-0.8242	-0.9733	1179109	CBDivE_014319	NCCc1c[nH]c2c(Cl)cc(Cl)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	L20	compound treatment	1.269	0.00999	0.13	1.224	0.00819	0.11	0.1742	0.9956	1873867	CBDivE_014320	Cc1ccccc1N=c2scc(c3ccc(cc3)[N+](=O)[O-])n2CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M01	compound treatment	1.289	0.03	0.4	1.367	0.151	2.06	1.7439	0.83	1405772	CBDivE_014321	Oc1ccc(CCc2ncccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M02	compound treatment	1.223	-0.036	-0.49	1.29	0.0742	1.01	0.3718	0.3313	1921823	CBDivE_014322	Clc1ccc(c2ccc(o2)C(=S)N3CCCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M03	compound treatment	1.257	-0.00201	-0.03	1.199	-0.0168	-0.23	-0.1813	-0.7854	1921824	CBDivE_014323	COc1ccc(CCc2ncccc2O)cc1S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M04	compound treatment	1.261	0.00199	0.03	1.234	0.0182	0.25	0.1943	0.779	1433313	CBDivE_014324	CC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M05	compound treatment	1.282	0.023	0.31	1.218	0.00219	0.03	0.2404	0.7716	1921825	CBDivE_014325	Oc1ccc(/C=N\NC(=O)COc2ccc(Cl)c3ccccc23)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M06	compound treatment	1.215	-0.044	-0.59	1.174	-0.0418	-0.57	-0.823	-0.9998	1194176	CBDivE_014326	CCSC(=O)C(NC1=C(C)C(=O)N1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M07	compound treatment	1.24	-0.019	-0.26	1.186	-0.0298	-0.41	-0.4688	-0.9753	1921826	CBDivE_014327	Oc1ccc(Br)cc1/C=N/c2cccc(Nc3nc(nc(n3)N4CCOCC4)N(c5ccccc5)c6ccccc6)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M08	compound treatment	1.255	-0.00401	-0.05	1.216	1.88E-4	0.0	-0.0365	-0.6728	1686150	CBDivE_014328	CCOC1=C(C(NC(=O)NC1=O)OC)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M09	compound treatment	1.266	0.00699	0.09	1.139	-0.0768	-1.05	-0.674	-0.6409	1921827	CBDivE_014329	O/N=C/1\C=C/C(=N\O)/C/2=C1/C3c4ccccc4C2c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M10	compound treatment	1.25	-0.00901	-0.12	1.246	0.0302	0.41	0.2051	0.4779	1239606	CBDivE_014330	Clc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)NC4CCS(=O)(=O)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M11	compound treatment	1.239	-0.02	-0.27	1.191	-0.0248	-0.34	-0.4302	-0.9937	1921828	CBDivE_014331	COc1ccc(/C=N/c2ccc(cc2)c3nc4ccc(C)cc4s3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M12	compound treatment	1.275	0.016	0.22	1.217	0.00119	0.02	0.164	0.7581	1921829	CBDivE_014332	[O-][N+](=O)c1cc(ccc1NS(=O)(=O)c2ccc(Cl)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M13	compound treatment	1.258	-0.00101	-0.01	1.191	-0.0248	-0.34	-0.2489	-0.7351	1921830	CBDivE_014333	Oc1ccccc1/C=N/NC(=O)CC(=O)N\N=C\c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M14	compound treatment	1.326	0.067	0.9	1.283	0.0672	0.92	1.2869	1.0	1366893	CBDivE_014334	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M15	compound treatment	1.237	-0.022	-0.3	1.191	-0.0248	-0.34	-0.4492	-0.9979	1921831	CBDivE_014335	Oc1cccc(/C=N/c2ccc(\N=C\c3cccc(O)c3)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M16	compound treatment	1.24	-0.019	-0.26	1.224	0.00819	0.11	-0.1024	-0.3661	1921832	CBDivE_014336	CC(C)Oc1ccc(NC(=O)c2ccccc2OC(=O)C3(CC4CC5CC(C4)C3)C5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M17	compound treatment	1.253	-0.00601	-0.08	1.205	-0.0108	-0.15	-0.1616	-0.9604	1921833	CBDivE_014337	CCn1c2ccccc2c3cc(/C=N/c4ccc(\N=C\c5ccc6n(CC)c7ccccc7c6c5)c(Cl)c4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M18	compound treatment	1.288	0.029	0.39	1.236	0.0202	0.28	0.4712	0.9852	1020203	CBDivE_014338	O=C1C=CC(=O)C2=C1C3c4ccccc4C2c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M19	compound treatment	1.246	-0.013	-0.18	1.194	-0.0218	-0.3	-0.3345	-0.9684	1921834	CBDivE_014339	CCOC(=O)c1ccc(/C=N\O)[n+]([O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	M20	compound treatment	1.29	0.031	0.42	1.24	0.0242	0.33	0.5288	0.9931	1774211	CBDivE_014340	CCCCN1CCc2c([nH]c3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N01	compound treatment	1.24	-0.019	-0.26	1.323	0.107	1.46	0.8522	0.5742	1776104	CBDivE_014341	CCOC(=O)C1CCN(CC1)C(=O)c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N02	compound treatment	1.226	-0.033	-0.45	1.281	0.0652	0.89	0.3137	0.3155	1580436	CBDivE_014342	CC(C1CC1)N(Cc2ccccc2)C(=O)NC(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N03	compound treatment	1.219	-0.04	-0.54	1.166	-0.0498	-0.68	-0.862	-0.9935	1318999	CBDivE_014343	O=C(Oc1ccc2[nH]cc(CCN3C(=O)c4ccccc4C3=O)c2c1)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N04	compound treatment	1.23	-0.029	-0.39	1.173	-0.0428	-0.58	-0.6896	-0.9811	1921835	CBDivE_014344	Oc1c(/C=N/Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N05	compound treatment	1.23	-0.029	-0.39	1.198	-0.0178	-0.24	-0.4485	-0.9737	1921836	CBDivE_014345	Oc1ccc2[nH]cc(CCNC(c3ccccc3)(c4ccccc4)c5ccccc5)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N06	compound treatment	1.216	-0.043	-0.58	1.129	-0.0868	-1.18	-1.2474	-0.9462	1921837	CBDivE_014346	CCCNC(=O)OCCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N07	compound treatment	1.223	-0.036	-0.49	1.172	-0.0438	-0.6	-0.766	-0.9947	1646615	CBDivE_014347	Clc1ccc(cc1)C(=O)OCc2cccc(COC(=O)c3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N08	compound treatment	1.191	-0.068	-0.92	1.177	-0.0388	-0.53	-1.023	-0.9658	1921838	CBDivE_014348	CSC(=S)N/N=C(\C)/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N09	compound treatment	1.191	-0.068	-0.92	1.169	-0.0468	-0.64	-1.1002	-0.9843	1921839	CBDivE_014349	Clc1ccccc1/C=N/NC(=O)C2=NNC(C2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N10	compound treatment	1.212	-0.047	-0.63	1.173	-0.0428	-0.58	-0.8613	-0.9991	1921840	CBDivE_014350	O/N=C/1\CCCc2nnc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N11	compound treatment	1.214	-0.045	-0.61	1.16	-0.0558	-0.76	-0.9676	-0.9937	1921841	CBDivE_014351	CCC(/N=C/c1ccc(O)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N12	compound treatment	1.245	-0.014	-0.19	1.18	-0.0358	-0.49	-0.479	-0.9147	1203291	CBDivE_014352	Nc1c2-c3ccccc3C(=O)c4cccc([nH]c1=O)c42
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N13	compound treatment	1.254	-0.00501	-0.07	1.212	-0.00381	-0.05	-0.0846	-0.9916	1921842	CBDivE_014353	CC(=C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C2CCC=CC2)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N14	compound treatment	1.246	-0.013	-0.18	1.194	-0.0218	-0.3	-0.3345	-0.9684	1197149	CBDivE_014354	COc1ccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(NC(=O)C)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N15	compound treatment	1.218	-0.041	-0.55	1.139	-0.0768	-1.05	-1.1319	-0.9555	1921843	CBDivE_014355	Cc1cc(Sc2nnnn2c3ccccc3)nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N16	compound treatment	1.241	-0.018	-0.24	1.183	-0.0328	-0.45	-0.4882	-0.9589	1921844	CBDivE_014356	Cc1cc(C)nc(NC(=O)NS(=O)(=O)Nc2nc(Cl)ccc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N17	compound treatment	1.233	-0.026	-0.35	1.175	-0.0408	-0.56	-0.6417	-0.9753	1921845	CBDivE_014357	Cc1c(O)c2ccccc2c3sc(cc13)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N18	compound treatment	1.261	0.00199	0.03	1.189	-0.0268	-0.37	-0.2396	-0.6535	1221756	CBDivE_014358	COc1ccc(OCC(=O)Nc2cccc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N19	compound treatment	1.254	-0.00501	-0.07	1.216	1.88E-4	0.0	-0.046	-0.6798	1620830	CBDivE_014359	NS(=O)(=O)c1cccc(c1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	N20	compound treatment	1.249	-0.01	-0.14	1.193	-0.0228	-0.31	-0.3155	-0.9302	1921846	CBDivE_014360	[O-][N+](=O)c1ccc2Nc3ccc(cc3S(=O)(=O)c2c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O01	compound treatment	1.289	0.03	0.4	1.219	0.00319	0.04	0.3168	0.7786	1921847	CBDivE_014361	CC(C)N(CC#CCO)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O02	compound treatment	1.333	0.074	1.0	1.299	0.0832	1.13	1.5079	0.998	1154222	CBDivE_014362	Cc1cc(=O)oc2cc(OCc3ccccc3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O03	compound treatment	1.324	0.065	0.88	1.237	0.0212	0.29	0.8242	0.8929	1921848	CBDivE_014363	C/C(=N\NC(=O)C1=NNC(C1)(c2ccccc2)c3ccccc3)/c4cccc(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O04	compound treatment	1.298	0.039	0.53	1.27	0.0542	0.74	0.8944	0.9861	1921849	CBDivE_014364	[O-][N+](=O)c1cc(ccc1n2ccnc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O05	compound treatment	1.29	0.031	0.42	1.215	-8.12E-4	-0.01	0.2878	0.6881	1921850	CBDivE_014365	CCN1CCN(CC1)c2ccc(NC(=O)C3CC3c4ccccc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O06	compound treatment	1.241	-0.018	-0.24	1.191	-0.0248	-0.34	-0.4111	-0.9868	1921851	CBDivE_014366	[O-][N+](=O)c1cc(ccc1n2cncn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O07	compound treatment	1.252	-0.00701	-0.09	1.175	-0.0408	-0.56	-0.4604	-0.8156	1262739	CBDivE_014367	CC1(CCC=C)NN(C(=O)N1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O08	compound treatment	1.265	0.00599	0.08	1.226	0.0102	0.14	0.1554	0.9667	1921852	CBDivE_014368	[O-][N+](=O)c1cc(ccc1NS(=O)(=O)c2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O09	compound treatment	1.296	0.037	0.5	1.274	0.0582	0.79	0.9139	0.975	1921853	CBDivE_014369	CCn1c2ccccc2c3cc(/C=N/c4ccc(cc4)c5nc6ccc(C)cc6s5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O10	compound treatment	1.283	0.024	0.32	1.236	0.0202	0.28	0.4235	0.9968	1557944	CBDivE_014370	CCOC(=O)c1nc(C)[nH]c1C(O)c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O11	compound treatment	1.261	0.00199	0.03	1.192	-0.0238	-0.32	-0.2106	-0.6465	1921854	CBDivE_014371	CCn1c2ccccc2c3cc(/C=N/c4ccc(cc4C)c5ccc(\N=C\c6ccc7n(CC)c8ccccc8c7c6)c(C)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O12	compound treatment	1.277	0.018	0.24	1.256	0.0402	0.55	0.5591	0.9329	1921855	CBDivE_014372	[O-][N+](=O)c1ccc(cc1)N2C=C(C=NC(=N2)Nc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O13	compound treatment	1.27	0.011	0.15	1.198	-0.0178	-0.24	-0.0669	-0.2352	1921856	CBDivE_014373	Cc1[nH]c2ccccc2c1/C=N/NC(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O14	compound treatment	1.276	0.017	0.23	1.244	0.0282	0.38	0.4339	0.9695	1921857	CBDivE_014374	CCOC1=C(NC(C(=S)N1)c2ccc(OC)cc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O15	compound treatment	1.287	0.028	0.38	1.231	0.0152	0.21	0.4134	0.96	1921858	CBDivE_014375	Cc1[nH]c2ccccc2c1/C=N/NC(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O16	compound treatment	1.293	0.034	0.46	1.241	0.0252	0.34	0.5671	0.9899	1921859	CBDivE_014376	CC1=C(Cl)C(=O)OC(C)(N1)c2cc(Cl)nc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O17	compound treatment	1.413	0.154	2.08	1.277	0.0612	0.83	2.0589	0.9197	1301683	CBDivE_014377	Cc1ccc(CCSc2ccc(F)cc2)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O18	compound treatment	1.279	0.02	0.27	1.214	-0.00181	-0.02	0.1732	0.6396	1921860	CBDivE_014378	OCCSc1ccc(cc1[N+](=O)[O-])C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O19	compound treatment	1.289	0.03	0.4	1.201	-0.0148	-0.2	0.1432	0.3168	1921861	CBDivE_014379	FC(F)(F)C(=O)O/N=C/1\CCc2nonc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	O20	compound treatment	1.34	0.081	1.09	1.321	0.105	1.43	1.7868	0.991	1921862	CBDivE_014380	CCO/C(=C/1\N=C(C)NC(C(=O)O)c2ccccc12)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P01	compound treatment	1.272	0.013	0.18	1.212	-0.00381	-0.05	0.0871	0.4768	1921863	CBDivE_014381	CC(=C1C(=O)CC(C)(C)CC1=O)NNc2nc3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P02	compound treatment	1.24	-0.019	-0.26	1.178	-0.0378	-0.52	-0.546	-0.948	1429108	CBDivE_014382	CN(C)c1ccc(cc1)C(=C2CN3CCC2CC3)c4ccc(cc4)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P03	compound treatment	1.249	-0.01	-0.14	1.207	-0.00881	-0.12	-0.1805	-0.9983	1921864	CBDivE_014383	CC(NC(=O)c1cc(Cl)c(C)cc1Cl)C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P04	compound treatment	1.189	-0.07	-0.94	1.132	-0.0838	-1.14	-1.476	-0.9955	1921865	CBDivE_014384	CCOC(=O)C(CC)(CC)/C(=N/NC(=S)N)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P05	compound treatment	1.3	0.041	0.55	1.219	0.00319	0.04	0.4217	0.7604	1295669	CBDivE_014385	Nc1ccc(cc1)C2(CC3CC4CC(O)(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P06	compound treatment	1.266	0.00699	0.09	1.191	-0.0248	-0.34	-0.1726	-0.4914	1921866	CBDivE_014386	Nc1ccc2oc(nc2c1)c3cc(I)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P07	compound treatment	1.221	-0.038	-0.51	1.149	-0.0668	-0.91	-1.0068	-0.963	1741203	CBDivE_014387	COc1ccc(cc1)C(=O)Nc2cc(OC)cc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P08	compound treatment	1.172	-0.087	-1.17	1.091	-0.125	-1.7	-2.0335	-0.9836	1921867	CBDivE_014388	On1c(nc-2c1CCc3c2no[n+]3[O-])c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P09	compound treatment	1.221	-0.038	-0.51	1.16	-0.0558	-0.76	-0.9008	-0.9815	1921868	CBDivE_014389	Brc1ccc(cc1)N2C(=O)N(C(=O)C2=O)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P10	compound treatment	0.667	-0.592	-7.99	0.791	-0.425	-5.79	-9.7436	-0.9876	1685458	CBDivE_014390	COc1ccc(cc1OC)C(=O)Nc2ccc(cc2)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P11	compound treatment	1.188	-0.071	-0.96	1.154	-0.0618	-0.84	-1.2734	-0.998	1921869	CBDivE_014391	O=C(CCC(=O)OCC#C)Nc1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P12	compound treatment	1.245	-0.014	-0.19	1.165	-0.0508	-0.69	-0.6236	-0.8683	1921870	CBDivE_014392	COc1ccc(CCNC(=O)NS(=O)(=O)c2ccccc2Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P13	compound treatment	1.172	-0.087	-1.17	1.107	-0.109	-1.48	-1.8793	-0.9933	1239865	CBDivE_014393	COC(CN1C(=O)c2ccccc2C1=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P14	compound treatment	1.277	0.018	0.24	1.197	-0.0188	-0.26	-0.0098	-0.0278	1776972	CBDivE_014394	CCC1CCCCN1S(=O)(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P15	compound treatment	1.18	-0.079	-1.07	1.128	-0.0878	-1.2	-1.6004	-0.9983	1921871	CBDivE_014395	COC(=O)c1ccc(/C=N/c2ccc3oc(nc3c2)c4cccc(C)c4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P16	compound treatment	1.233	-0.026	-0.35	1.158	-0.0578	-0.79	-0.8056	-0.9336	1268908	CBDivE_014396	Cc1cccc(C)c1NC(=O)COc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P17	compound treatment	1.257	-0.00201	-0.03	1.201	-0.0148	-0.2	-0.162	-0.795	1369225	CBDivE_014397	C1CSC2(N1)C3CC4CC2CC(C3)C54NCCS5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P18	compound treatment	1.25	-0.00901	-0.12	1.196	-0.0198	-0.27	-0.277	-0.935	1026728	CBDivE_014398	c1coc(c1)c2nc3ccccc3nc2c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P19	compound treatment	1.27	0.011	0.15	1.185	-0.0308	-0.42	-0.1923	-0.4316	1408788	CBDivE_014399	On1c(nc2C(=O)CCCc21)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.45	P20	compound treatment	1.287	0.028	0.38	1.231	0.0152	0.21	0.4134	0.96	1688253	CBDivE_014400	CN(C)c1nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)nc(n1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A01	compound treatment	1.278	0.0191	0.26	0.93	-0.282	-3.84	-2.5356	-0.6581	1921872	CBDivE_014401	[O-][n+]1onc2c(nnc(c3ccccc3)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A02	compound treatment	1.255	-0.00386	-0.05	1.237	0.0251	0.34	0.2053	0.5927	1741622	CBDivE_014402	Clc1ccc(OCC(=O)Nc2ccc(cc2)c3ccc(NC(=O)COc4ccc(Cl)cc4Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A03	compound treatment	1.31	0.0511	0.69	0.367	-0.845	-11.52	-7.659	-0.6636	1921873	CBDivE_014403	Cc1cccc(c1)C(=O)NNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A04	compound treatment	1.267	0.00814	0.11	1.159	-0.0529	-0.72	-0.4324	-0.5927	1921874	CBDivE_014404	CC(C)NC(=S)NC1CS(=O)(=O)CC1=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A05	compound treatment	1.259	1.38E-4	0.0	0.86	-0.352	-4.8	-3.3918	-0.7068	1921875	CBDivE_014405	O=C(N/N=C(\C=C\c1ccccc1)/c2ccccc2)C3CC3(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A06	compound treatment	1.291	0.0321	0.43	1.249	0.0371	0.51	0.6644	0.997	1358199	CBDivE_014406	CC(=O)Nc1cc(C)nc(C)c1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A07	compound treatment	1.272	0.0131	0.18	0.898	-0.314	-4.28	-2.9014	-0.6772	1921876	CBDivE_014407	CC1(C)C/2CCC1(C)C(=O)\C2=C/Nc3ccc(cc3)c4ccc(N\C=C/5\C6CCC(C)(C5=O)C6(C)C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A08	compound treatment	1.285	0.0261	0.35	1.232	0.0201	0.27	0.4432	0.9923	1921877	CBDivE_014408	COc1ccc(/C=N/c2nc(cs2)c3ccc(C)c(C)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A09	compound treatment	1.232	-0.0269	-0.36	1.013	-0.199	-2.71	-2.1741	-0.7945	1248525	CBDivE_014409	CSc1nc(NN)c2c3CC(C)(C)SCc3oc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A10	compound treatment	1.235	-0.0239	-0.32	1.152	-0.0599	-0.82	-0.8051	-0.9171	1014811	CBDivE_014410	O=C(N(C(=O)c1ccccc1)C(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A11	compound treatment	1.27	0.0111	0.15	1.226	0.0141	0.19	0.2423	0.9925	1921878	CBDivE_014411	Oc1cccc(c1)C(=O)OC2=CC=CNN=C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A12	compound treatment	1.294	0.0351	0.47	1.231	0.0191	0.26	0.5194	0.9603	1062385	CBDivE_014412	O=C1CSCc2nc3ccccc3n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A13	compound treatment	1.296	0.0371	0.5	1.262	0.0501	0.68	0.8374	0.9884	1921879	CBDivE_014413	Cc1cc(C)n(CNc2ccc(/C=C/c3ccccc3)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A14	compound treatment	1.285	0.0261	0.35	1.246	0.0341	0.47	0.5782	0.9907	1921880	CBDivE_014414	Cn1nc(C#CC(C)(C)O)c(C#CC(C)(C)O)c1C#CC(C)(C)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A15	compound treatment	1.255	-0.00386	-0.05	1.193	-0.0189	-0.26	-0.219	-0.8332	1131285	CBDivE_014415	C#CC(CN1CCCCC1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A16	compound treatment	1.269	0.0101	0.14	1.253	0.0411	0.56	0.4931	0.8546	1921881	CBDivE_014416	CCOC(=O)c1c(C)c(I)c(C)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A17	compound treatment	1.241	-0.0179	-0.24	1.178	-0.0339	-0.46	-0.4972	-0.9539	1921882	CBDivE_014417	[O-][N+](=O)c1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A18	compound treatment	1.324	0.0651	0.88	1.307	0.0951	1.3	1.5384	0.982	1921883	CBDivE_014418	[O-][n+]1c2CCCC(=O)c2nn1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A19	compound treatment	1.24	-0.0189	-0.25	1.178	-0.0339	-0.46	-0.5067	-0.9605	1921884	CBDivE_014419	CC(=O)C1=C(C)NC(=S)NC1c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	A20	compound treatment	1.283	0.0241	0.33	1.261	0.0491	0.67	0.7038	0.9451	1921885	CBDivE_014420	CC(=O)c1ccc(s1)C(CC(=O)c2ccccc2)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B01	compound treatment	1.257	-0.00186	-0.03	1.216	0.00411	0.06	0.0218	0.3558	1921886	CBDivE_014421	Cc1cc(C)n(n1)c2ccc3n[nH]c(=S)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B02	compound treatment	1.275	0.0161	0.22	1.24	0.0281	0.38	0.425	0.9641	1921887	CBDivE_014422	CC(=NOc1nc(N)nc(Nc2ccccc2SC(F)(F)C(F)(F)F)n1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B03	compound treatment	1.235	-0.0239	-0.32	1.178	-0.0339	-0.46	-0.5544	-0.9844	1921888	CBDivE_014423	[O-][n+]1nc(Cl)ccc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B04	compound treatment	1.31	0.0511	0.69	1.249	0.0371	0.51	0.8456	0.9884	1921889	CBDivE_014424	CSc1sc(SC)c(C=O)c1CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B05	compound treatment	1.313	0.0541	0.73	1.248	0.0361	0.49	0.8646	0.9816	1921890	CBDivE_014425	NC(=S)NNc1ccc(nn1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B06	compound treatment	1.294	0.0351	0.47	1.247	0.0351	0.48	0.6737	1.0	1665724	CBDivE_014426	CC1(C)CC(=C(C(C2C(=O)CC(C)(C)CC2=O)c3ccccc3)C(=O)C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B07	compound treatment	1.266	0.00714	0.1	1.228	0.0161	0.22	0.2234	0.9315	1353176	CBDivE_014427	CN(C)c1ccc(CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B08	compound treatment	1.292	0.0331	0.45	1.231	0.0191	0.26	0.5004	0.967	1921891	CBDivE_014428	COc1ccccc1C(=O)N[C@@H](C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B09	compound treatment	1.269	0.0101	0.14	1.179	-0.0329	-0.45	-0.2205	-0.4701	1692855	CBDivE_014429	COc1cccc(CN2CCN(CC2)c3ccccc3OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B10	compound treatment	1.302	0.0431	0.58	1.286	0.0741	1.01	1.1261	0.9656	1921892	CBDivE_014430	Nc1nc(Cl)nc(Nc2ccccc2OC(F)(F)C(F)Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B11	compound treatment	1.255	-0.00386	-0.05	1.222	0.0101	0.14	0.0606	0.4114	1921893	CBDivE_014431	FC(F)(F)c1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B12	compound treatment	1.255	-0.00386	-0.05	1.215	0.00311	0.04	-0.0069	-0.1024	1921894	CBDivE_014432	COc1ccc(cc1)C(=O)CC(Sc2ccccc2N)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B13	compound treatment	1.254	-0.00486	-0.07	1.15	-0.0619	-0.84	-0.6432	-0.7598	1361451	CBDivE_014433	COc1ccccc1N2CCN(Cc3ccc(cc3)N(C)C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B14	compound treatment	1.312	0.0531	0.72	1.254	0.0421	0.57	0.9129	0.9939	1921895	CBDivE_014434	NC(=S)NNC(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B15	compound treatment	1.273	0.0141	0.19	1.22	0.00811	0.11	0.213	0.9664	1621529	CBDivE_014435	C(N1CCN(CC1)c2ccccc2)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B16	compound treatment	1.265	0.00614	0.08	1.216	0.00411	0.06	0.0982	0.9819	1921896	CBDivE_014436	Cc1nc2ccccc2nc1C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B17	compound treatment	1.286	0.0271	0.37	1.225	0.0131	0.18	0.3853	0.9456	1122657	CBDivE_014437	Clc1ccccc1S(=O)(=O)NC(=O)n2ccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B18	compound treatment	1.264	0.00514	0.07	1.215	0.00311	0.04	0.079	0.9721	1921897	CBDivE_014438	O=C(CNCc1ccccc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B19	compound treatment	1.251	-0.00786	-0.11	1.203	-0.00889	-0.12	-0.1607	-0.9978	1649144	CBDivE_014439	C(c1ccccc1)n2c(csc2=Nc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	B20	compound treatment	1.268	0.00914	0.12	1.218	0.00611	0.08	0.1461	0.9818	1921898	CBDivE_014440	Cc1cc(C)[n+]2c3CCCCc3sc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C01	compound treatment	1.217	-0.0419	-0.56	0.368	-0.844	-11.51	-8.5365	-0.7409	1523680	CBDivE_014441	CN1C2CCC1C=C(C2)N(C(=O)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C02	compound treatment	1.283	0.0241	0.33	0.752	-0.46	-6.27	-4.2042	-0.6695	1921899	CBDivE_014442	Clc1ccc(cc1)c2cnc(o2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C03	compound treatment	1.272	0.0131	0.18	0.377	-0.835	-11.38	-7.9251	-0.696	1921900	CBDivE_014443	CC(C)(C)NS(=O)(=O)Nc1ccccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C04	compound treatment	1.278	0.0191	0.26	0.63	-0.582	-7.93	-5.4283	-0.6837	1921901	CBDivE_014444	COc1ccccc1/C=N/NC(=O)c2cc(C)n[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C05	compound treatment	1.265	0.00614	0.08	1.202	-0.00989	-0.13	-0.0368	-0.2327	1007324	CBDivE_014445	CCOC(=O)c1[nH]c(C=O)c(C(=O)OCC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C06	compound treatment	1.228	-0.0309	-0.42	1.223	0.0111	0.15	-0.1873	-0.4228	1921902	CBDivE_014446	O=C1N(N=C2C=CC(=O)C=C2)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C07	compound treatment	1.261	0.00214	0.03	0.627	-0.585	-7.98	-5.6194	-0.7045	1921903	CBDivE_014447	CC1(C)C(C(Cl)S1(=O)=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C08	compound treatment	1.278	0.0191	0.26	1.265	0.0531	0.72	0.6946	0.9035	1543212	CBDivE_014448	On1c2CCCCc2c3c1ccc4nonc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C09	compound treatment	1.264	0.00514	0.07	0.356	-0.856	-11.67	-8.2039	-0.7029	1921904	CBDivE_014449	OC(=O)c1ccccc1/N=C/c2ccc(O)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C10	compound treatment	1.273	0.0141	0.19	1.214	0.00211	0.03	0.1552	0.8046	1625034	CBDivE_014450	OCC(CC(=O)NCc1ccccc1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C11	compound treatment	1.269	0.0101	0.14	1.211	-8.93E-4	-0.01	0.0881	0.6416	1921905	CBDivE_014451	CCCCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C12	compound treatment	1.277	0.0181	0.24	1.243	0.0311	0.42	0.473	0.9658	1921906	CBDivE_014452	NCC(=O)Nc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C13	compound treatment	1.255	-0.00386	-0.05	1.165	-0.0469	-0.64	-0.489	-0.7622	1378559	CBDivE_014453	CCN(CC)c1nc(NC(C)(C)C)nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C14	compound treatment	1.277	0.0181	0.24	1.252	0.0401	0.55	0.5598	0.9342	1921907	CBDivE_014454	CN(C)c1ccc(cc1)c2cc([nH]n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C15	compound treatment	1.306	0.0471	0.64	1.176	-0.0359	-0.49	0.1036	0.1291	1921908	CBDivE_014455	Fc1ccc(cc1)C(=O)Nc2ccc(Oc3c(F)c(F)c(Oc4ccc(NC(=O)c5ccc(F)cc5)cc4)c(F)c3F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C16	compound treatment	1.293	0.0341	0.46	1.231	0.0191	0.26	0.5099	0.9636	3107574	CBDivE_014456	CCN1/C(=C/C=C/c2oc3ccc4ccccc4c3[n+]2CC)/Oc5ccc6ccccc6c15.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C17	compound treatment	1.269	0.0101	0.14	1.17	-0.0419	-0.57	-0.3072	-0.523	1921910	CBDivE_014457	CC(C)CN(CC(C)C)S(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C18	compound treatment	1.278	0.0191	0.26	1.235	0.0231	0.32	0.4054	0.9951	1921911	CBDivE_014458	COc1ccc2nc(NC(=O)/C=C/c3ccccc3)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C19	compound treatment	1.263	0.00414	0.06	1.178	-0.0339	-0.46	-0.2873	-0.6172	1271453	CBDivE_014459	Fc1ccccc1C(=O)Nc2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	C20	compound treatment	1.255	-0.00386	-0.05	1.195	-0.0169	-0.23	-0.1997	-0.8457	1921912	CBDivE_014460	Oc1ccc2ccccc2c1/C=N/c3nc(c(s3)c4ccc(cc4)[N+](=O)[O-])c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D01	compound treatment	1.283	0.0241	0.33	1.237	0.0251	0.34	0.4724	0.9997	1921913	CBDivE_014461	Cc1cccc(c1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D02	compound treatment	1.241	-0.0179	-0.24	1.177	-0.0349	-0.48	-0.5068	-0.9503	1921914	CBDivE_014462	CC(NC1CCCCC1)C(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D03	compound treatment	1.233	-0.0259	-0.35	1.212	1.07E-4	0.0	-0.2457	-0.7041	1921915	CBDivE_014463	C[C@@H]1O[C@@H](OCc2ccccc2)[C@@H]3OC(O[C@@H]3[C@H]1O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D04	compound treatment	1.274	0.0151	0.2	1.197	-0.0149	-0.2	8.0E-4	0.0028	1921916	CBDivE_014464	O=C(CN1CCOCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D05	compound treatment	1.242	-0.0169	-0.23	1.204	-0.00789	-0.11	-0.237	-0.9416	1334790	CBDivE_014465	CC(=O)Nc1cccc(NC(=O)c2cccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D06	compound treatment	1.257	-0.00186	-0.03	1.22	0.00811	0.11	0.0604	0.5329	1921917	CBDivE_014466	[O-][N+](=O)c1cccc(/C=C/2\SC(=S)N(Cc3ccccc3)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D07	compound treatment	1.272	0.0131	0.18	1.22	0.00811	0.11	0.2035	0.9742	1644691	CBDivE_014467	CCOC(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D08	compound treatment	1.249	-0.00986	-0.13	1.208	-0.00389	-0.05	-0.1316	-0.9188	1921918	CBDivE_014468	Brc1ccc(/C=C/2\SC(=S)N(Cc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D09	compound treatment	1.267	0.00814	0.11	1.236	0.0241	0.33	0.3101	0.8947	1921919	CBDivE_014469	Cc1cc(OCC(O)CN(Cc2ccccc2)C(C)(C)C)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D10	compound treatment	1.232	-0.0269	-0.36	1.217	0.00511	0.07	-0.207	-0.5609	1666537	CBDivE_014470	COC(=O)NCC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D11	compound treatment	1.235	-0.0239	-0.32	1.189	-0.0229	-0.31	-0.4484	-0.9999	1921920	CBDivE_014471	CC(C)N(C(C)C)C(=O)c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D12	compound treatment	1.281	0.0221	0.3	1.236	0.0241	0.33	0.4436	0.9989	1402478	CBDivE_014472	COc1cccc(c1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccnc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D13	compound treatment	1.308	0.0491	0.66	1.242	0.0301	0.41	0.759	0.9735	1921921	CBDivE_014473	FC(F)(F)c1c(Nc2cccc(Br)c2)c3cccc(Cl)c3nc1C(F)(F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D14	compound treatment	1.277	0.0181	0.24	1.27	0.0581	0.79	0.7333	0.8843	1921922	CBDivE_014474	CC(Cc1ccccc1)N/C=C\2/C(=O)CNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D15	compound treatment	1.225	-0.0339	-0.46	1.15	-0.0619	-0.84	-0.9198	-0.9584	1242389	CBDivE_014475	COc1ccccc1NC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D16	compound treatment	1.299	0.0401	0.54	1.237	0.0251	0.34	0.625	0.9756	1179859	CBDivE_014476	COc1nccnc1NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D17	compound treatment	1.253	-0.00586	-0.08	1.222	0.0101	0.14	0.0415	0.2614	1921923	CBDivE_014477	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D18	compound treatment	1.267	0.00814	0.11	1.219	0.00711	0.1	0.1462	0.9981	1921924	CBDivE_014478	CN1C/C(=N\S(=O)(=O)c2ccc(C)cc2)/N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D19	compound treatment	1.253	-0.00586	-0.08	1.217	0.00511	0.07	-0.0067	-0.0633	1913913	CBDivE_014479	CC(C)(C)c1ccc(cc1)c2nc(CN3CCOCC3)cc(CN4CCOCC4)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	D20	compound treatment	1.265	0.00614	0.08	1.229	0.0171	0.23	0.2235	0.9029	1921925	CBDivE_014480	CCN1C/C(=N\S(=O)(=O)c2ccc(C)cc2)/N(CC)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E01	compound treatment	1.228	-0.0309	-0.42	0.37	-0.842	-11.48	-8.4123	-0.7323	1921926	CBDivE_014481	O=C1C2C3CC(C=C3)C2C(=O)N1c4ccc(Oc5ccc(Oc6ccc(cc6)N7C(=O)C8C9CC(C=C9)C8C7=O)cc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E02	compound treatment	1.295	0.0361	0.49	0.912	-0.3	-4.09	-2.547	-0.6184	1921927	CBDivE_014482	C(=N/n1cnnc1)\c2cccc(/C=N/n3cnnc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E03	compound treatment	1.26	0.00114	0.02	0.364	-0.848	-11.56	-8.1649	-0.7062	1921928	CBDivE_014483	CN(C)c1ccc(/C=N\Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E04	compound treatment	1.302	0.0431	0.58	0.95	-0.262	-3.57	-2.1138	-0.5842	1022723	CBDivE_014484	O=C1N(C2c3ccccc3Oc4ccccc24)S(=O)(=O)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E05	compound treatment	1.261	0.00214	0.03	1.206	-0.00589	-0.08	-0.0364	-0.4267	1921929	CBDivE_014485	COC(=O)CCc1sc2CCCC(=O)Nc2c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E06	compound treatment	1.254	-0.00486	-0.07	1.222	0.0101	0.14	0.0511	0.3346	1112350	CBDivE_014486	c1cc(ccn1)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E07	compound treatment	1.267	0.00814	0.11	1.181	-0.0309	-0.42	-0.2203	-0.5059	1921930	CBDivE_014487	Oc1c(/C=N\Nc2nc(Nc3ccc(cc3)[N+](=O)[O-])nc(OC(C(F)(F)F)C(F)(F)F)n2)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E08	compound treatment	1.274	0.0151	0.2	1.257	0.0451	0.62	0.5793	0.8939	1921931	CBDivE_014488	C[N+]1(CCCCC1)C2CCC/3CCCC2\C3=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E09	compound treatment	1.278	0.0191	0.26	0.364	-0.848	-11.56	-7.9932	-0.6911	1270597	CBDivE_014489	CC(C)c1ccc(C)cc1OCC(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E10	compound treatment	1.274	0.0151	0.2	1.252	0.0401	0.55	0.5311	0.9098	1921932	CBDivE_014490	C/C(=N\NC(=O)Nc1ccccc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E11	compound treatment	1.258	-8.62E-4	-0.01	1.179	-0.0329	-0.45	-0.3254	-0.7252	898	CBDivE_014491	CCOC(=O)C(Cc1ccc(O)cc1)NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E12	compound treatment	1.284	0.0251	0.34	1.228	0.0161	0.22	0.3951	0.9779	1527904	CBDivE_014492	Clc1nnc(N2CCCCC2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E13	compound treatment	1.242	-0.0169	-0.23	1.179	-0.0329	-0.45	-0.478	-0.9505	1300050	CBDivE_014493	CC1(C)CNC=C(CC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E14	compound treatment	1.257	-0.00186	-0.03	1.255	0.0431	0.59	0.3979	0.6763	1921933	CBDivE_014494	OCC(NCc1ccccc1)C#CCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E15	compound treatment	1.268	0.00914	0.12	1.131	-0.0809	-1.1	-0.6928	-0.6242	1921934	CBDivE_014495	OS(=O)(=O)CCCN1/C(=C/c2sc3ccc(Cl)cc3[n+]2CCCS(=O)(=O)O)/Sc4ccc(Cl)cc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E16	compound treatment	1.283	0.0241	0.33	1.233	0.0211	0.29	0.4338	0.9981	1921935	CBDivE_014496	COc1cc2oc(=O)cc(C)c2cc1OCC(O)CN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E17	compound treatment	1.236	-0.0229	-0.31	1.183	-0.0289	-0.39	-0.4967	-0.9927	1921936	CBDivE_014497	CCCCOC(=O)CNc1n[nH]c(=S)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E18	compound treatment	1.275	0.0161	0.22	1.224	0.0121	0.17	0.2707	0.9907	1602333	CBDivE_014498	CCc1ccc(cc1)c2nc3cc(N)ccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E19	compound treatment	1.233	-0.0259	-0.35	1.183	-0.0289	-0.39	-0.5253	-0.9982	1921937	CBDivE_014499	[O-][N+](=O)C1(C2Nc3ccccc31)C4OC=CN24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	E20	compound treatment	1.263	0.00414	0.06	1.252	0.0401	0.55	0.4262	0.7753	1921938	CBDivE_014500	CC/C(=N\NS(=O)(=O)c1ccc(C)cc1)/C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F01	compound treatment	1.211	-0.0479	-0.65	1.158	-0.0539	-0.73	-0.9762	-0.9979	1921939	CBDivE_014501	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F02	compound treatment	1.232	-0.0269	-0.36	1.185	-0.0269	-0.37	-0.5156	-1.0	1199337	CBDivE_014502	NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F03	compound treatment	1.239	-0.0199	-0.27	1.188	-0.0239	-0.33	-0.4199	-0.9953	1376333	CBDivE_014503	CCOc1ccc(NC(=O)c2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F04	compound treatment	1.225	-0.0339	-0.46	1.192	-0.0199	-0.27	-0.5148	-0.969	1921940	CBDivE_014504	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F05	compound treatment	1.274	0.0151	0.2	1.211	-8.93E-4	-0.01	0.1358	0.6638	1779988	CBDivE_014505	[O-][N+](=O)c1cccc(c1)C2NCCc3[nH]cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F06	compound treatment	1.235	-0.0239	-0.32	1.182	-0.0299	-0.41	-0.5159	-0.9932	1921941	CBDivE_014506	[O-][N+](=O)c1ccccc1S(=O)(=O)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F07	compound treatment	1.251	-0.00786	-0.11	1.196	-0.0159	-0.22	-0.2282	-0.946	1921942	CBDivE_014507	Oc1c(I)cc(I)cc1/C=N/c2ccc3oc(nc3c2)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F08	compound treatment	1.25	-0.00886	-0.12	1.198	-0.0139	-0.19	-0.2185	-0.9754	1921943	CBDivE_014508	Cc1ccc(cc1)n2c(=N)[nH][nH]c2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F09	compound treatment	1.27	0.0111	0.15	1.224	0.0121	0.17	0.223	0.9989	1921944	CBDivE_014509	Cc1ccc2nc(sc2c1)c3ccc(/N=C/c4ccc(O)cc4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F10	compound treatment	1.311	0.0521	0.7	1.268	0.0561	0.77	1.0384	0.9991	1627596	CBDivE_014510	COc1cccc(c1)C(=O)Nc2nc3ccc(Cl)cc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F11	compound treatment	1.315	0.0561	0.76	1.282	0.0701	0.96	1.2115	0.9933	1921945	CBDivE_014511	CC1(C)CC(=O)C/C(=N/NC(=O)C2C3CCCCC23)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F12	compound treatment	1.315	0.0561	0.76	1.275	0.0631	0.86	1.144	0.998	1497546	CBDivE_014512	CC1(C)CC(=O)C2=C(C1)N(C3=C(C2)C(=O)CC(C)(C)C3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F13	compound treatment	1.242	-0.0169	-0.23	1.226	0.0141	0.19	-0.0248	-0.0833	1921946	CBDivE_014513	Cc1cccc(c1)C(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F14	compound treatment	1.229	-0.0299	-0.4	1.177	-0.0349	-0.48	-0.6213	-0.9966	1921947	CBDivE_014514	CC1(C)CC(=O)C2=C(C1)OC3=C(C2c4ccccc4)C(=O)CC(C)(C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F15	compound treatment	1.231	-0.0279	-0.38	1.19	-0.0219	-0.3	-0.4769	-0.9935	1921948	CBDivE_014515	CCc1ccccc1NC(=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F16	compound treatment	1.274	0.0151	0.2	1.244	0.0321	0.44	0.454	0.9397	1921949	CBDivE_014516	CCN1C/C(=N\S(=O)(=O)c2ccccc2)/N(CC)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F17	compound treatment	1.219	-0.0399	-0.54	1.162	-0.0499	-0.68	-0.8613	-0.9932	1274541	CBDivE_014517	COc1ccccc1NC(=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F18	compound treatment	1.262	0.00314	0.04	1.248	0.0361	0.49	0.3781	0.7651	1921950	CBDivE_014518	CCCCC/C(=N/NC(=O)c1ccc(O)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F19	compound treatment	1.219	-0.0399	-0.54	1.189	-0.0229	-0.31	-0.601	-0.9665	1921951	CBDivE_014519	CCN(C(=O)c1cccc(Br)c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	F20	compound treatment	1.256	-0.00286	-0.04	1.237	0.0251	0.34	0.2148	0.6234	1921952	CBDivE_014520	Cc1cc(C)[n+]2CCCc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G01	compound treatment	1.24	-0.0189	-0.25	0.363	-0.849	-11.58	-8.3653	-0.7225	1054990	CBDivE_014521	Brc1cccc(C=C2C(=O)NC(=O)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G02	compound treatment	1.237	-0.0219	-0.29	1.014	-0.198	-2.7	-2.1167	-0.7797	1571502	CBDivE_014522	OCCC1(CC2CC3C1)CC(CCO)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G03	compound treatment	1.244	-0.0149	-0.2	0.367	-0.845	-11.52	-8.2886	-0.7193	1921953	CBDivE_014523	C/C=C(\C=C/C=C)/S(=O)N1COCN(COC1)S(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G04	compound treatment	1.239	-0.0199	-0.27	1.022	-0.19	-2.59	-2.0205	-0.7761	1921954	CBDivE_014524	O=C(NC(=O)C1(CC2CC3CC(C2)C1)C3)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G05	compound treatment	1.241	-0.0179	-0.24	1.187	-0.0249	-0.34	-0.4104	-0.9859	1921955	CBDivE_014525	CC(=O)c1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G06	compound treatment	1.257	-0.00186	-0.03	1.248	0.0361	0.49	0.3304	0.6702	1921956	CBDivE_014526	CC(NC(=O)c1cc(C)c(Cl)cc1Cl)C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G07	compound treatment	1.275	0.0161	0.22	1.234	0.0221	0.3	0.3671	0.9872	1921957	CBDivE_014527	FC(F)(F)COc1nc(N/N=C\c2ccc(Cl)cc2Cl)nc(n1)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G08	compound treatment	1.263	0.00414	0.06	1.229	0.0171	0.23	0.2044	0.8523	1921958	CBDivE_014528	Clc1ccc2C(=O)/C(=C\3/C(=O)c4ccc(Br)c5cccc3c45)/Sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G09	compound treatment	1.249	-0.00986	-0.13	0.366	-0.846	-11.53	-8.2505	-0.7152	1590083	CBDivE_014529	COC(=O)c1ccc(NC(=O)COc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G10	compound treatment	1.246	-0.0129	-0.17	1.287	0.0751	1.02	0.6015	0.5791	1921959	CBDivE_014530	CC(=C/C(=N\NC(=O)N)/C1CCC(=O)CC1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G11	compound treatment	1.251	-0.00786	-0.11	1.193	-0.0189	-0.26	-0.2572	-0.9231	1267137	CBDivE_014531	Brc1ccc(NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G12	compound treatment	1.281	0.0221	0.3	1.253	0.0411	0.56	0.6076	0.9565	1921960	CBDivE_014532	C/C(=N\NC(=O)C1=CCC(C=C1)[N+](=O)[O-])/c2ccc(N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G13	compound treatment	1.205	-0.0539	-0.73	1.127	-0.0849	-1.16	-1.3324	-0.9748	1921961	CBDivE_014533	CC1=CC(C)(C)N(C(O)C(Cl)(Cl)Cl)c2cc(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G14	compound treatment	1.31	0.0511	0.69	1.31	0.0981	1.34	1.4338	0.9525	1703623	CBDivE_014534	CCCc1nc(N)nc2CC(C)(C)CC(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G15	compound treatment	1.254	-0.00486	-0.07	1.193	-0.0189	-0.26	-0.2286	-0.8597	1776082	CBDivE_014535	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G16	compound treatment	1.26	0.00114	0.02	1.233	0.0211	0.29	0.2144	0.7438	1921962	CBDivE_014536	Brc1ccc2/C(=C\3/Sc4c(ccc5ccccc45)C3=O)/C(=O)c6cccc1c62
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G17	compound treatment	1.307	0.0481	0.65	1.23	0.0181	0.25	0.6338	0.9122	1921963	CBDivE_014537	CCc1nc(C)cc(CSc2nc3ccccc3[nH]2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G18	compound treatment	1.281	0.0221	0.3	1.249	0.0371	0.51	0.569	0.9684	1921964	CBDivE_014538	CCCCOC(=O)c1ccc(cc1)c2ccc(C=O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G19	compound treatment	1.335	0.0761	1.03	1.27	0.0581	0.79	1.2866	0.9918	1921965	CBDivE_014539	Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	G20	compound treatment	1.278	0.0191	0.26	1.264	0.0521	0.71	0.685	0.9061	1465256	CBDivE_014540	CCCCN(C(=O)c1ccccc1)C2=CC3CCC(C2)N3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H01	compound treatment	1.216	-0.0429	-0.58	1.186	-0.0259	-0.35	-0.6585	-0.972	1732529	CBDivE_014541	CC(C)NS(=O)(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H02	compound treatment	1.262	0.00314	0.04	1.24	0.0281	0.38	0.301	0.7805	1448140	CBDivE_014542	CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C3(CC4CC5CC(C4)C3)C5)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H03	compound treatment	1.239	-0.0199	-0.27	1.183	-0.0289	-0.39	-0.4681	-0.9824	1921966	CBDivE_014543	Brc1ccccc1C(=O)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H04	compound treatment	1.23	-0.0289	-0.39	1.181	-0.0309	-0.42	-0.5732	-0.9992	1921967	CBDivE_014544	CC1(CC2CC3(C)C1)CC(C2)(C3)C(=O)NNC(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H05	compound treatment	1.27	0.0111	0.15	1.237	0.0251	0.34	0.3483	0.9317	1921968	CBDivE_014545	Cc1c(Cl)cccc1NC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H06	compound treatment	1.228	-0.0309	-0.42	1.132	-0.0799	-1.09	-1.0648	-0.9129	540	CBDivE_014546	CC1(CC2CC3(C)C1)CC(C2)(C3)C(=O)NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H07	compound treatment	1.254	-0.00486	-0.07	1.246	0.0341	0.47	0.2825	0.6014	1921969	CBDivE_014547	Cc1cccc(c1)C(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H08	compound treatment	1.237	-0.0219	-0.29	1.188	-0.0239	-0.33	-0.4389	-0.9988	1921970	CBDivE_014548	O=C1NC(=O)C(=NNc2ccc3OCCOc3c2)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H09	compound treatment	1.223	-0.0359	-0.48	1.232	0.0201	0.27	-0.1482	-0.2665	1776037	CBDivE_014549	CC(C)(C)Nc1nc(Nc2cccc(c2)[N+](=O)[O-])nc(NC(C)(C)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H10	compound treatment	1.184	-0.0749	-1.01	1.221	0.00911	0.12	-0.6263	-0.6155	1219714	CBDivE_014550	CC(C)(C)c1cc(cc(Br)c1O)c2cc(Br)c(O)c(c2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H11	compound treatment	1.24	-0.0189	-0.25	1.217	0.00511	0.07	-0.1307	-0.4954	1575285	CBDivE_014551	CCC1CCCCN1S(=O)(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H12	compound treatment	1.233	-0.0259	-0.35	1.203	-0.00889	-0.12	-0.3325	-0.9001	1598803	CBDivE_014552	O=C(Nc1ccccc1c2nc3ccccc3s2)c4ccc(cc4)S(=O)(=O)N5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H13	compound treatment	1.296	0.0371	0.5	1.277	0.0651	0.89	0.9821	0.9633	1921971	CBDivE_014553	CCc1ccccc1NC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H14	compound treatment	1.265	0.00614	0.08	1.253	0.0411	0.56	0.4549	0.8028	1921972	CBDivE_014554	C/C(=N\NC(=O)c1nc(n[nH]1)[N+](=O)[O-])/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H15	compound treatment	1.227	-0.0319	-0.43	1.169	-0.0429	-0.58	-0.7175	-0.9885	1921973	CBDivE_014555	O=C(c1cccs1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H16	compound treatment	1.247	-0.0119	-0.16	1.186	-0.0259	-0.35	-0.3628	-0.9359	1921974	CBDivE_014556	Cc1ccnc2ccc(Br)c[n+]12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H17	compound treatment	1.23	-0.0289	-0.39	1.154	-0.0579	-0.79	-0.8336	-0.9469	1921975	CBDivE_014557	Cc1cccc(c1)C(=O)Nc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H18	compound treatment	1.246	-0.0129	-0.17	1.221	0.00911	0.12	-0.0349	-0.1635	1921976	CBDivE_014558	C/C(=N/NC(=O)c1ccc(O)cc1)/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H19	compound treatment	1.225	-0.0339	-0.46	1.193	-0.0189	-0.26	-0.5052	-0.9633	1382043	CBDivE_014559	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	H20	compound treatment	1.159	-0.0999	-1.35	1.242	0.0301	0.41	-0.6623	-0.4703	1921977	CBDivE_014560	C/C(=N/OC(=O)c1ccc(Br)cc1)/C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I01	compound treatment	1.255	-0.00386	-0.05	0.38	-0.832	-11.34	-8.0583	-0.7103	1921978	CBDivE_014561	CC1(CCCCC1)C(=O)NC(=S)NNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I02	compound treatment	1.245	-0.0139	-0.19	1.105	-0.107	-1.46	-1.1629	-0.7913	1504148	CBDivE_014562	S=C(NC1(CC2CC3CC(C2)C1)C3)NC4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I03	compound treatment	1.276	0.0171	0.23	0.374	-0.838	-11.43	-7.9158	-0.6927	1921979	CBDivE_014563	OC(=O)C(=Cc1cccc(c1)[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I04	compound treatment	1.248	-0.0109	-0.15	1.074	-0.138	-1.88	-1.4332	-0.7599	1402533	CBDivE_014564	CCOC(=O)c1oc2ccc(C=O)c(Cl)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I05	compound treatment	1.308	0.0491	0.66	1.282	0.0701	0.96	1.1447	0.984	1921980	CBDivE_014565	COc1ccc(N=NC2C(=NN(C2=O)c3ccccc3)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I06	compound treatment	1.237	-0.0219	-0.29	1.19	-0.0219	-0.3	-0.4196	-1.0	1921981	CBDivE_014566	[O-][N+](=O)c1ccc(/C=N/Nc2ccc(cc2)[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I07	compound treatment	1.237	-0.0219	-0.29	1.177	-0.0349	-0.48	-0.545	-0.9736	1921982	CBDivE_014567	CS(=O)(=O)c1ccc2C(=O)/C(=C/3\Sc4cc(ccc4C3=O)S(=O)(=O)C)/Sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I08	compound treatment	1.236	-0.0229	-0.31	1.257	0.0451	0.62	0.2169	0.3152	1921983	CBDivE_014568	[O-][N+](=O)c1cccc(Nc2nc(OC(C(F)(F)F)C(F)(F)F)nc(n2)N3CCOCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I09	compound treatment	1.26	0.00114	0.02	0.796	-0.416	-5.67	-3.9994	-0.7052	1921984	CBDivE_014569	CC1(C)C2CCC1(C)C(=O)C2/C=N/c3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I10	compound treatment	1.265	0.00614	0.08	1.263	0.0511	0.7	0.5513	0.7856	1921985	CBDivE_014570	O=C(CC1(C(=O)c2ccccc2C1=O)c3ccccc3)Nc4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I11	compound treatment	1.249	-0.00986	-0.13	1.202	-0.00989	-0.13	-0.1895	-1.0	1921986	CBDivE_014571	Clc1nc(Nc2cccc3ccccc23)nc(n1)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I12	compound treatment	1.279	0.0201	0.27	1.228	0.0161	0.22	0.3474	0.9944	1286069	CBDivE_014572	CCC(C)Nc1nc(NC)nc(NC(C)CC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I13	compound treatment	1.282	0.0231	0.31	1.233	0.0211	0.29	0.4242	0.9992	1921987	CBDivE_014573	[O-][N+](=O)N1NCc2ccccc2C(=N1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I14	compound treatment	1.277	0.0181	0.24	1.222	0.0101	0.14	0.2705	0.9631	1921988	CBDivE_014574	Nc1nc(Cl)nc(NCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I15	compound treatment	1.256	-0.00286	-0.04	1.215	0.00311	0.04	0.0027	0.0464	1921989	CBDivE_014575	[O-][N+](=O)c1ccccc1/C=N\Nc2ncnc3sc4CCCCc4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I16	compound treatment	1.261	0.00214	0.03	1.252	0.0401	0.55	0.4071	0.7434	1682534	CBDivE_014576	COc1ccccc1Nc2nc(Cl)nc(NC(C)(C)C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I17	compound treatment	1.279	0.0201	0.27	1.185	-0.0269	-0.37	-0.0672	-0.1473	1921990	CBDivE_014577	Oc1ccc(Br)cc1/C=N\Nc2nc(OCC(F)(F)F)nc(n2)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I18	compound treatment	1.276	0.0171	0.23	1.219	0.00711	0.1	0.232	0.9255	1921991	CBDivE_014578	[O-][N+](=O)c1ccccc1S(=O)(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I19	compound treatment	1.256	-0.00286	-0.04	1.204	-0.00789	-0.11	-0.1034	-0.9043	1921992	CBDivE_014579	CCC(=O)OC1(CCN(C)C(C)C1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	I20	compound treatment	1.258	-8.62E-4	-0.01	1.211	-8.93E-4	-0.01	-0.0168	-0.9997	1921993	CBDivE_014580	Nc1nc(Cl)nc(Nc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J01	compound treatment	1.273	0.0141	0.19	1.188	-0.0239	-0.33	-0.0955	-0.253	1680723	CBDivE_014581	CC(=O)Nc1ccc(cc1)S(=O)(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J02	compound treatment	1.259	1.38E-4	0.0	1.188	-0.0239	-0.33	-0.2291	-0.7031	1921994	CBDivE_014582	COc1ccc(NC(=O)CN2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J03	compound treatment	1.28	0.0211	0.29	1.23	0.0181	0.25	0.3762	0.9974	1921995	CBDivE_014583	Clc1cccc(NC(=O)c2cccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J04	compound treatment	1.242	-0.0169	-0.23	1.175	-0.0369	-0.5	-0.5166	-0.9356	1921996	CBDivE_014584	OCCCCNc1ncnc2n(cnc12)C3OC(CO)C(O)C3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J05	compound treatment	1.247	-0.0119	-0.16	1.194	-0.0179	-0.24	-0.2857	-0.9791	1456588	CBDivE_014585	CCN(C(=O)c1ccc(NC(=O)C)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J06	compound treatment	1.242	-0.0169	-0.23	1.211	-8.93E-4	-0.01	-0.1695	-0.7439	1356677	CBDivE_014586	CC(C)(C)NS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J07	compound treatment	1.257	-0.00186	-0.03	1.196	-0.0159	-0.22	-0.171	-0.7838	1037267	CBDivE_014587	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J08	compound treatment	1.276	0.0171	0.23	1.212	1.07E-4	0.0	0.1645	0.7116	1282437	CBDivE_014588	OC(=O)C(Cc1ccc(O)cc1)N2C(=O)CSC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J09	compound treatment	1.259	1.38E-4	0.0	1.216	0.00411	0.06	0.0409	0.7302	1520829	CBDivE_014589	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccccc4I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J10	compound treatment	1.23	-0.0289	-0.39	1.206	-0.00589	-0.08	-0.3321	-0.8354	1921997	CBDivE_014590	Brc1ccc(cc1)S(=O)(=O)Nc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J11	compound treatment	1.278	0.0191	0.26	1.261	0.0491	0.67	0.6561	0.9141	1921998	CBDivE_014591	CCN(CC)C(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J12	compound treatment	1.238	-0.0209	-0.28	1.177	-0.0349	-0.48	-0.5355	-0.9686	1921999	CBDivE_014592	COc1ccc(/C=N/c2ccc3nc([nH]c3c2)c4ccc(Cl)cc4Cl)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J13	compound treatment	1.223	-0.0359	-0.48	1.21	-0.00189	-0.03	-0.3604	-0.7438	1922000	CBDivE_014593	Oc1c(Br)cc(Br)cc1/C=C/2\Sc3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J14	compound treatment	1.22	-0.0389	-0.52	1.19	-0.0219	-0.3	-0.5818	-0.9644	1922001	CBDivE_014594	O=C(N/N=C/C1CC2CCC1C2)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J15	compound treatment	1.28	0.0211	0.29	1.233	0.0211	0.29	0.4052	1.0	1643866	CBDivE_014595	CC(=O)Nc1cccc(NC(=O)c2cccc(C)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J16	compound treatment	1.228	-0.0309	-0.42	1.189	-0.0229	-0.31	-0.5151	-0.9899	1922002	CBDivE_014596	Clc1ccc(cc1)S(=O)(=O)c2ccc(Oc3ccc(cc3)C(=O)C(=O)c4ccccc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J17	compound treatment	1.26	0.00114	0.02	1.165	-0.0469	-0.64	-0.4413	-0.6899	1922003	CBDivE_014597	Clc1c(sc2ccccc12)C(=O)NCCN3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J18	compound treatment	1.283	0.0241	0.33	1.225	0.0131	0.18	0.3566	0.9601	1922004	CBDivE_014598	Clc1ccc(c2nc3ccc(/N=C/c4cccnc4)cc3[nH]2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J19	compound treatment	1.241	-0.0179	-0.24	1.196	-0.0159	-0.22	-0.3236	-0.9986	1131459	CBDivE_014599	CCOC(=O)c1c(N)n(c2cccc(O)c2)c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	J20	compound treatment	1.243	-0.0159	-0.21	1.186	-0.0259	-0.35	-0.401	-0.9712	1922005	CBDivE_014600	OCCNC(=O)c1ccc(cc1)C(=O)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K01	compound treatment	1.259	1.38E-4	0.0	0.267	-0.945	-12.88	-9.1097	-0.707	1213146	CBDivE_014601	CC1CN(C)CC(C)(C)C1(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K02	compound treatment	1.257	-0.00186	-0.03	1.172	-0.0399	-0.54	-0.4024	-0.739	1922006	CBDivE_014602	CCOc1ccc(OCC)c(/C=N/NC(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K03	compound treatment	1.269	0.0101	0.14	0.377	-0.835	-11.38	-7.9537	-0.6986	1922007	CBDivE_014603	CC(=O)OC1CCCC2NCCCC12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K04	compound treatment	1.224	-0.0349	-0.47	1.097	-0.115	-1.57	-1.4404	-0.8806	1922008	CBDivE_014604	FC(F)(F)COc1nc(nc(n1)N2CCNCC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K05	compound treatment	1.264	0.00514	0.07	1.209	-0.00289	-0.04	0.0211	0.2648	1922009	CBDivE_014605	CCN(CC(O)COc1ccc2ccccc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K06	compound treatment	1.32	0.0611	0.82	1.286	0.0741	1.01	1.2978	0.9949	1922010	CBDivE_014606	C/C(=N\NC(=O)c1ccc(cc1)[N+](=O)[O-])/c2cc(O)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K07	compound treatment	1.241	-0.0179	-0.24	1.237	0.0251	0.34	0.0717	0.1713	1451700	CBDivE_014607	COc1ccc2nc(NS(=O)(=O)c3ccccc3)sc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K08	compound treatment	1.243	-0.0159	-0.21	1.225	0.0131	0.18	-0.0249	-0.0894	1778433	CBDivE_014608	[O-][N+](=O)c1ccccc1C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K09	compound treatment	1.234	-0.0249	-0.34	0.988	-0.224	-3.05	-2.396	-0.7801	1922011	CBDivE_014609	Oc1nnc(O)n1/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K10	compound treatment	1.276	0.0171	0.23	1.299	0.0871	1.19	1.0034	0.8292	1922012	CBDivE_014610	COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2ccc(Cl)c(Cl)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K11	compound treatment	1.273	0.0141	0.19	1.194	-0.0179	-0.24	-0.0377	-0.1216	1922013	CBDivE_014611	CC(=O)N/N=C\1/c2ccccc2-c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K12	compound treatment	1.271	0.0121	0.16	1.195	-0.0169	-0.23	-0.0471	-0.1666	1774278	CBDivE_014612	Cc1cccc(c1)N2CCN(C2c3cccc(c3)[N+](=O)[O-])c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K13	compound treatment	1.262	0.00314	0.04	1.196	-0.0159	-0.22	-0.1233	-0.5584	1922014	CBDivE_014613	CN(NC(=O)Cc1c[nH]c2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K14	compound treatment	1.326	0.0671	0.91	1.31	0.0981	1.34	1.5864	0.982	1151315	CBDivE_014614	Cc1ccc(Nc2nc(Cl)nc(NCc3ccccc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K15	compound treatment	1.281	0.0221	0.3	1.211	-8.93E-4	-0.01	0.2026	0.6777	1922015	CBDivE_014615	NC1(CC2CC3CC(N)(C1)C2=O)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K16	compound treatment	1.277	0.0181	0.24	1.243	0.0311	0.42	0.473	0.9658	1922016	CBDivE_014616	CN(C)/C=C/C=C/C(=O)c1ccccc1N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K17	compound treatment	1.308	0.0491	0.66	1.221	0.00911	0.12	0.5566	0.8252	1922017	CBDivE_014617	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)S(=O)(=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K18	compound treatment	1.304	0.0451	0.61	1.252	0.0401	0.55	0.8173	0.9986	1922018	CBDivE_014618	CCCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K19	compound treatment	1.325	0.0661	0.89	1.202	-0.00989	-0.13	0.5355	0.5935	1922019	CBDivE_014619	NC1=NC(=O)/C(=C/c2ccccc2O)/S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	K20	compound treatment	1.295	0.0361	0.49	1.247	0.0351	0.48	0.6833	1.0	1005007	CBDivE_014620	O=S1(=O)c2ccccc2Oc3ccccc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L01	compound treatment	1.251	-0.00786	-0.11	1.227	0.0151	0.21	0.0707	0.305	1776970	CBDivE_014621	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L02	compound treatment	1.245	-0.0139	-0.19	1.171	-0.0409	-0.56	-0.5265	-0.8952	1922020	CBDivE_014622	OC(=O)CC(C(=O)O)c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L03	compound treatment	1.262	0.00314	0.04	1.221	0.00911	0.12	0.1177	0.8974	1922021	CBDivE_014623	N(/N=C/c1ccoc1)c2ccc3nn(nc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L04	compound treatment	1.244	-0.0149	-0.2	1.181	-0.0309	-0.42	-0.4397	-0.9424	1405772	CBDivE_014624	Oc1ccc(CCc2ncccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L05	compound treatment	1.226	-0.0329	-0.44	1.181	-0.0309	-0.42	-0.6114	-0.9997	1776087	CBDivE_014625	CN(Cc1ccccc1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L06	compound treatment	1.282	0.0231	0.31	1.215	0.00311	0.04	0.2507	0.7958	1922022	CBDivE_014626	Clc1ccc(NC(=O)NNc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L07	compound treatment	1.219	-0.0399	-0.54	1.188	-0.0239	-0.33	-0.6106	-0.9712	1922023	CBDivE_014627	CC(=O)Nc1ccc(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L08	compound treatment	1.221	-0.0379	-0.51	1.15	-0.0619	-0.84	-0.958	-0.9711	1922024	CBDivE_014628	O=C(N/N=C\c1ccc2OCOc2c1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L09	compound treatment	1.255	-0.00386	-0.05	1.24	0.0281	0.38	0.2342	0.6054	1585142	CBDivE_014629	NC(=O)COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L10	compound treatment	1.237	-0.0219	-0.29	1.172	-0.0399	-0.54	-0.5932	-0.9586	1922025	CBDivE_014630	COc1cc(/C=N/NC(=S)N)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L11	compound treatment	1.228	-0.0309	-0.42	1.172	-0.0399	-0.54	-0.6791	-0.9913	1412525	CBDivE_014631	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L12	compound treatment	1.267	0.00814	0.11	1.23	0.0181	0.25	0.2522	0.9334	1922026	CBDivE_014632	CCCC/C(=N\NC(=O)c1ccc(O)cc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L13	compound treatment	1.267	0.00814	0.11	1.243	0.0311	0.42	0.3776	0.8617	1776083	CBDivE_014633	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L14	compound treatment	1.268	0.00914	0.12	1.225	0.0131	0.18	0.2136	0.9836	1922027	CBDivE_014634	[O-][N+](=O)c1cccc(/C=N/c2ccc3nc([nH]c3c2)c4ccc(Cl)cc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L15	compound treatment	1.207	-0.0519	-0.7	1.177	-0.0349	-0.48	-0.8312	-0.9823	1584297	CBDivE_014635	O=C(OCCc1ccccc1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L16	compound treatment	1.26	0.00114	0.02	1.203	-0.00889	-0.12	-0.0749	-0.6127	1922028	CBDivE_014636	NC(=O)c1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L17	compound treatment	1.272	0.0131	0.18	1.227	0.0151	0.21	0.271	0.9972	1922029	CBDivE_014637	C/C(=N/NC(=S)N)/CS(=O)(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L18	compound treatment	1.243	-0.0159	-0.21	1.168	-0.0439	-0.6	-0.5745	-0.9039	1922030	CBDivE_014638	Cc1ccsc1/C=N/c2ccc(cc2)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L19	compound treatment	1.222	-0.0369	-0.5	1.157	-0.0549	-0.75	-0.8809	-0.9803	1922031	CBDivE_014639	Nc1nc(CS(=O)(=O)c2ccc(Cl)cc2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	L20	compound treatment	1.279	0.0201	0.27	1.195	-0.0169	-0.23	0.0292	0.082	1922032	CBDivE_014640	C/C(=N/NC(=O)c1cc(O)cc(O)c1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M01	compound treatment	1.291	0.0321	0.43	0.388	-0.824	-11.23	-7.6377	-0.6793	1922033	CBDivE_014641	C1CN=C(O1)c2cccc(c2)C3=NCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M02	compound treatment	1.22	-0.0389	-0.52	1.183	-0.0289	-0.39	-0.6493	-0.9901	1922034	CBDivE_014642	Clc1c2S/C(=C\3/Sc4ccccc4C3=O)/C(=O)c2cc5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M03	compound treatment	1.272	0.0131	0.18	0.382	-0.83	-11.32	-7.8768	-0.6959	1922035	CBDivE_014643	CCc1noc2CC(C)(C)C/C(=N/OC(=O)C)/c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M04	compound treatment	1.251	-0.00786	-0.11	1.213	0.00111	0.02	-0.0643	-0.6004	1922036	CBDivE_014644	Oc1ccccc1/C=N/c2cccc(Nc3nc(nc(n3)N4CCOCC4)N(c5ccccc5)c6ccccc6)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M05	compound treatment	1.233	-0.0259	-0.35	1.186	-0.0259	-0.35	-0.4964	-1.0	1299227	CBDivE_014645	Cc1cc(C)nc(NS(=O)(=O)c2ccc(Br)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M06	compound treatment	1.216	-0.0429	-0.58	1.189	-0.0229	-0.31	-0.6296	-0.9581	1002982	CBDivE_014646	ON=C1c2ccccc2-c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M07	compound treatment	1.254	-0.00486	-0.07	1.195	-0.0169	-0.23	-0.2093	-0.8737	1922037	CBDivE_014647	Cc1cccc(c1)C(=O)N/N=C/c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M08	compound treatment	1.241	-0.0179	-0.24	1.198	-0.0139	-0.19	-0.3044	-0.9929	1922038	CBDivE_014648	CN(C)c1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M09	compound treatment	1.26	0.00114	0.02	0.605	-0.607	-8.28	-5.8411	-0.7058	1922039	CBDivE_014649	[O-][N+](=O)c1ccc(NS(=O)(=O)Nc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M10	compound treatment	1.27	0.0111	0.15	1.242	0.0301	0.41	0.3966	0.9071	1503406	CBDivE_014650	C(Nc1cccc2ncccc12)n3nnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M11	compound treatment	1.269	0.0101	0.14	1.205	-0.00689	-0.09	0.0302	0.1823	1450450	CBDivE_014651	CC(C)CCN1CC(C)C(O)(CC1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M12	compound treatment	1.265	0.00614	0.08	1.234	0.0221	0.3	0.2717	0.8691	872	CBDivE_014652	CCN(CC)CCOC(=O)C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M13	compound treatment	1.228	-0.0309	-0.42	1.204	-0.00789	-0.11	-0.3705	-0.8616	1086044	CBDivE_014653	Nc1ccc(cc1)c2cc3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M14	compound treatment	1.299	0.0401	0.54	1.288	0.0761	1.04	1.1167	0.954	1397664	CBDivE_014654	O=C(NC12CCCC2C3CCC1C3)NC45CCCC5C6CCC4C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M15	compound treatment	1.266	0.00714	0.1	1.244	0.0321	0.44	0.3777	0.8425	1110228	CBDivE_014655	O=C1c2ccccc2C(=O)c3cc(ccc13)S(=O)(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M16	compound treatment	1.258	-8.62E-4	-0.01	1.21	-0.00189	-0.03	-0.0265	-0.9352	1922040	CBDivE_014656	CC[n+]1c(ccc2cc(OC)ccc12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M17	compound treatment	1.255	-0.00386	-0.05	1.198	-0.0139	-0.19	-0.1708	-0.8693	1774574	CBDivE_014657	NCCc1c[nH]c2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M18	compound treatment	1.263	0.00414	0.06	1.207	-0.00489	-0.07	-0.0077	-0.0886	1922041	CBDivE_014658	COC(=O)C1C(=O)/C(=C/Nc2cccc3ccccc23)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M19	compound treatment	1.248	-0.0109	-0.15	1.196	-0.0159	-0.22	-0.2569	-0.9818	1922042	CBDivE_014659	COc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	M20	compound treatment	1.274	0.0151	0.2	1.256	0.0441	0.6	0.5697	0.8969	1922043	CBDivE_014660	C/C(=N/OC(=O)C1CC1c2ccccc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N01	compound treatment	1.234	-0.0249	-0.34	1.258	0.0461	0.63	0.2074	0.2911	1922044	CBDivE_014661	Nc1nc(CS(=O)(=O)c2ccc(Br)cc2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N02	compound treatment	1.223	-0.0359	-0.48	1.226	0.0141	0.19	-0.2061	-0.3958	1023614	CBDivE_014662	Oc1ccc(Cl)cc1c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N03	compound treatment	1.22	-0.0389	-0.52	1.155	-0.0569	-0.78	-0.9193	-0.9818	1922045	CBDivE_014663	Clc1ccc(cc1)S(=O)(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N04	compound treatment	1.217	-0.0419	-0.56	1.169	-0.0429	-0.58	-0.8129	-0.9998	1922046	CBDivE_014664	C/C(=N\NC(=O)c1ccco1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N05	compound treatment	1.235	-0.0239	-0.32	1.191	-0.0209	-0.28	-0.4291	-0.9981	1922047	CBDivE_014665	[O-][N+](=O)/C(=C\Nc1ccc(Cl)cc1)/C2=CC(=O)C=CC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N06	compound treatment	1.198	-0.0609	-0.82	1.149	-0.0629	-0.86	-1.187	-0.9998	1922048	CBDivE_014666	Cc1cc(C)nc(n1)N2C(=O)C3C4CCC(O4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N07	compound treatment	1.217	-0.0419	-0.56	1.202	-0.00989	-0.13	-0.4947	-0.852	1922049	CBDivE_014667	OC(=O)c1cc(Cl)n(n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N08	compound treatment	1.189	-0.0699	-0.94	1.17	-0.0419	-0.57	-1.0704	-0.9712	1922050	CBDivE_014668	[O-][N+](=O)c1ccccc1S(=O)(=O)NC2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N09	compound treatment	1.193	-0.0659	-0.89	1.213	0.00111	0.02	-0.6176	-0.695	1615831	CBDivE_014669	OC(CN1C(SCC1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N10	compound treatment	1.211	-0.0479	-0.65	1.208	-0.00389	-0.05	-0.4941	-0.7627	1922051	CBDivE_014670	Oc1ccc2ccccc2c1/C=N/NC(=O)c3nc(n[nH]3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N11	compound treatment	1.219	-0.0399	-0.54	1.186	-0.0259	-0.35	-0.6299	-0.9792	1922052	CBDivE_014671	[O-][N+](=O)c1ccc2oc(=O)c([N+](=O)[O-])c(Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N12	compound treatment	1.241	-0.0179	-0.24	1.178	-0.0339	-0.46	-0.4972	-0.9539	1922053	CBDivE_014672	Fc1ccc(cc1)N2CCN(Cc3ccccc3F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N13	compound treatment	1.242	-0.0169	-0.23	1.236	0.0241	0.33	0.0716	0.1791	1133475	CBDivE_014673	Brc1ccc(NC(=O)Cn2nnc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N14	compound treatment	1.245	-0.0139	-0.19	1.21	-0.00189	-0.03	-0.1505	-0.7971	1572479	CBDivE_014674	Fc1ccc(cc1)N2CCN(Cc3ccoc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N15	compound treatment	1.226	-0.0329	-0.44	1.166	-0.0459	-0.63	-0.756	-0.9857	1922054	CBDivE_014675	Oc1ccc2ccccc2c1/C=N\Nc3ncnc4sc5CCCCc5c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N16	compound treatment	1.254	-0.00486	-0.07	1.188	-0.0239	-0.33	-0.2768	-0.8328	1383357	CBDivE_014676	CC(C)(C)c1cc(CN2CCN(CC2)c3ccccn3)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N17	compound treatment	1.229	-0.0299	-0.4	1.154	-0.0579	-0.79	-0.8431	-0.9512	1922055	CBDivE_014677	Nc1nc(CS(=O)(=O)c2ccc3ccccc3c2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N18	compound treatment	1.263	0.00414	0.06	1.183	-0.0289	-0.39	-0.2391	-0.6009	1485359	CBDivE_014678	COc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N19	compound treatment	1.255	-0.00386	-0.05	1.235	0.0231	0.32	0.186	0.5823	1652009	CBDivE_014679	CCOC(=O)c1c(N)n(c2cccc(c2)S(=O)(=O)N)c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	N20	compound treatment	1.256	-0.00286	-0.04	1.192	-0.0199	-0.27	-0.2191	-0.7997	1346656	CBDivE_014680	Fc1ccc(cc1)N2CCN(Cc3cccc(F)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O01	compound treatment	1.283	0.0241	0.33	1.199	-0.0129	-0.18	0.1059	0.2863	1922056	CBDivE_014681	CC1CC(C)OP(=S)(O)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O02	compound treatment	1.32	0.0611	0.82	1.299	0.0871	1.19	1.4231	0.9841	1105392	CBDivE_014682	Cc1nc(N)c2c3CCCCc3sc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O03	compound treatment	1.307	0.0481	0.65	1.262	0.0501	0.68	0.9424	0.9997	1922057	CBDivE_014683	[O-][N+](=O)c1ccc(N/N=C/c2ccc(o2)c3ccc(I)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O04	compound treatment	1.302	0.0431	0.58	1.272	0.0601	0.82	0.9911	0.9859	1922058	CBDivE_014684	O=C(N/C=C/c1nc2ccccc2s1)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O05	compound treatment	1.307	0.0481	0.65	1.237	0.0251	0.34	0.7013	0.9553	1776101	CBDivE_014685	[O-][N+](=O)c1ccc(o1)C(=O)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O06	compound treatment	1.249	-0.00986	-0.13	1.203	-0.00889	-0.12	-0.1798	-0.9989	1922059	CBDivE_014686	COC(=O)/C(=C\C=C\c1ccccc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O07	compound treatment	1.259	1.38E-4	0.0	1.119	-0.0929	-1.27	-0.8944	-0.7061	1201350	CBDivE_014687	CC(=O)Oc1cc2oc(=O)cc(C)c2cc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O08	compound treatment	1.254	-0.00486	-0.07	1.195	-0.0169	-0.23	-0.2093	-0.8737	1922060	CBDivE_014688	Cn1c2ccccc2c3cc(/C=C\4/N=C(OC4=O)c5ccccc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O09	compound treatment	1.308	0.0491	0.66	1.298	0.0861	1.17	1.299	0.9634	1922061	CBDivE_014689	CC(C)NCCCCCCN1C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O10	compound treatment	1.288	0.0291	0.39	1.246	0.0341	0.47	0.6068	0.9965	1922062	CBDivE_014690	COc1ccc(/C=C(\NC(=O)c2ccccc2)/C(=O)N3CCCCC3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O11	compound treatment	1.283	0.0241	0.33	1.197	-0.0149	-0.2	0.0867	0.2258	1922063	CBDivE_014691	OCCNc1c(cc([N+](=O)[O-])c2cccnc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O12	compound treatment	1.319	0.0601	0.81	1.291	0.0791	1.08	1.3365	0.9901	1922064	CBDivE_014692	NNC(=O)CC1CC(=NN1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O13	compound treatment	1.291	0.0321	0.43	1.229	0.0171	0.23	0.4715	0.9577	1922065	CBDivE_014693	CCCNS(=O)(=O)c1ccc2n3CCCc3nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O14	compound treatment	1.28	0.0211	0.29	1.26	0.0481	0.66	0.6655	0.9304	1922066	CBDivE_014694	CC(C)OC(=O)/C(=C\C=C\c1ccccc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O15	compound treatment	1.279	0.0201	0.27	1.237	0.0251	0.34	0.4342	0.9934	1922067	CBDivE_014695	Cc1n(O)c2/C(=N\O)/C=C/C(=N\O)/c2[n+]1[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O16	compound treatment	1.29	0.0311	0.42	1.241	0.0291	0.4	0.5777	0.9996	1922068	CBDivE_014696	Clc1c(sc2ccccc12)C(=O)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O17	compound treatment	1.29	0.0311	0.42	1.215	0.00311	0.04	0.327	0.7745	1922069	CBDivE_014697	OC(=O)CC(=O)NN=C1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O18	compound treatment	1.265	0.00614	0.08	1.224	0.0121	0.17	0.1753	0.9491	1616176	CBDivE_014698	Cc1ccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O19	compound treatment	1.275	0.0161	0.22	1.22	0.00811	0.11	0.2321	0.9506	1922070	CBDivE_014699	Cc1cc(C)n(CNc2ccc3sc(C)nc3c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	O20	compound treatment	1.36	0.101	1.36	1.335	0.123	1.68	2.1518	0.9947	1606417	CBDivE_014700	Clc1nc(Cl)nc(NCc2ccccc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P01	compound treatment	1.28	0.0211	0.29	1.226	0.0141	0.19	0.3377	0.9816	1922071	CBDivE_014701	Oc1ccc2ccccc2c1N=Nc3ccc4C5c6ccccc6C(c7ccccc57)c4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P02	compound treatment	1.247	-0.0119	-0.16	1.198	-0.0139	-0.19	-0.2471	-0.9965	1922072	CBDivE_014702	NC(=O)c1c(NC(=O)CN2CCOCC2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P03	compound treatment	1.262	0.00314	0.04	1.22	0.00811	0.11	0.1081	0.9132	1331794	CBDivE_014703	Cc1cc(=O)oc2cc(OCC(=O)Oc3ccc4c(C)cc(=O)oc4c3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P04	compound treatment	1.186	-0.0729	-0.98	1.141	-0.0709	-0.97	-1.3786	-1.0	1922073	CBDivE_014704	CCOC(=O)N/N=C/c1ccc2OCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P05	compound treatment	1.28	0.0211	0.29	1.212	1.07E-4	0.0	0.2027	0.7107	1922074	CBDivE_014705	CN(C)C(=S)SCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P06	compound treatment	1.255	-0.00386	-0.05	1.201	-0.0109	-0.15	-0.1419	-0.9013	1922075	CBDivE_014706	FC(F)(F)c1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P07	compound treatment	1.209	-0.0499	-0.67	1.165	-0.0469	-0.64	-0.9278	-0.9997	1922076	CBDivE_014707	CCS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc3ccccc3c2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P08	compound treatment	1.161	-0.0979	-1.32	1.11	-0.102	-1.39	-1.916	-0.9997	1695919	CBDivE_014708	Fc1ccc(cc1)N2CCN(Cc3coc4ccccc4c3=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P09	compound treatment	1.222	-0.0369	-0.5	1.125	-0.0869	-1.18	-1.1895	-0.9257	1922077	CBDivE_014709	Cc1cc(nc(SCC(=O)O)n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P10	compound treatment	0.825	-0.434	-5.85	0.704	-0.508	-6.93	-9.0361	-0.9965	1486691	CBDivE_014710	Fc1ccc(cc1)N2CCN(Cc3ccc4ccccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P11	compound treatment	1.209	-0.0499	-0.67	1.149	-0.0629	-0.86	-1.0821	-0.9928	1922078	CBDivE_014711	CCSc1ccsc1SC(CC(=O)c2ccccc2)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P12	compound treatment	1.248	-0.0109	-0.15	1.195	-0.0169	-0.23	-0.2665	-0.9762	1411485	CBDivE_014712	C(N1CCN(CC1)c2ccccn2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P13	compound treatment	1.166	-0.0929	-1.25	1.113	-0.0989	-1.35	-1.8394	-0.9993	1922079	CBDivE_014713	Nc1nc(Cl)nc(Nc2ccccc2SC(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P14	compound treatment	1.268	0.00914	0.12	1.198	-0.0139	-0.19	-0.0468	-0.207	1343612	CBDivE_014714	Cc1cccc(CN2CCN(CC2)c3ccc(F)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P15	compound treatment	1.205	-0.0539	-0.73	1.143	-0.0689	-0.94	-1.1781	-0.9919	1280045	CBDivE_014715	OC(=O)C1(CC2CC3CC(C2)C1=O)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P16	compound treatment	1.239	-0.0199	-0.27	1.153	-0.0589	-0.8	-0.7573	-0.8946	1405397	CBDivE_014716	Fc1ccc(cc1)N2CCN(Cc3cccs3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P17	compound treatment	1.259	1.38E-4	0.0	1.206	-0.00589	-0.08	-0.0555	-0.6905	1526057	CBDivE_014717	CC(CNC(C)c1ccccc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P18	compound treatment	1.237	-0.0219	-0.29	1.219	0.00711	0.1	-0.14	-0.451	1738245	CBDivE_014718	Fc1ccc(cc1)N2CCN(Cc3ccc(Br)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P19	compound treatment	1.254	-0.00486	-0.07	1.232	0.0201	0.27	0.1475	0.5232	1922080	CBDivE_014719	Cc1cc(C)c(C(=O)NCC(=O)O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.46	P20	compound treatment	1.291	0.0321	0.43	1.261	0.0491	0.67	0.7801	0.9779	1197391	CBDivE_014720	C(N1CCN(CC1)c2ccccn2)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A01	compound treatment	1.262	1.34E-4	0.0	1.187	-0.0168	-0.23	-0.1603	-0.7015	1922081	CBDivE_014721	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A02	compound treatment	1.257	-0.00487	-0.07	1.217	0.0132	0.18	0.0813	0.423	1922082	CBDivE_014722	Cc1nc2ccc3c4sc(C)nc4ccc3c2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A03	compound treatment	1.3	0.0381	0.51	1.232	0.0282	0.39	0.6361	0.9898	1266693	CBDivE_014723	Fc1ccc(cc1)N2CCN(Cc3cccnc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A04	compound treatment	1.255	-0.00687	-0.09	1.191	-0.0128	-0.17	-0.1885	-0.9565	1922083	CBDivE_014724	Clc1ccc(cc1)C(=O)NC(NCc2ccccc2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A05	compound treatment	1.286	0.0241	0.33	1.198	-0.00576	-0.08	0.1747	0.5217	1703468	CBDivE_014725	Fc1ccc(cc1)N2CCN(Cc3cccc(Br)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A06	compound treatment	1.285	0.0231	0.31	1.251	0.0472	0.64	0.6762	0.9446	1026940	CBDivE_014726	CC(=O)c1ccc2[nH]c3ccc(cc3c2c1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A07	compound treatment	1.254	-0.00787	-0.11	1.191	-0.0128	-0.17	-0.198	-0.9719	1248078	CBDivE_014727	Brc1ccccc1CN2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A08	compound treatment	1.266	0.00413	0.06	1.203	-7.55E-4	-0.01	0.0322	0.5669	1922084	CBDivE_014728	CC(=O)Nc1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A09	compound treatment	1.238	-0.0239	-0.32	1.175	-0.0288	-0.39	-0.5049	-0.9952	1422778	CBDivE_014729	C(N1CCN(CC1)c2ccccn2)c3ccoc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A10	compound treatment	1.223	-0.0389	-0.52	1.128	-0.0758	-1.03	-1.1012	-0.9506	1922085	CBDivE_014730	FC(F)(F)COc1nc(N/N=C/c2ccccc2Br)nc(n1)N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A11	compound treatment	1.245	-0.0169	-0.23	1.199	-0.00476	-0.06	-0.2067	-0.8738	1472995	CBDivE_014731	Fc1ccc(cc1)N2CCN(Cc3ccc(F)cc3F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A12	compound treatment	1.275	0.0131	0.18	1.242	0.0382	0.52	0.4941	0.897	1782252	CBDivE_014732	[O-][N+](=O)c1ccc(cc1)c2nc3ccccc3nc2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A13	compound treatment	1.294	0.0321	0.43	1.244	0.0402	0.55	0.6946	0.9932	1548563	CBDivE_014733	Fc1ccc(cc1)N2CCN(Cc3ccccc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A14	compound treatment	1.311	0.0491	0.66	1.25	0.0462	0.63	0.9146	0.9997	1690989	CBDivE_014734	OC(=O)c1ccc(Oc2ccc(cc2)C(=O)c3ccc(C(=O)O)c(c3)C(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A15	compound treatment	1.244	-0.0179	-0.24	1.181	-0.0228	-0.31	-0.3898	-0.9922	1264143	CBDivE_014735	Brc1csc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A16	compound treatment	1.263	0.00113	0.02	1.253	0.0492	0.67	0.4857	0.723	1922086	CBDivE_014736	COc1cccc(c1)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A17	compound treatment	1.216	-0.0459	-0.62	1.168	-0.0358	-0.49	-0.7823	-0.993	1922087	CBDivE_014737	CCCc1sc(nc1c2ccccc2)N(C(=O)c3cccc(I)c3)c4ccc(OC)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A18	compound treatment	1.307	0.0451	0.61	1.285	0.0812	1.11	1.2139	0.9603	1922088	CBDivE_014738	[O-][N+](=O)c1cccc(c1)c2cnc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A19	compound treatment	1.24	-0.0219	-0.29	1.176	-0.0278	-0.38	-0.4762	-0.9924	1922089	CBDivE_014739	Cc1ccc(N(C(=O)c2cccc(F)c2)c3nc(c(s3)c4ccc(Cl)cc4)C(F)(F)F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	A20	compound treatment	1.291	0.0291	0.39	1.239	0.0352	0.48	0.6178	0.995	1009372	CBDivE_014740	OC(=O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B01	compound treatment	1.258	-0.00387	-0.05	1.198	-0.00576	-0.08	-0.0924	-0.9803	1922090	CBDivE_014741	C/N=C/C1C2CCC(C)(C1=O)C2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B02	compound treatment	1.266	0.00413	0.06	1.202	-0.00176	-0.02	0.0225	0.3709	1922091	CBDivE_014742	CN1CCN(CCCNc2c(N)c(=O)oc3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B03	compound treatment	1.22	-0.0419	-0.56	1.156	-0.0478	-0.65	-0.8598	-0.9975	1922092	CBDivE_014743	FC(F)(F)c1nc2ccccc2c3nc4ccccc4n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B04	compound treatment	1.286	0.0241	0.33	1.229	0.0252	0.34	0.4736	0.9996	1922093	CBDivE_014744	Oc1ccccc1/C=N/c2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B05	compound treatment	1.287	0.0251	0.34	1.246	0.0422	0.58	0.6471	0.9681	1922094	CBDivE_014745	CCCNC(=O)OCCOC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B06	compound treatment	1.273	0.0111	0.15	1.225	0.0212	0.29	0.3111	0.9532	1922095	CBDivE_014746	COC(=O)CN1CCN(CC1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B07	compound treatment	1.299	0.0371	0.5	1.254	0.0502	0.69	0.8387	0.9882	1922096	CBDivE_014747	[O-][N+](=O)c1cccc(c1)c2ccc(o2)C(=S)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B08	compound treatment	1.281	0.0191	0.26	1.232	0.0282	0.39	0.4549	0.9811	1144699	CBDivE_014748	CC1(NC(=O)CS1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B09	compound treatment	1.255	-0.00687	-0.09	1.169	-0.0348	-0.47	-0.4006	-0.8296	1922097	CBDivE_014749	COCCNC(=O)C1(CC2CC3C1)CC(C2)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B10	compound treatment	1.306	0.0441	0.6	1.287	0.0832	1.14	1.2237	0.9546	1922098	CBDivE_014750	C(CSc1nc2ccccc2s1)Sc3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B11	compound treatment	1.261	-8.66E-4	-0.01	1.236	0.0322	0.44	0.3027	0.6881	1206949	CBDivE_014751	COc1ccc(NC(=O)C2(CC3CC4C2)CC(C3)(C4)c5ccc(C)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B12	compound treatment	1.264	0.00213	0.03	1.212	0.00824	0.11	0.0999	0.8604	1591003	CBDivE_014752	CC1(CC(=O)NN)OCC(CN2CCCCC2)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B13	compound treatment	1.241	-0.0209	-0.28	1.159	-0.0448	-0.61	-0.6306	-0.9383	1922099	CBDivE_014753	CC/C(=N/NC(=O)c1cccc(c1)[N+](=O)[O-])/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B14	compound treatment	1.311	0.0491	0.66	1.269	0.0652	0.89	1.0978	0.9895	1922100	CBDivE_014754	[O-][N+](=O)c1cccc(NC2(C(=O)c3ccccc3C2=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B15	compound treatment	1.276	0.0141	0.19	1.233	0.0292	0.4	0.4168	0.943	1922101	CBDivE_014755	Cc1cccc(c1)C(=O)N/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B16	compound treatment	1.259	-0.00287	-0.04	1.217	0.0132	0.18	0.1004	0.5434	1922102	CBDivE_014756	OC1(CC2CC3C1)CC(C2)C3=N/N=C\4/NC(=O)CS4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B17	compound treatment	1.278	0.0161	0.22	1.234	0.0302	0.41	0.4455	0.9554	1922103	CBDivE_014757	[O-][N+](=O)c1ccccc1Cn2c(=N)sc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B18	compound treatment	1.256	-0.00587	-0.08	1.214	0.0102	0.14	0.0428	0.2668	1922104	CBDivE_014758	COc1nc(C)nc(NC(=O)NS(=O)(=O)N(Cc2ccccc2)c3cccnc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B19	compound treatment	1.259	-0.00287	-0.04	1.211	0.00724	0.1	0.0425	0.4008	1922105	CBDivE_014759	Nc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	B20	compound treatment	1.255	-0.00687	-0.09	1.21	0.00624	0.09	-0.0053	-0.042	1922106	CBDivE_014760	Brc1ccc(/C=N/N=C\c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C01	compound treatment	1.233	-0.0289	-0.39	1.16	-0.0438	-0.6	-0.6973	-0.9786	1678490	CBDivE_014761	COc1cccc(NC(=O)C2CC2(c3ccc(C)cc3)c4ccc(C)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C02	compound treatment	1.239	-0.0229	-0.31	1.22	0.0162	0.22	-0.0615	-0.1619	1922107	CBDivE_014762	CCC(=O)Nc1ccc2nc([nH]c2c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C03	compound treatment	1.268	0.00613	0.08	1.187	-0.0168	-0.23	-0.103	-0.424	1922108	CBDivE_014763	O=C(Cc1ccccc1)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C04	compound treatment	1.257	-0.00487	-0.07	1.207	0.00324	0.04	-0.0151	-0.1911	1922109	CBDivE_014764	O=C(Oc1ccccc1)SC2CCS(=O)(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C05	compound treatment	1.264	0.00213	0.03	1.192	-0.0118	-0.16	-0.093	-0.571	1922110	CBDivE_014765	C/C(=C\CC\C(=N/NC(=S)N)\C)/CCC1C(=CCC2C(C)(C)CCCC12C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C06	compound treatment	1.295	0.0331	0.45	1.25	0.0462	0.63	0.762	0.9858	1922111	CBDivE_014766	Clc1ccc(cc1)c2nc3cc4ccccc4cc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C07	compound treatment	1.264	0.00213	0.03	1.204	2.45E-4	0.0	0.0227	0.7838	1317939	CBDivE_014767	COc1ccc(cc1)C(=O)NCC2(OC3C=C2)C4C3C(=O)N(Cc5ccccc5)C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C08	compound treatment	1.271	0.00913	0.12	1.22	0.0162	0.22	0.2438	0.9617	1922112	CBDivE_014768	Clc1ccc(Sc2ncnc3sc4CCCCc4c23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C09	compound treatment	1.223	-0.0389	-0.52	1.176	-0.0278	-0.38	-0.6384	-0.9872	1922113	CBDivE_014769	Cc1sc(Nc2ccccc2C)nc1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C10	compound treatment	1.291	0.0291	0.39	1.218	0.0142	0.19	0.4153	0.9472	1922114	CBDivE_014770	O=S1(=O)CCC(C1)SC2CCS(=O)(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C11	compound treatment	1.283	0.0211	0.29	1.217	0.0132	0.18	0.3293	0.9757	1375423	CBDivE_014771	Cc1ccc(cc1)C2(CC2C(=O)Nc3nccs3)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C12	compound treatment	1.316	0.0541	0.73	1.247	0.0432	0.59	0.9334	0.9944	1625003	CBDivE_014772	NS(=O)(=O)c1ccc(cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C13	compound treatment	1.264	0.00213	0.03	1.181	-0.0228	-0.31	-0.1991	-0.6387	1665472	CBDivE_014773	CCc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C14	compound treatment	1.28	0.0181	0.24	1.236	0.0322	0.44	0.4839	0.9617	1922115	CBDivE_014774	Cc1nc2c(cc(O)c3ccsc32)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C15	compound treatment	1.311	0.0491	0.66	1.25	0.0462	0.63	0.9146	0.9997	1922116	CBDivE_014775	Oc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C16	compound treatment	1.286	0.0241	0.33	1.234	0.0302	0.41	0.5219	0.9931	1922117	CBDivE_014776	O=C(CCN1C(=O)/C(=C/2\SC(=S)N(CCC(=O)Nc3nccs3)C2=O)/SC1=S)Nc4nccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C17	compound treatment	1.244	-0.0179	-0.24	1.169	-0.0348	-0.47	-0.5056	-0.9508	1547353	CBDivE_014777	Cc1[nH]c2ccccc2c1CN3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C18	compound treatment	1.281	0.0191	0.26	1.234	0.0302	0.41	0.4742	0.9745	1922118	CBDivE_014778	ClC(Cl)C(NCc1ccccc1)NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C19	compound treatment	1.236	-0.0259	-0.35	1.155	-0.0488	-0.66	-0.7169	-0.9547	1446994	CBDivE_014779	Fc1ccc(cc1)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	C20	compound treatment	1.258	-0.00387	-0.05	1.209	0.00524	0.07	0.0137	0.1547	1377687	CBDivE_014780	CCN1C(=O)c2cccc3c(NC(=O)C(c4ccccc4)c5ccccc5)ccc1c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D01	compound treatment	1.27	0.00813	0.11	1.194	-0.00976	-0.13	-0.0165	-0.0955	1922119	CBDivE_014781	CCCCOC(=O)COc1cc(=O)oc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D02	compound treatment	1.248	-0.0139	-0.19	1.158	-0.0458	-0.62	-0.5735	-0.8804	1922120	CBDivE_014782	COc1ccc(cc1O)[C@H]2NCC[C@@]3(O)CCCC[C@H]23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D03	compound treatment	1.243	-0.0189	-0.25	1.182	-0.0218	-0.3	-0.3897	-0.9971	1922121	CBDivE_014783	NC(=O)c1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D04	compound treatment	1.255	-0.00687	-0.09	1.179	-0.0248	-0.34	-0.3042	-0.869	1922122	CBDivE_014784	O=C(Cc1ccccn1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D05	compound treatment	1.259	-0.00287	-0.04	1.217	0.0132	0.18	0.1004	0.5434	1922123	CBDivE_014785	NC(=O)c1ccc(/N=C/c2ccc(O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D06	compound treatment	1.35	0.0881	1.19	1.279	0.0752	1.03	1.5663	0.9973	1922124	CBDivE_014786	O=C(Nc1ccccc1)OCC2345B67(B89(B%10%11(B8%126%13)B%12%14%15B%1372%16)B%10%17%18B%11%14%19C%15%16%205COC(=O)Nc%21ccccc%21)B9%173B%18%19%204
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D07	compound treatment	1.247	-0.0149	-0.2	1.203	-7.55E-4	-0.01	-0.1491	-0.7425	1922125	CBDivE_014787	O=C(NNC(=O)c1ccncc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D08	compound treatment	1.244	-0.0179	-0.24	1.191	-0.0128	-0.17	-0.2934	-0.9872		CBDivE_014788	
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D09	compound treatment	1.298	0.0361	0.49	1.257	0.0532	0.73	0.8581	0.9812	1922127	CBDivE_014789	Oc1ccc(cc1)C2Oc3ccccc3C4CC(=NN42)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D10	compound treatment	1.249	-0.0129	-0.17	1.188	-0.0158	-0.21	-0.2747	-0.9944		CBDivE_014790	
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D11	compound treatment	1.247	-0.0149	-0.2	1.154	-0.0498	-0.68	-0.6216	-0.8785	1922129	CBDivE_014791	Cc1ccnc2n3ccccc3n[n+]12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D12	compound treatment	1.266	0.00413	0.06	1.223	0.0192	0.26	0.225	0.8387	1590137	CBDivE_014792	COc1ccc(cc1OC)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D13	compound treatment	1.31	0.0481	0.65	1.261	0.0572	0.78	1.0111	0.9958	1498499	CBDivE_014793	COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)nc(OC)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D14	compound treatment	1.293	0.0311	0.42	1.255	0.0512	0.7	0.7911	0.9703		CBDivE_014794	
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D15	compound treatment	1.218	-0.0439	-0.59	1.127	-0.0768	-1.05	-1.1586	-0.9636	3107723	CBDivE_014795	CC[n+]1ccsc1N.Cc1ccc(cc1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D16	compound treatment	1.281	0.0191	0.26	1.236	0.0322	0.44	0.4934	0.9678	1922132	CBDivE_014796	OC1=C(/C=C(\F)/C=C2C(=O)c3ccccc3C2=O)C(=O)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D17	compound treatment	1.262	1.34E-4	0.0	1.21	0.00624	0.09	0.0615	0.722	1922133	CBDivE_014797	Clc1ccc(C(=O)Nc2ccc(cc2)c3nc4ccccc4s3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D18	compound treatment	1.276	0.0141	0.19	1.241	0.0372	0.51	0.494	0.9105	1922134	CBDivE_014798	Cc1ccc(C(=O)NCc2ccccc2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D19	compound treatment	1.284	0.0221	0.3	1.23	0.0262	0.36	0.4642	0.9959	1922135	CBDivE_014799	CCn1c2ccccc2c3cc(/C=N/c4ccc(cc4)S(=O)(=O)N)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	D20	compound treatment	1.26	-0.00187	-0.03	1.223	0.0192	0.26	0.1678	0.6364	1922136	CBDivE_014800	O=C(N/N=C/c1ccccc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E01	compound treatment	1.234	-0.0279	-0.38	1.161	-0.0428	-0.58	-0.6781	-0.9775	1169352	CBDivE_014801	Fc1ccc(cc1)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E02	compound treatment	1.301	0.0391	0.53	1.276	0.0722	0.99	1.0699	0.9573	1922137	CBDivE_014802	CCN(CC)CC(=O)N1c2ccccc2C=Cc3ccc(NC(=O)OC)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E03	compound treatment	1.27	0.00813	0.11	1.238	0.0342	0.47	0.4078	0.8501	1922138	CBDivE_014803	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3ccc(F)cc3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E04	compound treatment	1.275	0.0131	0.18	1.209	0.00524	0.07	0.1759	0.9204	1922139	CBDivE_014804	CN(C)CC(=O)N1c2ccccc2CCc3ccc(NC(=O)c4ccc(N)cc4)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E05	compound treatment	1.251	-0.0109	-0.15	1.19	-0.0138	-0.19	-0.2363	-0.9926	1500438	CBDivE_014805	COc1ccc(CN2CCN(CC2)c3ccccn3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E06	compound treatment	1.247	-0.0149	-0.2	1.194	-0.00976	-0.13	-0.2359	-0.9801	1922140	CBDivE_014806	[O-][N+](=O)c1ccc(c2nc3ccccc3s2)c(NC(=O)c4ccccc4Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E07	compound treatment	1.257	-0.00487	-0.07	1.186	-0.0178	-0.24	-0.2176	-0.8675	1486585	CBDivE_014807	COc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E08	compound treatment	1.267	0.00513	0.07	1.236	0.0322	0.44	0.3599	0.8085	1914550	CBDivE_014808	C(Nn1cn[n+](Cc2ccccc2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E09	compound treatment	1.28	0.0181	0.24	1.228	0.0242	0.33	0.4068	0.989	1470214	CBDivE_014809	Fc1ccc(cc1)N2CCN(Cc3ccc(Br)s3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E10	compound treatment	1.267	0.00513	0.07	1.234	0.0302	0.41	0.3406	0.8145	1922141	CBDivE_014810	CC1(CC2(C)CC3(C)C1)CC(C/N=C/c4c(O)ccc5ccccc45)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E11	compound treatment	1.258	-0.00387	-0.05	1.159	-0.0448	-0.61	-0.4684	-0.7647	1134653	CBDivE_014811	Brc1ccc(CN2CCN(CC2)c3ccccn3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E12	compound treatment	1.279	0.0171	0.23	1.244	0.0402	0.55	0.5515	0.9261	1721607	CBDivE_014812	CCNc1nc(cs1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E13	compound treatment	1.24	-0.0219	-0.29	1.153	-0.0508	-0.69	-0.698	-0.9277	1280404	CBDivE_014813	CN(C)c1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E14	compound treatment	1.288	0.0261	0.35	1.248	0.0442	0.6	0.6759	0.9673	1922142	CBDivE_014814	Cc1cc(C)[n+]2nc(CCCc3n[n+]4c(C)cc(C)nc4n3C)n(C)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E15	compound treatment	1.245	-0.0169	-0.23	1.158	-0.0458	-0.62	-0.6021	-0.9066	1247969	CBDivE_014815	CCOc1cc(CN2CCN(CC2)c3ccccn3)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E16	compound treatment	1.316	0.0541	0.73	1.252	0.0482	0.66	0.9816	0.9986	1922143	CBDivE_014816	Cc1ccc(Oc2cccc(NC(=O)c3ccc(cc3C(=O)O)[N+](=O)[O-])c2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E17	compound treatment	1.238	-0.0239	-0.32	1.167	-0.0368	-0.5	-0.5821	-0.9771	1593554	CBDivE_014817	CC(C)(C)c1cc(CN2CCN(CC2)c3ccc(F)cc3)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E18	compound treatment	1.273	0.0111	0.15	1.251	0.0472	0.64	0.5618	0.8492	1922144	CBDivE_014818	OC(=O)c1cccc([N+](=O)[O-])c1C(=O)Nc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E19	compound treatment	1.256	-0.00587	-0.08	1.182	-0.0218	-0.3	-0.2657	-0.8655	1521059	CBDivE_014819	Fc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	E20	compound treatment	1.29	0.0281	0.38	1.264	0.0602	0.82	0.8493	0.9385	1039046	CBDivE_014820	OC(=O)c1ccccc1C(=O)Nc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F01	compound treatment	1.221	-0.0409	-0.55	1.146	-0.0578	-0.79	-0.9467	-0.9848	1922145	CBDivE_014821	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F02	compound treatment	1.221	-0.0409	-0.55	1.164	-0.0398	-0.54	-0.7732	-1.0	1445236	CBDivE_014822	COc1cc2CCN(C)C(c3ccc4OCOc4c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F03	compound treatment	1.242	-0.0199	-0.27	1.161	-0.0428	-0.58	-0.6018	-0.9378	1922146	CBDivE_014823	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F04	compound treatment	1.234	-0.0279	-0.38	1.196	-0.00776	-0.11	-0.3406	-0.8722	1922147	CBDivE_014824	O=C(CCN1C(=O)/C(=C/c2ccccc2)/SC1=S)OC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F05	compound treatment	1.271	0.00913	0.12	1.215	0.0112	0.15	0.1956	0.9941	1922148	CBDivE_014825	Oc1cc(O)cc(c1)C(=O)N/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F06	compound treatment	1.258	-0.00387	-0.05	1.161	-0.0428	-0.58	-0.4491	-0.7673	1922149	CBDivE_014826	CC1=C(C(NC(=S)N1)c2ccccc2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F07	compound treatment	1.264	0.00213	0.03	1.217	0.0132	0.18	0.1481	0.8096	1922150	CBDivE_014827	C/C(=N/NC(=O)c1cc(O)cc(O)c1)/CCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F08	compound treatment	1.255	-0.00687	-0.09	1.19	-0.0138	-0.19	-0.1981	-0.9471	1019284	CBDivE_014828	OCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F09	compound treatment	1.252	-0.00987	-0.13	1.188	-0.0158	-0.21	-0.246	-0.9735	1922151	CBDivE_014829	C/C(=N/NC(=O)c1cc(O)cc(O)c1)/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F10	compound treatment	1.293	0.0311	0.42	1.231	0.0272	0.37	0.5597	0.9981	1922152	CBDivE_014830	COc1ccc(OC)c(c1)C2NCCc3c2[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F11	compound treatment	1.312	0.0501	0.68	1.258	0.0542	0.74	1.0013	0.999	1922153	CBDivE_014831	CC(C)C/C(=N/NC(=O)c1cc(O)cc(O)c1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F12	compound treatment	1.295	0.0331	0.45	1.255	0.0512	0.7	0.8102	0.9767	1922154	CBDivE_014832	Oc1ccc(cc1)C(=O)C(=O)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F13	compound treatment	1.248	-0.0139	-0.19	1.206	0.00224	0.03	-0.1106	-0.5836	1922155	CBDivE_014833	C/C(=N/NC(=O)c1cc(O)cc(O)c1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F14	compound treatment	1.233	-0.0289	-0.39	1.165	-0.0388	-0.53	-0.6491	-0.9887	1922156	CBDivE_014834	[O-][N+](=O)c1ccc(NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccc(cc4)[N+](=O)[O-])C3=O)/SC2=S)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F15	compound treatment	1.238	-0.0239	-0.32	1.19	-0.0138	-0.19	-0.3603	-0.9669	1922157	CBDivE_014835	Oc1ccc(cc1)C(=O)NN=C(/C=C/c2ccccc2)/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F16	compound treatment	1.288	0.0261	0.35	1.227	0.0232	0.32	0.4734	0.9986	1922158	CBDivE_014836	COC(=O)CCSc1nccn1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F17	compound treatment	1.217	-0.0449	-0.61	1.157	-0.0468	-0.64	-0.8788	-0.9997	1922159	CBDivE_014837	COc1cc(/C=N/c2ccc(cc2)S(=O)(=O)N)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F18	compound treatment	1.286	0.0241	0.33	1.229	0.0252	0.34	0.4736	0.9996	1922160	CBDivE_014838	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)NC(=O)N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F19	compound treatment	1.248	-0.0139	-0.19	1.18	-0.0238	-0.32	-0.3613	-0.9659	1922161	CBDivE_014839	Cc1[nH]c2ccccc2c1/C=N/c3ccc(cc3)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	F20	compound treatment	1.265	0.00313	0.04	1.242	0.0382	0.52	0.3987	0.7619	1922162	CBDivE_014840	CN(C)/C=C/C=C1C(=O)CCCC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G01	compound treatment	1.221	-0.0409	-0.55	1.166	-0.0378	-0.51	-0.7539	-0.9994	1383551	CBDivE_014841	CSc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G02	compound treatment	1.258	-0.00387	-0.05	1.195	-0.00876	-0.12	-0.1213	-0.931	1922163	CBDivE_014842	Cc1ccc(Oc2ccc(NC(=O)c3ccc(cc3C(=O)O)[N+](=O)[O-])cc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G03	compound treatment	1.251	-0.0109	-0.15	1.167	-0.0368	-0.5	-0.4581	-0.8772	1564230	CBDivE_014843	Clc1ccc(CN2CCN(CC2)c3ccccn3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G04	compound treatment	1.237	-0.0249	-0.34	1.196	-0.00776	-0.11	-0.312	-0.887	1922164	CBDivE_014844	Cc1ccsc1/C=N/N=C/c2sccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G05	compound treatment	1.221	-0.0409	-0.55	1.156	-0.0478	-0.65	-0.8503	-0.9966	1649267	CBDivE_014845	Fc1ccc(cc1)N2CCN(Cc3ccccc3Br)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G06	compound treatment	1.264	0.00213	0.03	1.237	0.0332	0.45	0.3409	0.7505	1922165	CBDivE_014846	CC1(CC(=O)O1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G07	compound treatment	1.284	0.0221	0.3	1.229	0.0252	0.34	0.4546	0.9975	1696762	CBDivE_014847	COc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G08	compound treatment	1.262	1.34E-4	0.0	1.219	0.0152	0.21	0.1483	0.7132	1922166	CBDivE_014848	Cc1ncc(C[n+]2ccccc2)c(N)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G09	compound treatment	1.259	-0.00287	-0.04	1.159	-0.0448	-0.61	-0.4589	-0.7504	1511071	CBDivE_014849	C(N1CCN(CC1)c2ccccn2)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G10	compound treatment	1.267	0.00513	0.07	1.23	0.0262	0.36	0.302	0.8286	1922167	CBDivE_014850	CCOC(=O)C[n+]1csc(CCO)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G11	compound treatment	1.273	0.0111	0.15	1.198	-0.00576	-0.08	0.0507	0.2993	1432286	CBDivE_014851	Fc1ccc(cc1)N2CCN(Cc3ccc(cc3)c4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G12	compound treatment	1.291	0.0291	0.39	1.273	0.0692	0.94	0.9456	0.9245	1922168	CBDivE_014852	Cc1c(CCOC(=O)CC2(CC3CC4CC(C3)C2)C4)sc[n+]1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G13	compound treatment	1.223	-0.0389	-0.52	1.154	-0.0498	-0.68	-0.8505	-0.9919	1695599	CBDivE_014853	Fc1ccc(cc1)N2CCN(Cc3ccc(Cl)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G14	compound treatment	1.345	0.0831	1.12	1.32	0.116	1.59	1.9139	0.9856	1334406	CBDivE_014854	CC1C2CC3(C)CC1(C)CC(C2)(C3)C4(C)CC(=O)O4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G15	compound treatment	1.28	0.0181	0.24	1.194	-0.00976	-0.13	0.0789	0.2834	1443960	CBDivE_014855	Fc1ccc(cc1)N2CCN(Cc3c[nH]c4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G16	compound treatment	1.262	1.34E-4	0.0	1.224	0.0202	0.28	0.1965	0.7117	1922169	CBDivE_014856	COC(=O)Nc1ccc2C=Cc3ccccc3N(C(=O)CCN4CCOCC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G17	compound treatment	1.273	0.0111	0.15	1.222	0.0182	0.25	0.2821	0.9708	1318693	CBDivE_014857	Fc1ccc(CN2CCN(CC2)c3ccccn3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G18	compound treatment	1.287	0.0251	0.34	1.265	0.0612	0.84	0.8303	0.9212	1922170	CBDivE_014858	Brc1ccc(/N=C/c2ccc[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G19	compound treatment	1.308	0.0461	0.62	1.252	0.0482	0.66	0.9053	0.9996	1427156	CBDivE_014859	CC(=O)Nc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	G20	compound treatment	1.276	0.0141	0.19	1.253	0.0492	0.67	0.6097	0.8734	1922171	CBDivE_014860	Cc1ccsc1/C=N/c2ccc(cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H01	compound treatment	1.207	-0.0549	-0.74	1.141	-0.0628	-0.86	-1.1285	-0.9974	1922172	CBDivE_014861	CCOc1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H02	compound treatment	1.243	-0.0189	-0.25	1.184	-0.0198	-0.27	-0.3705	-0.9996	1922173	CBDivE_014862	O=C(/C=C/c1ccco1)c2ccc(cc2)C(=O)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H03	compound treatment	1.222	-0.0399	-0.54	1.17	-0.0338	-0.46	-0.7058	-0.997	1922174	CBDivE_014863	Oc1ccccc1/C=N/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H04	compound treatment	1.229	-0.0329	-0.44	1.178	-0.0258	-0.35	-0.5619	-0.9933	1778175	CBDivE_014864	CCOC(=O)c1cc(C(=O)OCC)c(=O)[nH]c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H05	compound treatment	1.275	0.0131	0.18	1.23	0.0262	0.36	0.3784	0.9474	1922175	CBDivE_014865	CC(C)C/C(=N\NC(=O)c1cccc(c1)[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H06	compound treatment	1.209	-0.0529	-0.71	1.155	-0.0488	-0.66	-0.9744	-0.9994	1784735	CBDivE_014866	CCOC(=O)c1cc(C(=O)NN)c(=O)[nH]c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H07	compound treatment	1.275	0.0131	0.18	1.22	0.0162	0.22	0.2819	0.9939	1922176	CBDivE_014867	CN(C(=O)C)c1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H08	compound treatment	1.258	-0.00387	-0.05	1.184	-0.0198	-0.27	-0.2274	-0.8286	1922177	CBDivE_014868	Nc1ccc(/N=C/c2cccc3ccccc23)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H09	compound treatment	1.21	-0.0519	-0.7	1.181	-0.0228	-0.31	-0.7142	-0.9331	1922178	CBDivE_014869	C/C(=N/NC(=O)c1cccc(c1)[N+](=O)[O-])/CCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H10	compound treatment	1.305	0.0431	0.58	1.201	-0.00276	-0.04	0.3849	0.6601	1922179	CBDivE_014870	Nc1ccc(/N=C/c2cc(Cl)cc(Cl)c2O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H11	compound treatment	1.266	0.00413	0.06	1.22	0.0162	0.22	0.1961	0.8584	1922180	CBDivE_014871	Cc1ccc(/N=C/c2ccccc2O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H12	compound treatment	1.242	-0.0199	-0.27	1.225	0.0212	0.29	0.0153	0.0389	1922181	CBDivE_014872	COc1cccc(/C=N/c2ccc(N)c(Cl)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H13	compound treatment	1.297	0.0351	0.47	1.255	0.0512	0.7	0.8293	0.9821	1922182	CBDivE_014873	Cc1ccc(/N=C/c2ccccc2O)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H14	compound treatment	1.267	0.00513	0.07	1.251	0.0472	0.64	0.5045	0.7786	1922183	CBDivE_014874	CCC/C(=N/NC(=O)c1cccc(c1)[N+](=O)[O-])/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H15	compound treatment	1.249	-0.0129	-0.17	1.186	-0.0178	-0.24	-0.2939	-0.9867	1922184	CBDivE_014875	Cc1ccc(/N=C/c2ccccc2O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H16	compound treatment	1.239	-0.0229	-0.31	1.182	-0.0218	-0.3	-0.4279	-0.9998	1922185	CBDivE_014876	O=C(/C=C/c1ccccn1)c2ccc(cc2)C(=O)/C=C/c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H17	compound treatment	1.219	-0.0429	-0.58	1.175	-0.0288	-0.39	-0.6862	-0.9821	1922186	CBDivE_014877	CCN(CC)c1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H18	compound treatment	1.248	-0.0139	-0.19	1.199	-0.00476	-0.06	-0.1781	-0.8997	1412883	CBDivE_014878	Cc1ccc(cc1)C2NCCc3[nH]cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H19	compound treatment	1.24	-0.0219	-0.29	1.189	-0.0148	-0.2	-0.3509	-0.9826	1922187	CBDivE_014879	Oc1ccccc1/C=N/NC(=O)C2CC32CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	H20	compound treatment	1.29	0.0281	0.38	1.252	0.0482	0.66	0.7336	0.9658	1922188	CBDivE_014880	Brc1cc(NS(=O)(=O)c2ccccc2)c(Br)cc1NS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I01	compound treatment	1.237	-0.0249	-0.34	1.187	-0.0168	-0.23	-0.3988	-0.9825	1922189	CBDivE_014881	Fc1ccc(cc1)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I02	compound treatment	1.249	-0.0129	-0.17	1.213	0.00924	0.13	-0.0336	-0.1566	1922190	CBDivE_014882	Cc1ccsc1/C=N/c2ccc(cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I03	compound treatment	1.253	-0.00887	-0.12	1.201	-0.00276	-0.04	-0.1111	-0.8865	1492966	CBDivE_014883	COc1ccc(CN2CCN(CC2)c3ccc(F)cc3)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I04	compound treatment	1.254	-0.00787	-0.11	1.204	2.45E-4	0.0	-0.0727	-0.6845	1922191	CBDivE_014884	NC(=O)c1ccc(/N=C/c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I05	compound treatment	1.339	0.0771	1.04	1.269	0.0652	0.89	1.3649	0.997	1520889	CBDivE_014885	Oc1cccc(CN2CCN(CC2)c3ccc(F)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I06	compound treatment	1.062	-0.2	-2.7	1.185	-0.0188	-0.26	-2.0874	-0.7707	1922192	CBDivE_014886	NC(=O)c1ccc(/N=C/c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I07	compound treatment	1.287	0.0251	0.34	1.181	-0.0228	-0.31	0.0203	0.0443	1922193	CBDivE_014887	Fc1ccc(cc1)N2CCN(Cc3ccccc3C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I08	compound treatment	1.266	0.00413	0.06	1.213	0.00924	0.13	0.1286	0.9327	1922194	CBDivE_014888	NC(=O)c1ccc(/N=C/c2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I09	compound treatment	1.256	-0.00587	-0.08	1.164	-0.0398	-0.54	-0.4393	-0.8018	1173986	CBDivE_014889	Fc1ccc(CN2CCN(CC2)c3ccccn3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I10	compound treatment	1.277	0.0151	0.2	1.238	0.0342	0.47	0.4746	0.9312	1922195	CBDivE_014890	COc1cc(OC)c(/C=N/c2ccc(cc2)C(=O)c3ccccc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I11	compound treatment	1.254	-0.00787	-0.11	1.156	-0.0478	-0.65	-0.5355	-0.8116	1546665	CBDivE_014891	Fc1ccc(cc1)N2CCN(Cc3ccc4OCOc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I12	compound treatment	1.281	0.0191	0.26	1.218	0.0142	0.19	0.3199	0.9902	1922196	CBDivE_014892	NC(=O)c1ccc(/N=C/c2cc(Br)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I13	compound treatment	1.301	0.0391	0.53	1.22	0.0162	0.22	0.53	0.9256	1672769	CBDivE_014893	Fc1cccc(CN2CCN(CC2)c3ccccn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I14	compound treatment	1.279	0.0171	0.23	1.213	0.00924	0.13	0.2526	0.9593	1922197	CBDivE_014894	NC(=O)c1ccc(/N=C/c2cccc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I15	compound treatment	1.238	-0.0239	-0.32	1.205	0.00124	0.02	-0.2157	-0.6689	1274015	CBDivE_014895	Fc1ccc(cc1)N2CCN(Cc3cccc(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I16	compound treatment	1.273	0.0111	0.15	1.262	0.0582	0.79	0.6678	0.8262	1604901	CBDivE_014896	O=C(NCCc1c[nH]c2ccccc12)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I17	compound treatment	1.288	0.0261	0.35	1.178	-0.0258	-0.35	0.001	0.0019	1922198	CBDivE_014897	FC(F)(F)c1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I18	compound treatment	1.199	-0.0629	-0.85	1.203	-7.55E-4	-0.01	-0.607	-0.7156	1144069	CBDivE_014898	Oc1ccc(cc1)S(=O)(=O)c2ccc(O)c(c2)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I19	compound treatment	1.279	0.0171	0.23	1.191	-0.0128	-0.17	0.0405	0.1398	1922199	CBDivE_014899	[O-][N+](=O)c1cccc(CN2CCN(CC2)c3ccc(F)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	I20	compound treatment	1.266	0.00413	0.06	1.214	0.0102	0.14	0.1382	0.9189	1922200	CBDivE_014900	Ic1ccc(cc1)c2nc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J01	compound treatment	1.224	-0.0379	-0.51	1.17	-0.0338	-0.46	-0.6867	-0.9986	1922201	CBDivE_014901	C/C(=N/NC(=O)c1cccc(c1)[N+](=O)[O-])/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J02	compound treatment	1.242	-0.0199	-0.27	1.198	-0.00576	-0.08	-0.245	-0.8773	1679086	CBDivE_014902	Cc1ccc(cc1)S(=O)(=O)N(C(=O)c2ccccc2)c3ccccc3OC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J03	compound treatment	1.251	-0.0109	-0.15	1.198	-0.00576	-0.08	-0.1591	-0.9571	1922202	CBDivE_014903	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J04	compound treatment	1.234	-0.0279	-0.38	1.188	-0.0158	-0.21	-0.4177	-0.9648	1512567	CBDivE_014904	Oc1c(Cl)cc(NS(=O)(=O)c2ccccc2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J05	compound treatment	1.246	-0.0159	-0.21	1.189	-0.0148	-0.2	-0.2936	-0.9995	1294835	CBDivE_014905	O=c1[nH]c(SCc2cccc3nsnc23)nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J06	compound treatment	1.247	-0.0149	-0.2	1.17	-0.0338	-0.46	-0.4673	-0.9307	1205984	CBDivE_014906	COc1nc(nc(n1)n2ccnc2)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J07	compound treatment	1.247	-0.0149	-0.2	1.186	-0.0178	-0.24	-0.313	-0.9956	1195420	CBDivE_014907	COc1ccc(cc1OC)C(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J08	compound treatment	1.267	0.00513	0.07	1.203	-7.55E-4	-0.01	0.0417	0.5954	1922203	CBDivE_014908	CC1CC(=CC(C)C21COC(OC2)c3cccnc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J09	compound treatment	1.253	-0.00887	-0.12	1.219	0.0152	0.21	0.0624	0.2603	1922204	CBDivE_014909	CCN(CC)c1ccc(/C=N/c2ccc(C)c(I)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J10	compound treatment	1.254	-0.00787	-0.11	1.174	-0.0298	-0.41	-0.3619	-0.863	1922205	CBDivE_014910	CC(O)CC/C=C(\C)/CCC1C(=CCC2C(C)(C)CCCC12C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J11	compound treatment	1.297	0.0351	0.47	1.255	0.0512	0.7	0.8293	0.9821	1922206	CBDivE_014911	COc1ccc(/C=N/c2ccc(C)c(I)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J12	compound treatment	1.251	-0.0109	-0.15	1.169	-0.0348	-0.47	-0.4388	-0.8845	1922207	CBDivE_014912	CCOP(=O)(Nc1cccc(c1)C(F)(F)F)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J13	compound treatment	1.258	-0.00387	-0.05	1.21	0.00624	0.09	0.0233	0.2337	1922208	CBDivE_014913	Cc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J14	compound treatment	1.25	-0.0119	-0.16	1.17	-0.0338	-0.46	-0.4387	-0.9001	1922209	CBDivE_014914	CN1CCC(=NNC(=O)CSCc2cccc(Br)c2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J15	compound treatment	1.281	0.0191	0.26	1.204	2.45E-4	0.0	0.1849	0.7162	1922210	CBDivE_014915	Cc1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J16	compound treatment	1.223	-0.0389	-0.52	1.192	-0.0118	-0.16	-0.4841	-0.8829	1922211	CBDivE_014916	CC(=O)OC(C#CBr)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J17	compound treatment	1.245	-0.0169	-0.23	1.168	-0.0358	-0.49	-0.5057	-0.9398	1922212	CBDivE_014917	Cc1ccc(/N=C/c2ccc(cc2)[N+](=O)[O-])cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J18	compound treatment	1.286	0.0241	0.33	1.224	0.0202	0.28	0.4254	0.9966	1922213	CBDivE_014918	CCOC(=O)C(=O)N/N=C(\C)/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J19	compound treatment	1.22	-0.0419	-0.56	1.176	-0.0278	-0.38	-0.667	-0.981	1922214	CBDivE_014919	CNC(C)C(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	J20	compound treatment	1.241	-0.0209	-0.28	1.181	-0.0228	-0.31	-0.4185	-0.9988	1922215	CBDivE_014920	CCOC(=O)C(=O)N/N=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K01	compound treatment	1.281	0.0191	0.26	1.229	0.0252	0.34	0.4259	0.9899	1922216	CBDivE_014921	CCn1c2ccccc2c3cc(CN4CCN(CC4)c5ccc(F)cc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K02	compound treatment	1.245	-0.0169	-0.23	1.213	0.00924	0.13	-0.0717	-0.2758	1922217	CBDivE_014922	Cc1ccc(Oc2ccc(NC(=O)c3c(cccc3[N+](=O)[O-])C(=O)O)cc2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K03	compound treatment	1.265	0.00313	0.04	1.17	-0.0338	-0.46	-0.2956	-0.6395	1190518	CBDivE_014923	COc1cc(CN2CCN(CC2)c3ccc(F)cc3)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K04	compound treatment	1.256	-0.00587	-0.08	1.197	-0.00676	-0.09	-0.1211	-0.9971	1774962	CBDivE_014924	COc1ccccc1NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K05	compound treatment	1.282	0.0201	0.27	1.189	-0.0148	-0.2	0.0498	0.1473	1713938	CBDivE_014925	Cc1ccsc1CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K06	compound treatment	1.307	0.0451	0.61	1.275	0.0712	0.97	1.1175	0.9747	1181671	CBDivE_014926	COc1cccc(c1)C(=O)Oc2cc(OC(=O)c3cccc(OC)c3)cc(OC(=O)c4cccc(OC)c4)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K07	compound treatment	1.255	-0.00687	-0.09	1.21	0.00624	0.09	-0.0053	-0.042	1620883	CBDivE_014927	Fc1ccc(cc1)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K08	compound treatment	1.256	-0.00587	-0.08	1.204	2.45E-4	0.0	-0.0536	-0.6767	1241730	CBDivE_014928	Cc1ccc(Oc2ccc(cc2)N3C(=O)c4ccc(Oc5ccc(N)cc5)cc4C3=O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K09	compound treatment	1.27	0.00813	0.11	1.174	-0.0298	-0.41	-0.2093	-0.498	1183261	CBDivE_014929	COc1cccc(CN2CCN(CC2)c3ccc(F)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K10	compound treatment	1.281	0.0191	0.26	1.265	0.0612	0.84	0.7731	0.8844	1113101	CBDivE_014930	O=C(Oc1cc(OC(=O)c2ccccc2)cc(OC(=O)c3ccccc3)c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K11	compound treatment	1.286	0.0241	0.33	1.194	-0.00976	-0.13	0.1362	0.3871	1162884	CBDivE_014931	Fc1ccc(cc1)N2CCN(Cc3cccc4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K12	compound treatment	1.276	0.0141	0.19	1.214	0.0102	0.14	0.2336	0.9883	1922218	CBDivE_014932	CNc1nc(NC2CC2)nc(Nc3ccccc3SC(F)(F)C(F)(F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K13	compound treatment	1.273	0.0111	0.15	1.175	-0.0288	-0.39	-0.1711	-0.4074	1403852	CBDivE_014933	COc1ccc(CN2CCN(CC2)c3ccccn3)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K14	compound treatment	1.323	0.0611	0.82	1.301	0.0972	1.33	1.5209	0.9739	1593394	CBDivE_014934	CC(NC(CO)C#C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K15	compound treatment	1.255	-0.00687	-0.09	1.182	-0.0218	-0.3	-0.2753	-0.8857	1571872	CBDivE_014935	C(N1CCN(CC1)c2ccccn2)c3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K16	compound treatment	1.283	0.0211	0.29	1.244	0.0402	0.55	0.5897	0.9535	1569539	CBDivE_014936	CCOc1ccc(cc1)C(=O)Nc2ccccc2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K17	compound treatment	1.335	0.0731	0.99	1.239	0.0352	0.48	1.0375	0.9454	1615768	CBDivE_014937	Fc1ccc(cc1)N2CCN(Cc3ccc(Cl)cc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K18	compound treatment	1.291	0.0291	0.39	1.232	0.0282	0.39	0.5503	0.9999	1922219	CBDivE_014938	Cc1ccc(/N=C/c2ccc[nH]2)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K19	compound treatment	1.266	0.00413	0.06	1.188	-0.0158	-0.21	-0.1125	-0.5067	1635318	CBDivE_014939	Nc1ccccc1c2ccccc2N(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	K20	compound treatment	1.288	0.0261	0.35	1.224	0.0202	0.28	0.4445	0.9927	1922220	CBDivE_014940	Cc1ccc(/N=C/c2ccc(O)cc2O)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L01	compound treatment	1.254	-0.00787	-0.11	1.208	0.00424	0.06	-0.0341	-0.2822	1554627	CBDivE_014941	OC(=O)CCNC(=O)NC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L02	compound treatment	1.244	-0.0179	-0.24	1.159	-0.0448	-0.61	-0.602	-0.9174	1922221	CBDivE_014942	Cc1ccc(cc1)/C(=N\N)/C=C/2\Nc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L03	compound treatment	1.246	-0.0159	-0.21	1.183	-0.0208	-0.28	-0.3515	-0.9905	1922222	CBDivE_014943	CCN/1C(=O)CS\C1=N/c2nccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L04	compound treatment	1.244	-0.0179	-0.24	1.161	-0.0428	-0.58	-0.5827	-0.9236	1922223	CBDivE_014944	CC1SC(NC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L05	compound treatment	1.24	-0.0219	-0.29	1.165	-0.0388	-0.53	-0.5823	-0.9621	1922224	CBDivE_014945	O=C(CN1CCCC1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L06	compound treatment	1.293	0.0311	0.42	1.218	0.0142	0.19	0.4344	0.9386	1922225	CBDivE_014946	COC(=O)/C=C\1/OC(=CC1=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L07	compound treatment	1.226	-0.0359	-0.48	1.171	-0.0328	-0.45	-0.658	-0.9992	1738801	CBDivE_014947	CN(C)CCOC(=O)C1(CC2(C)CC3(C)CC(C)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L08	compound treatment	1.22	-0.0419	-0.56	1.133	-0.0708	-0.96	-1.0816	-0.9675	1922226	CBDivE_014948	CC(C)(C)/C(=N\N)/C=C/1\Nc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L09	compound treatment	1.284	0.0221	0.3	1.225	0.0212	0.29	0.416	0.9999	1922227	CBDivE_014949	CC(N(C)C)C(=O)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L10	compound treatment	1.227	-0.0349	-0.47	1.161	-0.0428	-0.58	-0.7449	-0.9943	1922228	CBDivE_014950	Clc1ccc(cc1)C(=O)/C=C\2/NCCOC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L11	compound treatment	1.236	-0.0259	-0.35	1.147	-0.0568	-0.77	-0.794	-0.9353	1922229	CBDivE_014951	CC(N1CCCC1)C(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L12	compound treatment	1.269	0.00713	0.1	1.232	0.0282	0.39	0.3404	0.8574	1718929	CBDivE_014952	O=c1ccc2nc3ccccc3c(=O)n2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L13	compound treatment	1.293	0.0311	0.42	1.236	0.0322	0.44	0.6079	0.9997	1922230	CBDivE_014953	Oc1ccccc1/C=N/c2ccc(Br)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L14	compound treatment	1.264	0.00213	0.03	1.217	0.0132	0.18	0.1481	0.8096	1922231	CBDivE_014954	NC(=S)NNC(=O)c1ccccc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L15	compound treatment	1.223	-0.0389	-0.52	1.193	-0.0108	-0.15	-0.4745	-0.8715	1922232	CBDivE_014955	Cc1ccc(/N=C/c2ccccc2O)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L16	compound treatment	1.258	-0.00387	-0.05	1.195	-0.00876	-0.12	-0.1213	-0.931	1922233	CBDivE_014956	OC(=O)c1ccccc1C(=O)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L17	compound treatment	1.303	0.0411	0.55	1.236	0.0322	0.44	0.7033	0.9934	1922234	CBDivE_014957	[O-][N+](=O)c1cc(/N=C/c2cccc3ccccc23)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L18	compound treatment	1.241	-0.0209	-0.28	1.163	-0.0408	-0.56	-0.592	-0.9503	1454445	CBDivE_014958	CCC(CO)NC(=O)Nc1ccc2ccccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L19	compound treatment	1.207	-0.0549	-0.74	1.149	-0.0548	-0.75	-1.0514	-1.0	1922235	CBDivE_014959	NCCCNC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	L20	compound treatment	1.273	0.0111	0.15	1.205	0.00124	0.02	0.1182	0.782	1275479	CBDivE_014960	O=S(=O)(C1CCS(=O)(=O)C1)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M01	compound treatment	1.285	0.0231	0.31	1.22	0.0162	0.22	0.3773	0.9859	1922236	CBDivE_014961	CCC/C(=N/NC(=O)c1ccc(O)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M02	compound treatment	1.21	-0.0519	-0.7	1.165	-0.0388	-0.53	-0.8685	-0.9904	1922237	CBDivE_014962	Oc1ccc(/C=N/c2ccc(Cl)c(c2)[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M03	compound treatment	1.283	0.0211	0.29	1.198	-0.00576	-0.08	0.1461	0.4941	1034149	CBDivE_014963	Nc1cc2nc3ccccc3nc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M04	compound treatment	1.269	0.00713	0.1	1.217	0.0132	0.18	0.1958	0.9566	1922238	CBDivE_014964	Cc1ccc(/N=C/c2cc(Br)ccc2O)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M05	compound treatment	1.273	0.0111	0.15	1.189	-0.0148	-0.2	-0.0361	-0.1436	1591733	CBDivE_014965	Cc1nn(C2OC(COC(=O)c3ccccc3)C(OC(=O)c4ccccc4)C2OC(=O)c5ccccc5)c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M06	compound treatment	1.221	-0.0409	-0.55	1.176	-0.0278	-0.38	-0.6575	-0.9832	1922239	CBDivE_014966	Oc1ccc(Br)cc1/C=N/c2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M07	compound treatment	1.239	-0.0229	-0.31	1.167	-0.0368	-0.5	-0.5725	-0.9728	1922240	CBDivE_014967	O=S(=O)(C1=CCCS1(=O)=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M08	compound treatment	1.242	-0.0199	-0.27	1.185	-0.0188	-0.26	-0.3704	-0.9997	1922241	CBDivE_014968	[O-][N+](=O)c1cc(/N=C/c2cccc(Cl)c2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M09	compound treatment	1.28	0.0181	0.24	1.178	-0.0258	-0.35	-0.0754	-0.1761	1914773	CBDivE_014969	OS(=O)(=O)C1CS(=O)(=O)CC1S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M10	compound treatment	1.28	0.0181	0.24	1.226	0.0222	0.3	0.3875	0.9943	1922242	CBDivE_014970	CCCC(=O)NC(NC1CCS(=O)(=O)C1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M11	compound treatment	1.251	-0.0109	-0.15	1.194	-0.00976	-0.13	-0.1977	-0.9988	1922243	CBDivE_014971	O=S1(=O)CCC(C1)SCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M12	compound treatment	1.26	-0.00187	-0.03	1.215	0.0112	0.15	0.0906	0.5832	1922244	CBDivE_014972	CCCC(=O)NC(N1CCCCC1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M13	compound treatment	1.263	0.00113	0.02	1.195	-0.00876	-0.12	-0.0736	-0.6115	1922245	CBDivE_014973	Nc1ccccc1SC(CC(=O)c2ccc(Br)cc2)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M14	compound treatment	1.321	0.0591	0.8	1.288	0.0842	1.15	1.3764	0.9841	1922246	CBDivE_014974	Cc1cccc(NC(=O)CN2C(=O)/C(=N\NC(=O)N)/c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M15	compound treatment	1.258	-0.00387	-0.05	1.194	-0.00976	-0.13	-0.1309	-0.9164	1026096	CBDivE_014975	OC(=O)CCNc1ncnc2[nH]cnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M16	compound treatment	1.251	-0.0109	-0.15	1.203	-7.55E-4	-0.01	-0.1109	-0.7549	1922247	CBDivE_014976	CCCC(=O)NC(NC(C)(C)C)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M17	compound treatment	1.269	0.00713	0.1	1.208	0.00424	0.06	0.109	0.9704	1922248	CBDivE_014977	OC(=O)CCCNc1ncnc2[nH]cnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M18	compound treatment	1.268	0.00613	0.08	1.207	0.00324	0.04	0.0898	0.957	1922249	CBDivE_014978	Cc1cccc(NC(=O)CN2C(=O)/C(=N\NC(=N)N)/c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M19	compound treatment	1.246	-0.0159	-0.21	1.188	-0.0158	-0.21	-0.3033	-1.0	1922250	CBDivE_014979	FC(F)(F)C(Oc1nc(Nc2ccccc2C(=O)c3ccccc3)nc(OC(C(F)(F)F)C(F)(F)F)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	M20	compound treatment	1.276	0.0141	0.19	1.219	0.0152	0.21	0.2818	0.9991	1922251	CBDivE_014980	CC(C)C(=O)NC(NC(=S)N1CCOCC1)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N01	compound treatment	1.244	-0.0179	-0.24	1.171	-0.0328	-0.45	-0.4863	-0.9581	1922252	CBDivE_014981	NS(=O)(=O)c1ccc(/N=C/c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N02	compound treatment	1.225	-0.0369	-0.5	1.17	-0.0338	-0.46	-0.6772	-0.9993	1922253	CBDivE_014982	Cc1ccc(NC2=CC(N(C2=O)c3ccc(C)cc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N03	compound treatment	1.217	-0.0449	-0.61	1.141	-0.0628	-0.86	-1.0331	-0.9856	1922254	CBDivE_014983	Oc1ccc(/C=N/c2ccc(Br)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N04	compound treatment	1.222	-0.0399	-0.54	1.157	-0.0468	-0.64	-0.8311	-0.9964	1922255	CBDivE_014984	[O-][N+](=O)c1ccc2N/C(=C\C(=O)c3ccc(Cl)cc3)/C(=C\C(=O)c4ccc(Cl)cc4)/Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N05	compound treatment	1.225	-0.0369	-0.5	1.164	-0.0398	-0.54	-0.735	-0.9991	1922256	CBDivE_014985	CN(C)c1ccc(/C=N/c2ccc(Br)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N06	compound treatment	1.215	-0.0469	-0.63	1.132	-0.0718	-0.98	-1.139	-0.9777	1922257	CBDivE_014986	O=C(NN=C1CCCCC1)c2ccc(cc2)C(=O)NN=C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N07	compound treatment	1.234	-0.0279	-0.38	1.189	-0.0148	-0.2	-0.4081	-0.9571	1922258	CBDivE_014987	CCN(CC)c1ccc(/C=N/c2ccc(Br)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N08	compound treatment	1.23	-0.0319	-0.43	1.159	-0.0448	-0.61	-0.7355	-0.9853	1922259	CBDivE_014988	OC(CC(=O)c1ccccc1)(c2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N09	compound treatment	1.254	-0.00787	-0.11	1.202	-0.00176	-0.02	-0.092	-0.8454	1922260	CBDivE_014989	O=C/1N(Cc2ccccc2)C(=S)S\C1=C\C=C\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N10	compound treatment	1.237	-0.0249	-0.34	1.177	-0.0268	-0.36	-0.4952	-0.9991	1922261	CBDivE_014990	CC(C)(C)C(=O)CC(O)(c1ccccc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N11	compound treatment	1.238	-0.0239	-0.32	1.175	-0.0288	-0.39	-0.5049	-0.9952	1922262	CBDivE_014991	S=c1[nH]cnc2sc3CCCCc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N12	compound treatment	1.251	-0.0109	-0.15	1.181	-0.0228	-0.31	-0.3231	-0.9414	1028923	CBDivE_014992	CN(C)CCC(O)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N13	compound treatment	1.282	0.0201	0.27	1.216	0.0122	0.17	0.3101	0.9727	1922263	CBDivE_014993	COc1cc(/C=N/c2ccc(N)c(Cl)c2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N14	compound treatment	1.261	-8.66E-4	-0.01	1.176	-0.0278	-0.38	-0.2759	-0.7286	1922264	CBDivE_014994	CC1(C)COC(O)(CC1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N15	compound treatment	1.237	-0.0249	-0.34	1.159	-0.0448	-0.61	-0.6688	-0.9603	1547967	CBDivE_014995	CN(C)CCOC(=O)C1(CC2CC3C1)CC(C2)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N16	compound treatment	1.253	-0.00887	-0.12	1.18	-0.0238	-0.32	-0.3136	-0.9083	1922265	CBDivE_014996	OC(CC(=O)c1cccs1)(c2ccccc2)C(F)(F)C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N17	compound treatment	1.227	-0.0349	-0.47	1.158	-0.0458	-0.62	-0.7738	-0.9903	1922266	CBDivE_014997	COc1ccc(/C=N/c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N18	compound treatment	1.258	-0.00387	-0.05	1.177	-0.0268	-0.36	-0.2949	-0.8	1922267	CBDivE_014998	C/C=C/C(=O)NNC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N19	compound treatment	1.266	0.00413	0.06	1.227	0.0232	0.32	0.2636	0.8189	1922268	CBDivE_014999	COc1ccc(/C=N/c2ccc(Br)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	N20	compound treatment	1.263	0.00113	0.02	1.181	-0.0228	-0.31	-0.2086	-0.6714	1922269	CBDivE_015000	CCCCCCCC(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O01	compound treatment	1.276	0.0141	0.19	1.197	-0.00676	-0.09	0.0697	0.3291	1922270	CBDivE_015001	CCC(=O)Nc1ccc2nc(C)[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O02	compound treatment	1.309	0.0471	0.64	1.278	0.0742	1.01	1.1655	0.9749	1922271	CBDivE_015002	Cc1cc(C)c(/C=N/N=C/c2c(C)cc(C)cc2C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O03	compound treatment	1.323	0.0611	0.82	1.245	0.0412	0.56	0.9809	0.9826	1922272	CBDivE_015003	Clc1ccc(/C=N/NC(=O)c2ccc(cc2)N3CCCC3=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O04	compound treatment	1.291	0.0291	0.39	1.248	0.0442	0.6	0.7045	0.9784	1922273	CBDivE_015004	Clc1cccc(/C=N/N=C/c2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O05	compound treatment	1.283	0.0211	0.29	1.218	0.0142	0.19	0.339	0.9825	1494688	CBDivE_015005	Cc1ccc(cc1)c2nc3cnc4ccccc4c3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O06	compound treatment	1.269	0.00713	0.1	1.202	-0.00176	-0.02	0.0511	0.5155	1300655	CBDivE_015006	Cc1cccc(NS(=O)(=O)c2cc(ccc2C)C(=O)Nc3ccccc3C(=O)O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O07	compound treatment	1.272	0.0101	0.14	1.142	-0.0618	-0.84	-0.4988	-0.5847	1922274	CBDivE_015007	COc1cccc(/C=N/NC(=O)c2ccc(cc2)N3CCCC3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O08	compound treatment	1.267	0.00513	0.07	1.216	0.0122	0.17	0.167	0.9241	1922275	CBDivE_015008	ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)Sc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O09	compound treatment	1.319	0.0571	0.77	1.281	0.0772	1.05	1.2898	0.9882	1922276	CBDivE_015009	C/C(=N/NC(=O)c1ccc(O)cc1)/CCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O10	compound treatment	1.301	0.0391	0.53	1.251	0.0472	0.64	0.8289	0.9951	1541495	CBDivE_015010	O=C(Nc1ccc(cc1)c2nc3ccccc3s2)c4ccc(cc4)S(=O)(=O)N5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O11	compound treatment	1.258	-0.00387	-0.05	1.182	-0.0218	-0.3	-0.2467	-0.8189	1922277	CBDivE_015011	CCCC/C(=N/NC(=O)c1ccc(O)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O12	compound treatment	1.349	0.0871	1.18	1.294	0.0902	1.23	1.7014	0.9997	1922278	CBDivE_015012	COc1ccc(/C=N/NC(=S)Nc2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O13	compound treatment	1.331	0.0691	0.93	1.245	0.0412	0.56	1.0572	0.9707	1922279	CBDivE_015013	O=C(CN1C(=O)S/C(=C\c2ccccc2)/C1=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O14	compound treatment	1.291	0.0291	0.39	1.246	0.0422	0.58	0.6853	0.9826	1922280	CBDivE_015014	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccc[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O15	compound treatment	1.264	0.00213	0.03	1.217	0.0132	0.18	0.1481	0.8096	1922281	CBDivE_015015	[O-][N+](=O)c1ccccc1NC(=O)CCN2C(=O)/C(=C/3\SC(=S)N(CCC(=O)Nc4ccccc4[N+](=O)[O-])C3=O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O16	compound treatment	1.294	0.0321	0.43	1.245	0.0412	0.56	0.7042	0.9917	1536941	CBDivE_015016	OCCNc1nc(nc(n1)N2CCOCC2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O17	compound treatment	1.292	0.0301	0.41	1.212	0.00824	0.11	0.367	0.87	1922282	CBDivE_015017	O=C(CCN1C(=O)/C(=C/c2ccccc2)/SC1=S)Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O18	compound treatment	1.252	-0.00987	-0.13	1.22	0.0162	0.22	0.0625	0.2419	1922283	CBDivE_015018	C/C(=N/NC(=S)Nc1cccc(C)c1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O19	compound treatment	1.273	0.0111	0.15	1.207	0.00324	0.04	0.1375	0.8781	1922284	CBDivE_015019	FC(F)(F)C1(NC(=O)N2CCCCC=C2S1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	O20	compound treatment	1.352	0.0901	1.22	1.314	0.11	1.5	1.9228	0.9945	1922285	CBDivE_015020	CCc1c(C)nc2sc(C(=O)OC)c(N)c2c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P01	compound treatment	1.287	0.0251	0.34	1.219	0.0152	0.21	0.3868	0.9724	1596819	CBDivE_015021	CCn1c(=O)c(C(=O)NCCN2CCCCC2)c(O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P02	compound treatment	1.256	-0.00587	-0.08	1.174	-0.0298	-0.41	-0.3429	-0.8294	1922286	CBDivE_015022	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P03	compound treatment	1.294	0.0321	0.43	1.208	0.00424	0.06	0.3475	0.7945	1922287	CBDivE_015023	COc1cc(OC)c(/C=N/c2ccc(cc2)S(=O)(=O)N)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P04	compound treatment	1.205	-0.0569	-0.77	1.121	-0.0828	-1.13	-1.3404	-0.9823	1922288	CBDivE_015024	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P05	compound treatment	1.282	0.0201	0.27	1.241	0.0372	0.51	0.5512	0.957	1922289	CBDivE_015025	Oc1ccc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P06	compound treatment	1.257	-0.00487	-0.07	1.179	-0.0248	-0.34	-0.2851	-0.8291	1922290	CBDivE_015026	C/C(=N/NC(=O)c1ccccc1)/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P07	compound treatment	1.233	-0.0289	-0.39	1.174	-0.0298	-0.41	-0.5623	-0.9998	1922291	CBDivE_015027	CCCCOC(=O)N/N=C/c1cc(C)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P08	compound treatment	1.202	-0.0599	-0.81	1.092	-0.112	-1.52	-1.6487	-0.9559	1922292	CBDivE_015028	CC(C)c1ccc(/C=C/C(=O)NNC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P09	compound treatment	1.232	-0.0299	-0.4	1.127	-0.0768	-1.05	-1.025	-0.9139	1922293	CBDivE_015029	CCCCC/N=C(/C)\c1c(O)c2cc(ccc2oc1=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P10	compound treatment	1.081	-0.181	-2.44	0.828	-0.376	-5.12	-5.3485	-0.9424	1922294	CBDivE_015030	Fc1ccc(/C=N/NC(=O)c2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P11	compound treatment	1.211	-0.0509	-0.69	1.128	-0.0758	-1.03	-1.2157	-0.9803	1922295	CBDivE_015031	Cc1nc(C)nc(N/N=C/c2cccc(I)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P12	compound treatment	1.256	-0.00587	-0.08	1.187	-0.0168	-0.23	-0.2175	-0.8996	1922296	CBDivE_015032	COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P13	compound treatment	1.192	-0.0699	-0.94	1.122	-0.0818	-1.11	-1.4548	-0.9965	1922297	CBDivE_015033	CCCCOC(=O)N/N=C/c1ccc2OCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P14	compound treatment	1.268	0.00613	0.08	1.184	-0.0198	-0.27	-0.132	-0.4683	1922298	CBDivE_015034	COc1ccc(cc1)C(=O)NNC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P15	compound treatment	1.209	-0.0529	-0.71	1.132	-0.0718	-0.98	-1.1962	-0.9879	1710165	CBDivE_015035	O=C(Nc1nc(cs1)C2(CC3CC4CC(C3)C2)C4)C(c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P16	compound treatment	1.253	-0.00887	-0.12	1.16	-0.0438	-0.6	-0.5065	-0.8323	1922299	CBDivE_015036	Oc1ccc(/C=N/NC(=O)c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P17	compound treatment	1.261	-8.66E-4	-0.01	1.204	2.45E-4	0.0	-0.0059	-0.4858	1922300	CBDivE_015037	Cc1cccc(c1)C(=O)NNC(=O)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P18	compound treatment	1.27	0.00813	0.11	1.202	-0.00176	-0.02	0.0607	0.5402	1473747	CBDivE_015038	CC(=C1C(=O)CC(C)(C)CC1=O)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P19	compound treatment	1.275	0.0131	0.18	1.193	-0.0108	-0.15	0.0216	0.0938	1922301	CBDivE_015039	NC(=O)c1ccc(/N=C/c2ccccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.47	P20	compound treatment	1.317	0.0551	0.74	1.26	0.0562	0.77	1.0683	0.9999	1922302	CBDivE_015040	COc1cccc(c1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A01	compound treatment	1.265	0.00226	0.03	1.214	0.00984	0.13	0.1165	0.8462	1922303	CBDivE_015041	Cc1cc(C)c(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c(C)c1CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A02	compound treatment	1.276	0.0133	0.18	1.237	0.0328	0.45	0.4432	0.9189	1694755	CBDivE_015042	Clc1ccc(cc1)N2CCN(Cc3ccccc3Br)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A03	compound treatment	1.31	0.0473	0.64	1.267	0.0628	0.86	1.0568	0.9894	1251542	CBDivE_015043	NC(=O)C1(CC1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A04	compound treatment	1.257	-0.00574	-0.08	1.231	0.0268	0.37	0.2041	0.5455	1227071	CBDivE_015044	Clc1ccc(cc1)N2CCN(Cc3ccc(cc3)c4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A05	compound treatment	1.265	0.00226	0.03	1.2	-0.00416	-0.06	-0.0185	-0.2877	1922304	CBDivE_015045	[O-][N+](=O)c1cccc(c1)N2Cc3ccccc3C4(CCOCC4)C2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A06	compound treatment	1.305	0.0423	0.57	1.26	0.0558	0.76	0.9416	0.9898	1020666	CBDivE_015046	OCCN1CCN(CCO)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A07	compound treatment	1.285	0.0223	0.3	1.224	0.0198	0.27	0.4037	0.9986	1922305	CBDivE_015047	CC/1=NN(C(=O)\C1=N\Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A08	compound treatment	1.28	0.0173	0.23	1.229	0.0248	0.34	0.4042	0.9833	1922306	CBDivE_015048	CC(=O)NN=C1CCC(=NNC(=O)C)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A09	compound treatment	1.235	-0.0277	-0.37	1.201	-0.00316	-0.04	-0.2951	-0.7833	1922307	CBDivE_015049	C/C(=N\N=C\1/NC(=O)C(Cc2cccc(C)c2)S1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A10	compound treatment	1.246	-0.0167	-0.23	1.197	-0.00716	-0.1	-0.2287	-0.9296	1336138	CBDivE_015050	CC(O)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A11	compound treatment	1.273	0.0103	0.14	1.23	0.0258	0.35	0.3471	0.9167	1019857	CBDivE_015051	O=C1N(C(C=C1Nc2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A12	compound treatment	1.311	0.0483	0.65	1.216	0.0118	0.16	0.5746	0.8565	1922308	CBDivE_015052	CC/C(=N\O)/C(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A13	compound treatment	1.306	0.0433	0.58	1.279	0.0748	1.02	1.1343	0.9648	1922309	CBDivE_015053	NS(=O)(=O)c1cccc(Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(Br)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A14	compound treatment	1.304	0.0413	0.56	1.254	0.0498	0.68	0.8742	0.9951	1213697	CBDivE_015054	C(N1CCN(CC1)c2ccccn2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A15	compound treatment	1.248	-0.0147	-0.2	1.165	-0.0392	-0.53	-0.5182	-0.9094	1219687	CBDivE_015055	O=C(Nc1ccc2CCc3ccccc3Nc2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A16	compound treatment	1.277	0.0143	0.19	1.255	0.0508	0.69	0.6263	0.8704	1922310	CBDivE_015056	[O-][N+](=O)c1ccc(cc1)c2nc3ccc(cc3c(=O)o2)c4ccc5nc(oc(=O)c5c4)c6ccc(cc6)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A17	compound treatment	1.25	-0.0127	-0.17	1.187	-0.0172	-0.23	-0.287	-0.9885	1922311	CBDivE_015057	Cc1cc2c(ccc3nonc23)n1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A18	compound treatment	1.32	0.0573	0.77	1.304	0.0998	1.36	1.509	0.964	1021435	CBDivE_015058	Nc1ccc(NS(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A19	compound treatment	1.243	-0.0197	-0.27	1.165	-0.0392	-0.53	-0.5659	-0.9484	1922312	CBDivE_015059	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)N4C(=O)c5ccccc5C4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	A20	compound treatment	1.29	0.0273	0.37	1.261	0.0568	0.78	0.8081	0.9419	1313587	CBDivE_015060	CC(=O)Nc1ccc(Oc2ccc3C(=O)N(C(=O)c3c2)c4cc(NC(=O)C)ccc4C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B01	compound treatment	1.27	0.00726	0.1	1.207	0.00284	0.04	0.0967	0.9177	1922313	CBDivE_015061	c1cnn(c1)c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B02	compound treatment	1.275	0.0123	0.17	1.219	0.0148	0.2	0.2601	0.995	1922314	CBDivE_015062	CN1C2CC(N(C)C1=O)N(C)C(=O)N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B03	compound treatment	1.241	-0.0217	-0.29	1.182	-0.0222	-0.3	-0.421	-0.9999	1733365	CBDivE_015063	NS(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B04	compound treatment	1.3	0.0373	0.5	1.243	0.0388	0.53	0.73	0.9997	1922315	CBDivE_015064	CN1C(NC(=O)N2CCOCC2)C(NC(=O)N3CCOCC3)N(C)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B05	compound treatment	1.3	0.0373	0.5	1.252	0.0478	0.65	0.8168	0.9917	1922316	CBDivE_015065	[O-][N+](=O)c1ccc(/N=C/c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B06	compound treatment	1.275	0.0123	0.17	1.239	0.0348	0.48	0.4529	0.9003	1176552	CBDivE_015066	CC1NC(=O)N(C)C2NC(=O)N(C)C(C12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B07	compound treatment	1.265	0.00226	0.03	1.234	0.0298	0.41	0.3093	0.758	1922317	CBDivE_015067	CC(=O)Nc1ccccc1C(=O)C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B08	compound treatment	1.268	0.00526	0.07	1.242	0.0378	0.52	0.4151	0.7968	1575175	CBDivE_015068	CN1C2=C(C(NC1=O)c3ccccc3)C(=O)N(C2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B09	compound treatment	1.278	0.0153	0.21	1.223	0.0188	0.26	0.3273	0.994	1922318	CBDivE_015069	CC(=O)OCc1c(C)cc(C)c(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B10	compound treatment	1.302	0.0393	0.53	1.309	0.105	1.43	1.3855	0.9087	1922319	CBDivE_015070	CN1C(=O)N(C)C2(C)CC1(C)N(C)C(=O)N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B11	compound treatment	1.262	-7.4E-4	-0.01	1.213	0.00884	0.12	0.0782	0.6464	1213342	CBDivE_015071	Cc1oc2cc(OCC(=O)O)ccc2c(=O)c1c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B12	compound treatment	1.257	-0.00574	-0.08	1.193	-0.0112	-0.15	-0.1623	-0.9509	1298752	CBDivE_015072	CC1C2C(N(C)C(=O)N(C)C2N(C)C(=O)N1C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B13	compound treatment	1.243	-0.0197	-0.27	1.177	-0.0272	-0.37	-0.4502	-0.9869	1604126	CBDivE_015073	OC(CC=C)(CC=C)c1cc(nc(c1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B14	compound treatment	1.323	0.0603	0.81	1.285	0.0808	1.1	1.3544	0.9888	1922320	CBDivE_015074	CCc1cc2c(=O)c(c3nc4ccccc4n3C)c(oc2cc1O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B15	compound treatment	1.252	-0.0107	-0.14	1.216	0.0118	0.16	0.0117	0.0541	1922321	CBDivE_015075	[O-][N+](=O)c1ccc-2c(Cc3cc(C4CC4)c(cc32)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B16	compound treatment	1.264	0.00126	0.02	1.204	-1.57E-4	0.0	0.0105	0.6134	1525237	CBDivE_015076	Oc1ccc(cc1)N2C(=O)CSC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B17	compound treatment	1.289	0.0263	0.35	1.26	0.0558	0.76	0.789	0.9394	1922322	CBDivE_015077	CC(=O)c1ccc(/N=C/c2ccccc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B18	compound treatment	1.283	0.0203	0.27	1.229	0.0248	0.34	0.4328	0.9943	1922323	CBDivE_015078	COC(=O)c1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B19	compound treatment	1.258	-0.00474	-0.06	1.206	0.00184	0.03	-0.0274	-0.3994	1922324	CBDivE_015079	COc1cc(C)c(/C=C/C(=O)C)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	B20	compound treatment	1.297	0.0343	0.46	1.241	0.0368	0.5	0.6821	0.9991	1922325	CBDivE_015080	OC(=O)CN1C(=O)/C(=C/C=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C01	compound treatment	1.229	-0.0337	-0.46	1.176	-0.0282	-0.38	-0.5934	-0.9964	1922326	CBDivE_015081	Oc1ccc(cc1)C(=O)N/N=C/c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C02	compound treatment	1.289	0.0263	0.35	1.242	0.0378	0.52	0.6154	0.9832	1580966	CBDivE_015082	COc1ccccc1N2CCN(Cc3ccc(F)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C03	compound treatment	1.263	2.6E-4	0.0	1.212	0.00784	0.11	0.0781	0.7299	1922327	CBDivE_015083	Cc1cc(C)c(/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c(C)c1CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C04	compound treatment	1.287	0.0243	0.33	1.23	0.0258	0.35	0.4806	0.9993	1922328	CBDivE_015084	CCOC(=O)CCS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C05	compound treatment	1.268	0.00526	0.07	1.224	0.0198	0.27	0.2415	0.8634	1922329	CBDivE_015085	CCO/N=C\1/CC(Cc2noc(C)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C06	compound treatment	1.289	0.0263	0.35	1.234	0.0298	0.41	0.5383	0.9976	1922330	CBDivE_015086	COC(=O)CCS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C07	compound treatment	1.261	-0.00174	-0.02	1.214	0.00984	0.13	0.0783	0.5747	1490188	CBDivE_015087	Cc1ccc(cc1)c2cc(=O)c(=O)[nH][nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C08	compound treatment	1.281	0.0183	0.25	1.237	0.0328	0.45	0.4909	0.9604	1575356	CBDivE_015088	Clc1ccc(cc1)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C09	compound treatment	1.26	-0.00274	-0.04	1.183	-0.0212	-0.29	-0.2301	-0.7912	1922331	CBDivE_015089	COC(=O)/C(=C/C(=O)\C=C\c1ccccc1)/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C10	compound treatment	1.296	0.0333	0.45	1.241	0.0368	0.5	0.6725	0.9984	1318765	CBDivE_015090	Fc1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C11	compound treatment	1.316	0.0533	0.72	1.218	0.0138	0.19	0.6415	0.8636	1734420	CBDivE_015091	CC(=O)N1c2ccccc2CCc3ccc(NC(=O)c4ccccc4)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C12	compound treatment	1.361	0.0983	1.33	1.237	0.0328	0.45	1.254	0.8962	1270008	CBDivE_015092	COc1ccccc1CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C13	compound treatment	1.267	0.00426	0.06	1.163	-0.0412	-0.56	-0.3562	-0.6314	1922332	CBDivE_015093	Brc1cccc(c1)C(=O)NNC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C14	compound treatment	1.281	0.0183	0.25	1.265	0.0608	0.83	0.7609	0.8791	1301554	CBDivE_015094	Oc1cccc(CN2CCN(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C15	compound treatment	1.343	0.0803	1.08	1.262	0.0578	0.79	1.3234	0.9879	1014311	CBDivE_015095	OC(=O)c1cccc2nc3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C16	compound treatment	1.316	0.0533	0.72	1.251	0.0468	0.64	0.9597	0.9983	1922333	CBDivE_015096	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C17	compound treatment	1.269	0.00626	0.08	1.166	-0.0382	-0.52	-0.3082	-0.5847	1922334	CBDivE_015097	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C18	compound treatment	1.279	0.0163	0.22	1.246	0.0418	0.57	0.5586	0.9138	1022812	CBDivE_015098	Clc1ccc(cc1)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C19	compound treatment	1.269	0.00626	0.08	1.195	-0.00916	-0.12	-0.0286	-0.1896	1922335	CBDivE_015099	COc1cccc(c1)C(=O)N/N=C/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	C20	compound treatment	1.237	-0.0257	-0.35	1.186	-0.0182	-0.25	-0.4206	-0.9863	1624452	CBDivE_015100	COc1ccccc1N2CCN(Cc3ccccc3Br)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D01	compound treatment	1.265	0.00226	0.03	1.202	-0.00216	-0.03	8.0E-4	0.018	1922336	CBDivE_015101	Cc1noc(C)c1Cc2c(C)noc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D02	compound treatment	1.236	-0.0267	-0.36	1.185	-0.0192	-0.26	-0.4398	-0.9874	1470940	CBDivE_015102	CC1CCN(CC(O)COc2ccc3ccccc3c2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D03	compound treatment	1.225	-0.0377	-0.51	1.181	-0.0232	-0.32	-0.5833	-0.9736	1922337	CBDivE_015103	CC(NC(=S)NC(=O)/C=C/c1ccco1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D04	compound treatment	1.262	-7.4E-4	-0.01	1.203	-0.00116	-0.02	-0.0182	-0.9756	1922338	CBDivE_015104	O=C1NC(=O)/C(=C/C=C/c2ccccc2)/S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D05	compound treatment	1.241	-0.0217	-0.29	1.192	-0.0122	-0.17	-0.3246	-0.9635	1922339	CBDivE_015105	Cc1noc(/C=C/c2ccccc2)c1N=Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D06	compound treatment	1.267	0.00426	0.06	1.215	0.0108	0.15	0.1452	0.9152	1922340	CBDivE_015106	CC(C)C(N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D07	compound treatment	1.274	0.0113	0.15	1.211	0.00684	0.09	0.1734	0.9726	1922341	CBDivE_015107	OC(=O)/C(=C\C(=O)c1ccccc1)/NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D08	compound treatment	1.24	-0.0227	-0.31	1.181	-0.0232	-0.32	-0.4402	-0.9999	1922342	CBDivE_015108	CCCCOC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D09	compound treatment	1.256	-0.00674	-0.09	1.246	0.0418	0.57	0.3392	0.587	1922343	CBDivE_015109	c1c(n[nH]c1c2ccccc2)c3cc(n[nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D10	compound treatment	1.23	-0.0327	-0.44	1.195	-0.00916	-0.12	-0.4006	-0.8728	1171169	CBDivE_015110	CCCCn1c2nc(CN(C)C3(CC4CC5CC(C4)C3)C5)cn2c6ccccc16
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D11	compound treatment	1.285	0.0223	0.3	1.188	-0.0162	-0.22	0.0566	0.1518	1922344	CBDivE_015111	Oc1ccc(/C=N/c2ccc3nc[nH]c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D12	compound treatment	1.296	0.0333	0.45	1.243	0.0388	0.53	0.6918	0.9966	1922345	CBDivE_015112	CC(=O)C/1C(=O)c2c(cccc2[N+](=O)[O-])\C1=N/c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D13	compound treatment	1.31	0.0473	0.64	1.266	0.0618	0.84	1.0471	0.9905	1922346	CBDivE_015113	Clc1ccc(cc1)c2cc([nH]n2)c3cc([nH]n3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D14	compound treatment	1.28	0.0173	0.23	1.262	0.0578	0.79	0.7224	0.8784	1606708	CBDivE_015114	Fc1cccc(NC2(C(=O)c3ccccc3C2=O)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D15	compound treatment	1.237	-0.0257	-0.35	1.146	-0.0582	-0.79	-0.8063	-0.9314	1922347	CBDivE_015115	CC(=O)c1ccc(/N=C/c2cccc(CC=C)c2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D16	compound treatment	1.3	0.0373	0.5	1.231	0.0268	0.37	0.6143	0.9879	1922348	CBDivE_015116	C/C(=N\NC(=O)c1ccncc1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D17	compound treatment	1.247	-0.0157	-0.21	1.213	0.00884	0.12	-0.0649	-0.2657	1922349	CBDivE_015117	CN(C)c1ccc(/C=N/c2ccc(cc2)S(=O)(=O)NC3=Nc4[nH]c5ccccc5c4C(N3)c6ccccc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D18	compound treatment	1.271	0.00826	0.11	1.212	0.00784	0.11	0.1544	0.9998	1922350	CBDivE_015118	C/C(=N\NC(=O)c1ccc(cc1)C(=O)N/N=C(\C)/c2ccc(F)cc2)/c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D19	compound treatment	1.278	0.0153	0.21	1.219	0.0148	0.2	0.2887	1.0	1922351	CBDivE_015119	Oc1ccc(cc1)C(=O)N/N=C/c2ccc(s2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	D20	compound treatment	1.269	0.00626	0.08	1.222	0.0178	0.24	0.2318	0.8999	1922352	CBDivE_015120	CC(=O)C/1C(=O)c2c(cccc2[N+](=O)[O-])\C1=N/c3ccc(\N=C\c4cc(Br)cc(Br)c4O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E01	compound treatment	1.226	-0.0367	-0.5	1.164	-0.0402	-0.55	-0.7377	-0.9988	1922353	CBDivE_015121	Clc1cccc(c1)C(=O)NNC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E02	compound treatment	1.284	0.0213	0.29	1.304	0.0998	1.36	1.1655	0.8377	1191530	CBDivE_015122	OC(=O)CSc1ccc(Cc2ccc(SCC(=O)O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E03	compound treatment	1.277	0.0143	0.19	1.199	-0.00516	-0.07	0.0863	0.4214	1376597	CBDivE_015123	COC(=O)C(NC(=O)c1ccc(Cl)cc1Cl)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E04	compound treatment	1.287	0.0243	0.33	1.228	0.0238	0.33	0.4613	1.0	1612183	CBDivE_015124	Cc1ccc(cc1)C(=O)Oc2ccc(OC(=O)c3ccc(C)cc3)c(c2)S(=O)(=O)c4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E05	compound treatment	1.267	0.00426	0.06	1.224	0.0198	0.27	0.232	0.8386	1922354	CBDivE_015125	CCCCCCCC(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E06	compound treatment	1.271	0.00826	0.11	1.241	0.0368	0.5	0.4341	0.8434	1922355	CBDivE_015126	OCCSc1ccc(Cc2ccc(SCCO)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E07	compound treatment	1.263	2.6E-4	0.0	1.208	0.00384	0.05	0.0395	0.7528	1922356	CBDivE_015127	CCCCCCCC(=O)NNC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E08	compound treatment	1.277	0.0143	0.19	1.227	0.0228	0.31	0.3563	0.9732	1131773	CBDivE_015128	CC1C(OC(CC1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E09	compound treatment	1.278	0.0153	0.21	1.263	0.0588	0.8	0.713	0.8606	1922357	CBDivE_015129	Clc1cccc(c1)C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E10	compound treatment	1.288	0.0253	0.34	1.238	0.0338	0.46	0.5673	0.9889	1454014	CBDivE_015130	CC1(C)CC(C)(Oc2cc(O)ccc21)c3ccc(O)cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E11	compound treatment	1.23	-0.0327	-0.44	1.119	-0.0852	-1.16	-1.1334	-0.9123	1922358	CBDivE_015131	Clc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E12	compound treatment	1.293	0.0303	0.41	1.254	0.0498	0.68	0.7693	0.9703	1919548	CBDivE_015132	CNC(=S)NCCCCc1n[nH]c(N)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E13	compound treatment	1.255	-0.00774	-0.1	1.168	-0.0362	-0.49	-0.4225	-0.8383	1922359	CBDivE_015133	CCCCCC(=O)N/N=C(/C)\c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E14	compound treatment	1.275	0.0123	0.17	1.248	0.0438	0.6	0.5397	0.87	1657751	CBDivE_015134	Clc1ccc(cc1)N2CCN(Cc3cccc4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E15	compound treatment	1.302	0.0393	0.53	1.179	-0.0252	-0.34	0.1319	0.2091	1922360	CBDivE_015135	O=C(Oc1ccc2ccccc2c1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E16	compound treatment	1.321	0.0583	0.79	1.214	0.00984	0.13	0.6507	0.8161	1189456	CBDivE_015136	C(N1CCN(CC1)c2ccccc2)c3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E17	compound treatment	1.237	-0.0257	-0.35	1.168	-0.0362	-0.49	-0.5942	-0.9853	1922361	CBDivE_015137	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E18	compound treatment	1.299	0.0363	0.49	1.217	0.0128	0.18	0.4697	0.9041	1682136	CBDivE_015138	Clc1cccc(CN2CCN(CC2)c3ccccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E19	compound treatment	1.24	-0.0227	-0.31	1.186	-0.0182	-0.25	-0.392	-0.9943	1922362	CBDivE_015139	COc1cccc(c1)C(=O)NNC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	E20	compound treatment	1.274	0.0113	0.15	1.256	0.0518	0.71	0.6073	0.8399	1377616	CBDivE_015140	CCOc1cc(CN2CCN(CC2)c3ccccc3OC)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F01	compound treatment	1.222	-0.0407	-0.55	1.157	-0.0472	-0.64	-0.8433	-0.9969	1034941	CBDivE_015141	OCCNc1ncnc2n(cnc12)C3OC(CO)C(O)C3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F02	compound treatment	1.227	-0.0357	-0.48	1.202	-0.00216	-0.03	-0.3617	-0.7488	1922363	CBDivE_015142	[O-][N+](=O)c1ccc(Cl)c(c1)C2=NCC(=O)Nc3ccc(cc23)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F03	compound treatment	1.236	-0.0267	-0.36	1.172	-0.0322	-0.44	-0.5651	-0.9953	1494538	CBDivE_015143	OC1C(COC(=O)c2ccccc2)OC3C1Oc4nc(=O)ccn34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F04	compound treatment	1.198	-0.0647	-0.87	1.167	-0.0372	-0.51	-0.9759	-0.9665	1922364	CBDivE_015144	Clc1ccccc1/C=N/NC(=O)C(=O)N\N=C\c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F05	compound treatment	1.279	0.0163	0.22	1.235	0.0308	0.42	0.4525	0.9539	1774892	CBDivE_015145	CC(=O)OCC1OC(CC1OC(=O)C)n2ccc(=O)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F06	compound treatment	1.241	-0.0217	-0.29	1.192	-0.0122	-0.17	-0.3246	-0.9635	1922365	CBDivE_015146	O=c1oc2ccccc2c3[nH]c(nc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F07	compound treatment	1.253	-0.00974	-0.13	1.198	-0.00616	-0.08	-0.1523	-0.9766	1376305	CBDivE_015147	CN(Cc1cn2c(n1)n(C)c3ccccc32)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F08	compound treatment	1.249	-0.0137	-0.19	1.195	-0.00916	-0.12	-0.2194	-0.9815	1922366	CBDivE_015148	CCN(C(=O)/C=C/c1cccc(c1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F09	compound treatment	1.242	-0.0207	-0.28	1.193	-0.0112	-0.15	-0.3054	-0.959	1922367	CBDivE_015149	CN(Cc1nc2n(Cc3ccccc3)c4ccccc4n2c1C(=O)C)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F10	compound treatment	1.309	0.0463	0.62	1.289	0.0848	1.16	1.2594	0.958	1707966	CBDivE_015150	CCOC(=O)c1c(C)n(C)c2ccc(OC(=O)NC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F11	compound treatment	1.314	0.0513	0.69	1.3	0.0958	1.31	1.4131	0.9557	1127962	CBDivE_015151	CCn1c(=N)n(CC(=O)C2(CC3CC4CC(C3)C2)C4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F12	compound treatment	1.305	0.0423	0.57	1.275	0.0708	0.97	1.0862	0.9684	1922368	CBDivE_015152	Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F13	compound treatment	1.254	-0.00874	-0.12	1.223	0.0188	0.26	0.0983	0.3478	1922369	CBDivE_015153	Brc1cccc(c1)C(=O)NNC(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F14	compound treatment	1.274	0.0113	0.15	1.204	-1.57E-4	0.0	0.1059	0.6971	1922370	CBDivE_015154	CSCCC(N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F15	compound treatment	1.258	-0.00474	-0.06	1.146	-0.0582	-0.79	-0.606	-0.7616	1922371	CBDivE_015155	CC(C)NC(=O)c1ccccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F16	compound treatment	1.313	0.0503	0.68	1.234	0.0298	0.41	0.7672	0.9702	1922372	CBDivE_015156	OC(=O)c1ccc(cc1)N2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F17	compound treatment	1.216	-0.0467	-0.63	1.171	-0.0332	-0.45	-0.7656	-0.9867	1922373	CBDivE_015157	CC(NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F18	compound treatment	1.289	0.0263	0.35	1.251	0.0468	0.64	0.7022	0.9613	1922374	CBDivE_015158	COC(=O)CN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F19	compound treatment	1.241	-0.0217	-0.29	1.18	-0.0242	-0.33	-0.4403	-0.9983	1922375	CBDivE_015159	CCOc1ccc(cc1)N2C(=O)CC(N3CCC(C)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	F20	compound treatment	1.26	-0.00274	-0.04	1.227	0.0228	0.31	0.1941	0.6189	1922376	CBDivE_015160	CCCCCCCNC(=C1C(=O)CC(C)(C)CC1=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G01	compound treatment	1.235	-0.0277	-0.37	1.185	-0.0192	-0.26	-0.4493	-0.9846	1922377	CBDivE_015161	CCCCCCCC(=O)N/N=C/c1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G02	compound treatment	1.235	-0.0277	-0.37	1.258	0.0538	0.73	0.2546	0.3089	1420493	CBDivE_015162	Clc1ccc(cc1)N2CCN(Cc3ccc4ccccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G03	compound treatment	1.254	-0.00874	-0.12	1.146	-0.0582	-0.79	-0.6441	-0.8034	1922378	CBDivE_015163	CC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G04	compound treatment	1.247	-0.0157	-0.21	1.18	-0.0242	-0.33	-0.3831	-0.9774	1434626	CBDivE_015164	CSc1ccc(CN2CCN(CC2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G05	compound treatment	1.235	-0.0277	-0.37	1.142	-0.0622	-0.85	-0.864	-0.9325	1922379	CBDivE_015165	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G06	compound treatment	1.265	0.00226	0.03	1.242	0.0378	0.52	0.3865	0.7476	1922380	CBDivE_015166	COc1ccccc1Nc2nc(Cl)nc(Sc3nc(C)cc(C)n3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G07	compound treatment	1.271	0.00826	0.11	1.214	0.00984	0.13	0.1737	0.9957	1922381	CBDivE_015167	COc1cccc(c1)C(=O)NNC(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G08	compound treatment	1.268	0.00526	0.07	1.241	0.0368	0.5	0.4054	0.7991	1922382	CBDivE_015168	OCC(NC(=O)CC(=O)NC(CO)c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G09	compound treatment	1.247	-0.0157	-0.21	1.194	-0.0102	-0.14	-0.2481	-0.9786	1922383	CBDivE_015169	CC1CCCC(C)N1C(=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G10	compound treatment	1.278	0.0153	0.21	1.221	0.0168	0.23	0.308	0.9985	1018021	CBDivE_015170	COC(=O)C1(C)CC1(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G11	compound treatment	1.264	0.00126	0.02	1.174	-0.0302	-0.41	-0.2788	-0.6773	1922384	CBDivE_015171	COc1ccc(cc1)C(=O)N/N=C/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G12	compound treatment	1.29	0.0273	0.37	1.266	0.0618	0.84	0.8564	0.9308	1922385	CBDivE_015172	COCCCNc1cc2c(Cl)cc(=O)c3c(Cl)cc4c(Cl)cc(=O)c1c4c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G13	compound treatment	1.213	-0.0497	-0.67	1.159	-0.0452	-0.62	-0.9099	-0.9991	1113756	CBDivE_015173	CC(C)NC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G14	compound treatment	1.323	0.0603	0.81	1.285	0.0808	1.1	1.3544	0.9888	1922386	CBDivE_015174	Cc1ccc(cc1)S(=O)(=O)Nc2cc(Br)c(O)c(Br)c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G15	compound treatment	1.281	0.0183	0.25	1.218	0.0138	0.19	0.3077	0.9914	1699265	CBDivE_015175	CCOC(=O)c1c(NC(=O)c2ccc(Cl)cc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G16	compound treatment	1.268	0.00526	0.07	1.244	0.0398	0.54	0.4344	0.7927	1922387	CBDivE_015176	[O-][N+](=O)c1ccc(/C=N/Nc2nc(Nc3ccc(Cl)cc3)nc(n2)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G17	compound treatment	1.306	0.0433	0.58	1.23	0.0258	0.35	0.6619	0.9708	1922388	CBDivE_015177	Brc1ccccc1C(=O)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G18	compound treatment	1.284	0.0213	0.29	1.232	0.0278	0.38	0.4713	0.9904	1922389	CBDivE_015178	Oc1c(/C=N/Nc2ccc(Cl)nn2)cccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G19	compound treatment	1.327	0.0643	0.87	1.181	-0.0232	-0.32	0.3897	0.4224	1922390	CBDivE_015179	COc1cccc(c1)C(=O)NNC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	G20	compound treatment	1.285	0.0223	0.3	1.231	0.0268	0.37	0.4712	0.9952	1146333	CBDivE_015180	CCOC(=O)c1c(C)oc2c1cc(NS(=O)(=O)c3ccc(Cl)cc3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H01	compound treatment	1.218	-0.0447	-0.6	1.157	-0.0472	-0.64	-0.8815	-0.9995	1922391	CBDivE_015181	CN(Cc1nc2n(C)c3ccccc3n2c1C(=O)C)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H02	compound treatment	1.222	-0.0407	-0.55	1.193	-0.0112	-0.15	-0.4962	-0.8701	1922392	CBDivE_015182	CCCCCCCC(=O)NNC(=O)/C=C/c1ccc(cc1)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H03	compound treatment	1.245	-0.0177	-0.24	1.19	-0.0142	-0.19	-0.3057	-0.9943	1922393	CBDivE_015183	CC(C)(C)c1cc(c(O)cc1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H04	compound treatment	1.243	-0.0197	-0.27	1.236	0.0318	0.43	0.1187	0.2331	1922394	CBDivE_015184	Nc1ccccc1C(=O)N/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H05	compound treatment	1.261	-0.00174	-0.02	1.225	0.0208	0.28	0.1844	0.6465	1922395	CBDivE_015185	OC(CC(=O)c1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H06	compound treatment	1.137	-0.126	-1.7	1.059	-0.145	-1.98	-2.5991	-0.997	1922396	CBDivE_015186	[O-][N+](=O)c1cccc(c1)C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H07	compound treatment	1.239	-0.0237	-0.32	1.198	-0.00616	-0.08	-0.2858	-0.8633	1922397	CBDivE_015187	CC(C)(C)C1=CC(=O)C(=C(O)C1=O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H08	compound treatment	1.236	-0.0267	-0.36	1.177	-0.0272	-0.37	-0.5169	-0.9999	1922398	CBDivE_015188	Fc1ccc(/C=N/NC(=O)C(=O)N\N=C\c2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H09	compound treatment	1.246	-0.0167	-0.23	1.162	-0.0422	-0.57	-0.5662	-0.9167	1018233	CBDivE_015189	CCN(CC)S(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H10	compound treatment	1.25	-0.0127	-0.17	1.187	-0.0172	-0.23	-0.287	-0.9885	1922399	CBDivE_015190	O=C(N/N=C/c1ccc2OCOc2c1)C(=O)N/N=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H11	compound treatment	1.242	-0.0207	-0.28	1.195	-0.00916	-0.12	-0.2861	-0.9339	1922400	CBDivE_015191	Cc1nn(C)cc1C#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H12	compound treatment	1.231	-0.0317	-0.43	1.195	-0.00916	-0.12	-0.3911	-0.8768	1922401	CBDivE_015192	[O-][N+](=O)c1ccc(NNC(=O)c2ccccc2Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H13	compound treatment	1.285	0.0223	0.3	1.263	0.0588	0.8	0.7797	0.9101	1922402	CBDivE_015193	COC(=O)c1ccc(C#CC(C)(C)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H14	compound treatment	1.276	0.0133	0.18	1.228	0.0238	0.33	0.3564	0.9604	1922403	CBDivE_015194	O=C(N/N=C/c1cccnc1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H15	compound treatment	1.244	-0.0187	-0.25	1.169	-0.0352	-0.48	-0.5178	-0.9553	1226826	CBDivE_015195	Nc1ccccc1c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H16	compound treatment	1.256	-0.00674	-0.09	1.189	-0.0152	-0.21	-0.2104	-0.932	1922404	CBDivE_015196	COc1cccc(c1)C(=O)N/N=C/c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H17	compound treatment	1.225	-0.0377	-0.51	1.124	-0.0802	-1.09	-1.1329	-0.9395	1656942	CBDivE_015197	O=C1CSC2(CN3CCC2CC3)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H18	compound treatment	1.242	-0.0207	-0.28	1.189	-0.0152	-0.21	-0.344	-0.9889	1922405	CBDivE_015198	COc1ccc(cc1)S(=O)(=O)N/N=C(/C)\c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H19	compound treatment	1.172	-0.0907	-1.22	1.08	-0.124	-1.69	-2.0628	-0.9873	1619000	CBDivE_015199	Clc1ccc(cc1)c2cc(=O)c(=O)[nH][nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	H20	compound treatment	1.283	0.0203	0.27	1.156	-0.0482	-0.66	-0.2711	-0.3811	1922406	CBDivE_015200	COc1cc(/C=N/NC(=O)c2ccccc2N)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I01	compound treatment	1.23	-0.0327	-0.44	1.192	-0.0122	-0.17	-0.4295	-0.9105	1922407	CBDivE_015201	Clc1ccccc1NN=C2C(=O)NC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I02	compound treatment	1.252	-0.0107	-0.14	1.237	0.0328	0.45	0.2142	0.4551	1922408	CBDivE_015202	[O-][N+](=O)c1ccc(CC2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I03	compound treatment	1.242	-0.0207	-0.28	1.205	8.43E-4	0.01	-0.1897	-0.6775	1922409	CBDivE_015203	Brc1ccc(cc1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I04	compound treatment	1.244	-0.0187	-0.25	1.191	-0.0132	-0.18	-0.3056	-0.9859	1922410	CBDivE_015204	CC(=O)OC1CCC2CCCNC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I05	compound treatment	1.312	0.0493	0.66	1.27	0.0658	0.9	1.1048	0.989	1922411	CBDivE_015205	Clc1ccc(OCC(=O)NNC(=O)C2C3CCCCC23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I06	compound treatment	1.241	-0.0217	-0.29	1.177	-0.0272	-0.37	-0.4692	-0.9933	1922412	CBDivE_015206	CCC(=O)OC1(CC(C)(C)N(C)CC1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I07	compound treatment	1.261	-0.00174	-0.02	1.223	0.0188	0.26	0.1651	0.6399	1922413	CBDivE_015207	O=C1NC(=S)NC(=O)C1=NNc2ccccc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I08	compound treatment	1.276	0.0133	0.18	1.223	0.0188	0.26	0.3082	0.9843	1922414	CBDivE_015208	CC/C(=N\NS(=O)(=O)c1ccc(C)cc1)/CC(c2ccccc2)c3c(O)c4ccccc4oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I09	compound treatment	1.26	-0.00274	-0.04	1.23	0.0258	0.35	0.2231	0.6295	1922415	CBDivE_015209	Ic1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I10	compound treatment	1.27	0.00726	0.1	1.189	-0.0152	-0.21	-0.0769	-0.3362	1922416	CBDivE_015210	CC1(C)CCCC(C)(C)N1CCCCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I11	compound treatment	1.244	-0.0187	-0.25	1.15	-0.0542	-0.74	-0.701	-0.898	1922417	CBDivE_015211	CC(C)c1ccc(NS(=O)(=O)c2c(cc(cc2C(C)C)C(C)C)C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I12	compound treatment	1.293	0.0303	0.41	1.231	0.0268	0.37	0.5475	0.9985	1293718	CBDivE_015212	CN1CCN(CC1)c2nccc3n(C)cnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I13	compound treatment	1.313	0.0503	0.68	1.238	0.0338	0.46	0.8058	0.9824	1922418	CBDivE_015213	Nc1ccccc1C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I14	compound treatment	1.284	0.0213	0.29	1.206	0.00184	0.03	0.2206	0.7661	1922419	CBDivE_015214	CCNC(=O)OC(CC)C1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I15	compound treatment	1.252	-0.0107	-0.14	1.163	-0.0412	-0.56	-0.4993	-0.8614	1922420	CBDivE_015215	OC(COc1ccc(F)cc1)CN(CC(O)COc2ccc(F)cc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I16	compound treatment	1.272	0.00926	0.12	1.235	0.0308	0.42	0.3857	0.8792	1922421	CBDivE_015216	COC(=O)C(Br)(Br)C1(CC2CC3CC(Br)(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I17	compound treatment	1.295	0.0323	0.44	1.194	-0.0102	-0.14	0.2098	0.4594	1922422	CBDivE_015217	Cc1ccc2N(CN3CCOCC3)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I18	compound treatment	1.273	0.0103	0.14	1.225	0.0208	0.28	0.2989	0.9453	1922423	CBDivE_015218	CC(/N=C/c1ccc(O)cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I19	compound treatment	1.258	-0.00474	-0.06	1.197	-0.00716	-0.1	-0.1142	-0.979	1127093	CBDivE_015219	OC1CCC2CCCNC2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	I20	compound treatment	1.268	0.00526	0.07	1.192	-0.0122	-0.17	-0.067	-0.3718	1335284	CBDivE_015220	OC(=O)c1ccccc1C(=O)NC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J01	compound treatment	1.26	-0.00274	-0.04	1.21	0.00584	0.08	0.0302	0.3439	1922424	CBDivE_015221	Clc1ccc(cc1)C(=O)/C=C\2/OC(=CC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J02	compound treatment	1.24	-0.0227	-0.31	1.188	-0.0162	-0.22	-0.3727	-0.9868	1922425	CBDivE_015222	Clc1ccccc1C(=O)NNC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J03	compound treatment	1.268	0.00526	0.07	1.212	0.00784	0.11	0.1258	0.9801	1922426	CBDivE_015223	Oc1ccccc1/C=N/c2ccccc2\N=C\c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J04	compound treatment	1.238	-0.0247	-0.33	1.185	-0.0192	-0.26	-0.4207	-0.9927	1922427	CBDivE_015224	COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J05	compound treatment	1.257	-0.00574	-0.08	1.198	-0.00616	-0.08	-0.1141	-0.9992	1285755	CBDivE_015225	OC(=O)c1ccc(Nc2nc(cs2)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J06	compound treatment	1.245	-0.0177	-0.24	1.195	-0.00916	-0.12	-0.2575	-0.954	1424200	CBDivE_015226	CCc1ccc(OCC(O)CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J07	compound treatment	1.258	-0.00474	-0.06	1.193	-0.0112	-0.15	-0.1528	-0.9258	1405459	CBDivE_015227	OC1C(O)C(OC1COC(=O)c2ccccc2)n3ccc(=O)[nH]c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J08	compound treatment	1.269	0.00626	0.08	1.203	-0.00116	-0.02	0.0486	0.5653	1922428	CBDivE_015228	Fc1ccc(/C=N/NC(=O)C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J09	compound treatment	1.254	-0.00874	-0.12	1.219	0.0148	0.2	0.0598	0.2551	1922429	CBDivE_015229	CCCCCCCC(=O)N/N=C/c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J10	compound treatment	1.223	-0.0397	-0.54	1.184	-0.0202	-0.27	-0.5735	-0.9518	1922430	CBDivE_015230	CCCCOC(=O)CN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J11	compound treatment	1.285	0.0223	0.3	1.231	0.0268	0.37	0.4712	0.9952	1922431	CBDivE_015231	COc1ccc(cc1)C(=O)N/N=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J12	compound treatment	1.246	-0.0167	-0.23	1.151	-0.0532	-0.72	-0.6722	-0.8854	1922432	CBDivE_015232	Clc1ccccc1/C=N/NC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J13	compound treatment	1.22	-0.0427	-0.58	1.146	-0.0582	-0.79	-0.9685	-0.9877	1922433	CBDivE_015233	COc1ccc(cc1)C(=O)N/N=C(/C)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J14	compound treatment	1.248	-0.0147	-0.2	1.161	-0.0432	-0.59	-0.5567	-0.8963	1922434	CBDivE_015234	COc1ccc(cc1)C(=O)/C=C/c2c[nH]c3ccc(Br)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J15	compound treatment	1.282	0.0193	0.26	1.212	0.00784	0.11	0.2594	0.923	1282238	CBDivE_015235	CC(C)NC(=O)COc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J16	compound treatment	1.253	-0.00974	-0.13	1.168	-0.0362	-0.49	-0.4415	-0.8653	1032631	CBDivE_015236	Cc1c(Cl)cccc1NS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J17	compound treatment	1.261	-0.00174	-0.02	1.166	-0.0382	-0.52	-0.3845	-0.7383	1922435	CBDivE_015237	O=C(N/N=C/c1ccncc1)[C@H]2C[C@H]2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J18	compound treatment	1.305	0.0423	0.57	1.229	0.0248	0.34	0.6427	0.9691	1051142	CBDivE_015238	CN1CCN(CC1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J19	compound treatment	1.248	-0.0147	-0.2	1.196	-0.00816	-0.11	-0.2193	-0.9623	1922436	CBDivE_015239	CCOC(=O)/C(=N/Nc1ccccc1)/S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	J20	compound treatment	1.253	-0.00974	-0.13	1.176	-0.0282	-0.38	-0.3644	-0.898	1922437	CBDivE_015240	CCOC(=O)/C(=N\Nc1ccccc1OC)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K01	compound treatment	1.261	-0.00174	-0.02	1.162	-0.0422	-0.57	-0.4231	-0.7354	1368663	CBDivE_015241	Cc1cn(C2OC(COC(=O)c3ccccc3)C(O)C2O)c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K02	compound treatment	1.252	-0.0107	-0.14	1.231	0.0268	0.37	0.1564	0.3972	1922438	CBDivE_015242	C(Cc1c[nH]c2ccccc12)N3Cc4ccccc4C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K03	compound treatment	1.255	-0.00774	-0.1	1.179	-0.0252	-0.34	-0.3164	-0.8824	1922439	CBDivE_015243	Oc1ccccc1C(=O)N/N=C/c2ccc(I)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K04	compound treatment	1.237	-0.0257	-0.35	1.207	0.00284	0.04	-0.2181	-0.6243	1776665	CBDivE_015244	Nc1nc(cs1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K05	compound treatment	1.278	0.0153	0.21	1.21	0.00584	0.08	0.2019	0.9147	1623283	CBDivE_015245	Brc1ccccc1NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K06	compound treatment	1.294	0.0313	0.42	1.234	0.0298	0.41	0.586	0.9998	1922440	CBDivE_015246	CCNC(=O)O/N=C(\C)/c1nonc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K07	compound treatment	1.221	-0.0417	-0.56	1.15	-0.0542	-0.74	-0.9204	-0.991	1922441	CBDivE_015247	COc1ccc(/C=N/NC(=O)CCCO)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K08	compound treatment	1.253	-0.00974	-0.13	1.179	-0.0252	-0.34	-0.3355	-0.9132	1155119	CBDivE_015248	Clc1ccc(NC(=O)Nc2nc(cs2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K09	compound treatment	1.242	-0.0207	-0.28	1.183	-0.0212	-0.29	-0.4018	-0.9999	1922442	CBDivE_015249	CC(O)CCC(=O)N/N=C/C(=N/NC(=O)CCC(C)O)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K10	compound treatment	1.269	0.00626	0.08	1.248	0.0438	0.6	0.4825	0.7991	1421770	CBDivE_015250	Cn1c(nc2cnccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K11	compound treatment	1.268	0.00526	0.07	1.187	-0.0172	-0.23	-0.1153	-0.4714	1922443	CBDivE_015251	COc1ccc([C@H]2NCC[C@@]3(O)CCCC[C@H]23)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K12	compound treatment	1.263	2.6E-4	0.0	1.201	-0.00316	-0.04	-0.028	-0.6473	1922444	CBDivE_015252	O=C1O/C(=C\C=C\2/OC(=O)c3ccccc23)/c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K13	compound treatment	1.287	0.0243	0.33	1.202	-0.00216	-0.03	0.2106	0.641	1922445	CBDivE_015253	Clc1ccc(Cl)c(NS(=O)(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K14	compound treatment	1.331	0.0683	0.92	1.303	0.0988	1.35	1.6042	0.9827	1514841	CBDivE_015254	CNc1nnc(c2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K15	compound treatment	1.297	0.0343	0.46	1.198	-0.00616	-0.08	0.2675	0.5693	1922446	CBDivE_015255	CN(/N=C/c1c(O)ccc2ccccc12)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K16	compound treatment	1.288	0.0253	0.34	1.251	0.0468	0.64	0.6926	0.9567	1777076	CBDivE_015256	CC(C(=O)O)c1n[nH]c(=O)c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K17	compound treatment	1.318	0.0553	0.75	1.219	0.0148	0.2	0.6703	0.8677	1922447	CBDivE_015257	Cc1cc(=NS(=O)(=O)c2ccccc2Cl)cc(C)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K18	compound treatment	1.295	0.0323	0.44	1.244	0.0398	0.54	0.6919	0.994	1715440	CBDivE_015258	O=c1[nH]nc(Cc2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K19	compound treatment	1.283	0.0203	0.27	1.183	-0.0212	-0.29	-0.0107	-0.027	1922448	CBDivE_015259	Nc1ccccc1C(=O)N/N=C/c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	K20	compound treatment	1.281	0.0183	0.25	1.204	-1.57E-4	0.0	0.1727	0.7009	1643816	CBDivE_015260	CC1(C)CC2(CCO1)OC(=O)CC2C(=S)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L01	compound treatment	1.261	-0.00174	-0.02	1.204	-1.57E-4	0.0	-0.0181	-0.7683	1922449	CBDivE_015261	Oc1ccccc1/C=N/Nc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L02	compound treatment	1.242	-0.0207	-0.28	1.163	-0.0412	-0.56	-0.5947	-0.9483	1922450	CBDivE_015262	Cc1noc(C)c1N=Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L03	compound treatment	1.245	-0.0177	-0.24	1.201	-0.00316	-0.04	-0.1997	-0.8211	1922451	CBDivE_015263	Clc1ccc(cc1)C(=O)/C=C/2\OC(=CC2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L04	compound treatment	1.228	-0.0347	-0.47	1.156	-0.0482	-0.66	-0.7957	-0.9863	1581542	CBDivE_015264	CC(C)C1CCC(C)CC1OCC(O)CN2CCC(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L05	compound treatment	1.243	-0.0197	-0.27	1.158	-0.0462	-0.63	-0.6334	-0.9267	1922452	CBDivE_015265	O=C(NNC(=O)c1ccccc1)c2cc(n[nH]2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L06	compound treatment	1.277	0.0143	0.19	1.21	0.00584	0.08	0.1924	0.9239	1922453	CBDivE_015266	CCc1nc2ccccc2c(NC(=O)CN3CCCCCC3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L07	compound treatment	1.229	-0.0337	-0.46	1.18	-0.0242	-0.33	-0.5548	-0.9874	1922454	CBDivE_015267	Cc1ccc(/C=N/c2ccc(O)c(c2)C(=O)O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L08	compound treatment	1.233	-0.0297	-0.4	1.134	-0.0702	-0.96	-0.9602	-0.9256	1590867	CBDivE_015268	OC(COc1ccc2ccccc2c1)CN3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L09	compound treatment	1.26	-0.00274	-0.04	1.229	0.0248	0.34	0.2134	0.6262	1922455	CBDivE_015269	O/C(=C\C(=O)c1ccccc1)/C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L10	compound treatment	1.244	-0.0187	-0.25	1.187	-0.0172	-0.23	-0.3442	-0.9993	1416340	CBDivE_015270	Clc1cccc(NC(=O)c2ccc(cc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L11	compound treatment	1.232	-0.0307	-0.41	1.167	-0.0372	-0.51	-0.6515	-0.9951	1025286	CBDivE_015271	COc1cc2ccccc2cc1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L12	compound treatment	1.261	-0.00174	-0.02	1.221	0.0168	0.23	0.1458	0.6316	1922456	CBDivE_015272	Cc1ccccc1N2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L13	compound treatment	1.271	0.00826	0.11	1.24	0.0358	0.49	0.4244	0.8466	1922457	CBDivE_015273	Brc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L14	compound treatment	1.316	0.0533	0.72	1.251	0.0468	0.64	0.9597	0.9983	1922458	CBDivE_015274	OC(=O)c1ccc(cc1)N2C(=O)/C(=C/c3ccccc3C(=O)O)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L15	compound treatment	1.204	-0.0587	-0.79	1.18	-0.0242	-0.33	-0.7933	-0.9244	1044191	CBDivE_015275	CC(=O)CSc1nc2ccccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L16	compound treatment	1.268	0.00526	0.07	1.214	0.00984	0.13	0.1451	0.9556	1922459	CBDivE_015276	Cc1cccc(c1)C(=O)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L17	compound treatment	1.287	0.0243	0.33	1.26	0.0558	0.76	0.7699	0.9289	1922460	CBDivE_015277	COc1cc(/C=C/2\SC(=S)N(C2=O)c3ccc(cc3)C(=O)O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L18	compound treatment	1.259	-0.00374	-0.05	1.172	-0.0322	-0.44	-0.3457	-0.7833	1922461	CBDivE_015278	Clc1cccc(c1)C(=O)NNC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L19	compound treatment	1.231	-0.0317	-0.43	1.163	-0.0412	-0.56	-0.6996	-0.9911	1922462	CBDivE_015279	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	L20	compound treatment	1.279	0.0163	0.22	1.191	-0.0132	-0.18	0.0282	0.0997	1922463	CBDivE_015280	COc1ccc(/N=C/c2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M01	compound treatment	1.286	0.0233	0.31	1.237	0.0328	0.45	0.5386	0.9849	1513156	CBDivE_015281	CC(C)NC(=C1C(=O)CC(C)(C)CC1=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M02	compound treatment	1.216	-0.0467	-0.63	1.156	-0.0482	-0.66	-0.9102	-0.9998	1922464	CBDivE_015282	NC(=O)/C(=C\C=C\c1ccccc1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M03	compound treatment	1.255	-0.00774	-0.1	1.207	0.00284	0.04	-0.0464	-0.4167	1922465	CBDivE_015283	Clc1cccc(NC(=O)NCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M04	compound treatment	1.259	-0.00374	-0.05	1.219	0.0148	0.2	0.1074	0.5151	1922466	CBDivE_015284	CCCCNS(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M05	compound treatment	1.237	-0.0257	-0.35	1.203	-0.00116	-0.02	-0.2567	-0.7385	1716908	CBDivE_015285	COC(=O)c1sc2cc(OC)ccc2c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M06	compound treatment	1.216	-0.0467	-0.63	1.15	-0.0542	-0.74	-0.9681	-0.9969	1922467	CBDivE_015286	O=C(N/C(=C/C=C/c1ccccc1)/C(=O)N2CCCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M07	compound treatment	1.259	-0.00374	-0.05	1.161	-0.0432	-0.59	-0.4518	-0.7649	1922468	CBDivE_015287	COc1ccc(N/N=C/2\C(=O)ON=C2c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M08	compound treatment	1.248	-0.0147	-0.2	1.2	-0.00416	-0.06	-0.1807	-0.8739	1922469	CBDivE_015288	CN(Cc1ccccc1)C(=O)c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M09	compound treatment	1.266	0.00326	0.04	1.206	0.00184	0.03	0.0489	0.9648	1075874	CBDivE_015289	Cc1c(Cl)cccc1NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M10	compound treatment	1.277	0.0143	0.19	1.23	0.0258	0.35	0.3852	0.9595	1922470	CBDivE_015290	Clc1c(sc2ccccc12)C(=O)NNc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M11	compound treatment	1.264	0.00126	0.02	1.185	-0.0192	-0.26	-0.1727	-0.6597	1922471	CBDivE_015291	Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccc(cc3)C(=O)N\N=C\c4c(O)ccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M12	compound treatment	1.242	-0.0207	-0.28	1.226	0.0218	0.3	0.0128	0.0313	1922472	CBDivE_015292	CC1(C(C2CCCCC2=C3CCCCC31)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M13	compound treatment	1.232	-0.0307	-0.41	1.159	-0.0452	-0.62	-0.7287	-0.9815	1922473	CBDivE_015293	[O-][N+](=O)c1ccc(/C=N/c2ccc3nc[nH]c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M14	compound treatment	1.303	0.0403	0.54	1.266	0.0618	0.84	0.9804	0.9774	1922474	CBDivE_015294	CCOc1cc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)cc(Cl)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M15	compound treatment	1.266	0.00326	0.04	1.19	-0.0142	-0.19	-0.1054	-0.5324	1458132	CBDivE_015295	Clc1cccc(NC(=O)NC2CCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M16	compound treatment	1.265	0.00226	0.03	1.221	0.0168	0.23	0.184	0.794	1922475	CBDivE_015296	Cc1ccc2nc(sc2c1)c3ccc(/N=C/c4c(O)ccc5cc(ccc45)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M17	compound treatment	1.279	0.0163	0.22	1.206	0.00184	0.03	0.1729	0.783	1478274	CBDivE_015297	OC(=O)C(NC(=O)c1ccc(cc1)c2ccccc2)C3(CC4CC5CC(C4)C3)C5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M18	compound treatment	1.273	0.0103	0.14	1.206	0.00184	0.03	0.1156	0.8221	1922476	CBDivE_015298	O=C(N/N=C/c1cc(=O)[nH]c(=O)[nH]1)C2CC2(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M19	compound treatment	1.256	-0.00674	-0.09	1.176	-0.0282	-0.38	-0.3358	-0.851	1922477	CBDivE_015299	CCCc1noc2CC(C)(C)C/C(=N/OC(=O)C)/c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	M20	compound treatment	1.284	0.0213	0.29	1.243	0.0388	0.53	0.5774	0.9585	1922478	CBDivE_015300	Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N01	compound treatment	1.239	-0.0237	-0.32	1.195	-0.00916	-0.12	-0.3148	-0.9157	1159654	CBDivE_015301	CC(=O)Nc1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N02	compound treatment	1.229	-0.0337	-0.46	1.189	-0.0152	-0.21	-0.468	-0.9362	1922479	CBDivE_015302	COc1ccccc1/C=C/C(=O)c2c(C)cc(C)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N03	compound treatment	1.212	-0.0507	-0.68	1.146	-0.0582	-0.79	-1.0448	-0.9973	1058726	CBDivE_015303	c1ccc2c(c1)[nH]c3nc4cc5ccccc5cc4nc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N04	compound treatment	1.225	-0.0377	-0.51	1.152	-0.0522	-0.71	-0.8629	-0.9866	1922480	CBDivE_015304	COc1ccc(OC)c(/N=C/c2ccncc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N05	compound treatment	1.219	-0.0437	-0.59	1.184	-0.0202	-0.27	-0.6116	-0.9396	1922481	CBDivE_015305	O=C(/C=C/c1ccccc1)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N06	compound treatment	1.206	-0.0567	-0.77	1.131	-0.0732	-1.0	-1.2467	-0.9914	1922482	CBDivE_015306	O=C(N/N=C/c1ccc2OCOc2c1)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N07	compound treatment	1.22	-0.0427	-0.58	1.155	-0.0492	-0.67	-0.8817	-0.9972	1922483	CBDivE_015307	COc1ccc(cc1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N08	compound treatment	1.189	-0.0737	-0.99	1.131	-0.0732	-1.0	-1.4088	-1.0	1922484	CBDivE_015308	OC(=O)CN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N09	compound treatment	1.195	-0.0677	-0.91	1.142	-0.0622	-0.85	-1.2455	-0.9993	1922485	CBDivE_015309	Clc1cccc(c1)C(=O)N/N=C/c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N10	compound treatment	1.23	-0.0327	-0.44	1.153	-0.0512	-0.7	-0.8056	-0.9757	1922486	CBDivE_015310	O=C/1NC(=S)S\C1=C\Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N11	compound treatment	1.213	-0.0497	-0.67	1.14	-0.0642	-0.87	-1.0931	-0.9914	1922487	CBDivE_015311	Clc1ccccc1c2nc(=O)[nH]c3ccc(Br)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N12	compound treatment	1.259	-0.00374	-0.05	1.181	-0.0232	-0.32	-0.259	-0.8098	1922488	CBDivE_015312	Fc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N13	compound treatment	1.258	-0.00474	-0.06	1.192	-0.0122	-0.17	-0.1624	-0.9142	1292192	CBDivE_015313	Oc1cc(OCc2ccccc2)cc3oc(cc(=O)c13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N14	compound treatment	1.249	-0.0137	-0.19	1.172	-0.0322	-0.44	-0.4411	-0.9266	1922489	CBDivE_015314	[O-][N+](=O)c1cccc(/C=C/C(=O)Nc2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N15	compound treatment	1.225	-0.0377	-0.51	1.139	-0.0652	-0.89	-0.9883	-0.9651	1171682	CBDivE_015315	Cc1nn(C(=O)c2ccccc2)c3CC(C)(C)CC(=O)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N16	compound treatment	1.271	0.00826	0.11	1.174	-0.0302	-0.41	-0.212	-0.4976	1922490	CBDivE_015316	COc1ccc(cc1)S(=O)(=O)N/N=C(/C)\c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N17	compound treatment	1.232	-0.0307	-0.41	1.165	-0.0392	-0.53	-0.6708	-0.9922	1922491	CBDivE_015317	O=C(NN=C1CCCC1)c2ccc(cc2)C(=O)NN=C3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N18	compound treatment	1.26	-0.00274	-0.04	1.168	-0.0362	-0.49	-0.3748	-0.758	1922492	CBDivE_015318	CC(C)NC(=O)CCCOc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N19	compound treatment	1.264	0.00126	0.02	1.197	-0.00716	-0.1	-0.057	-0.5753	1098309	CBDivE_015319	CC1(C)NC(Cc2c1[nH]c3ccccc23)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	N20	compound treatment	1.26	-0.00274	-0.04	1.183	-0.0212	-0.29	-0.2301	-0.7912	1922493	CBDivE_015320	Clc1cccc(c1)C(=O)NNC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O01	compound treatment	1.294	0.0313	0.42	1.225	0.0208	0.28	0.4992	0.9816	1479025	CBDivE_015321	Cc1ccc(cc1)C(=O)NC(C(=O)O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O02	compound treatment	1.322	0.0593	0.8	1.27	0.0658	0.9	1.2002	0.9983	1922494	CBDivE_015322	CCOC(=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O03	compound treatment	1.303	0.0403	0.54	1.231	0.0268	0.37	0.6429	0.9816	1922495	CBDivE_015323	CCCCCCCC(=O)N/N=C/c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O04	compound treatment	1.303	0.0403	0.54	1.266	0.0618	0.84	0.9804	0.9774	1922496	CBDivE_015324	COc1cc(C=C2C(=O)c3ccccc3C2=O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O05	compound treatment	1.301	0.0383	0.52	1.227	0.0228	0.31	0.5852	0.9708	1922497	CBDivE_015325	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O06	compound treatment	1.246	-0.0167	-0.23	1.187	-0.0172	-0.23	-0.3251	-0.9998	1922498	CBDivE_015326	OC(=O)CCCCCNC(=O)Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O07	compound treatment	1.256	-0.00674	-0.09	1.176	-0.0282	-0.38	-0.3358	-0.851	1922499	CBDivE_015327	CC1(C)CC(=C/C(=N/NC(=O)c2ccco2)/C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O08	compound treatment	1.249	-0.0137	-0.19	1.155	-0.0492	-0.67	-0.6051	-0.87	1110184	CBDivE_015328	Oc1ccc(O)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O09	compound treatment	1.307	0.0443	0.6	1.286	0.0818	1.12	1.2114	0.9571	1922500	CBDivE_015329	Oc1nnc(O)n1/N=C/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O10	compound treatment	1.295	0.0323	0.44	1.237	0.0328	0.45	0.6244	0.9999	1027303	CBDivE_015330	Nc1cc2C(=O)c3ccccc3C(=O)c2cc1S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O11	compound treatment	1.286	0.0233	0.31	1.179	-0.0252	-0.34	-0.0207	-0.0445	1922501	CBDivE_015331	CC1(C)CC(=C/C(=N\NC(=O)c2ccncc2)/C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O12	compound treatment	1.324	0.0613	0.83	1.25	0.0458	0.63	1.0264	0.9905	1052455	CBDivE_015332	Ic1ccccc1C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O13	compound treatment	1.292	0.0293	0.39	1.197	-0.00716	-0.1	0.2101	0.5167	1922502	CBDivE_015333	CC(C)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O14	compound treatment	1.283	0.0203	0.27	1.232	0.0278	0.38	0.4617	0.987	1922503	CBDivE_015334	C1COc2cc3nsnc3cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O15	compound treatment	1.284	0.0213	0.29	1.24	0.0358	0.49	0.5484	0.9677	1922504	CBDivE_015335	CCN1C2C(NC1=O)N(C)C(=O)N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O16	compound treatment	1.278	0.0153	0.21	1.227	0.0228	0.31	0.3658	0.9798	1922505	CBDivE_015336	COc1ccc(/C=N\Nc2nc(cc(n2)c3ccc(F)cc3)c4ccccc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O17	compound treatment	1.301	0.0383	0.52	1.205	8.43E-4	0.01	0.3731	0.7227	1922506	CBDivE_015337	CC(=O)OCc1c(C)cc(C)c(/C=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O18	compound treatment	1.262	-7.4E-4	-0.01	1.209	0.00484	0.07	0.0396	0.5935	1922507	CBDivE_015338	CCN(CC)S(=O)(=O)c1ccc(C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O19	compound treatment	1.245	-0.0177	-0.24	1.186	-0.0182	-0.25	-0.3443	-0.9999	1922508	CBDivE_015339	O=C(CN1C(=O)/C(=C/c2ccccc2)/SC1=S)OC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	O20	compound treatment	1.26	-0.00274	-0.04	1.331	0.127	1.73	1.1969	0.6918	1776976	CBDivE_015340	CN(Cc1ccccc1)S(=O)(=O)c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P01	compound treatment	1.27	0.00726	0.1	1.204	-1.57E-4	0.0	0.0677	0.6915	1922509	CBDivE_015341	O=C(CCN1C(=O)c2cccc3cccc(C1=O)c23)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P02	compound treatment	1.24	-0.0227	-0.31	1.186	-0.0182	-0.25	-0.392	-0.9943	1075885	CBDivE_015342	Fc1ccc(NS(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P03	compound treatment	1.245	-0.0177	-0.24	1.192	-0.0122	-0.17	-0.2864	-0.9839	1922510	CBDivE_015343	Cc1ccc(NCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P04	compound treatment	1.18	-0.0827	-1.12	1.099	-0.105	-1.43	-1.8032	-0.9923	1922511	CBDivE_015344	CCCCOC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P05	compound treatment	1.28	0.0173	0.23	1.236	0.0318	0.43	0.4717	0.9573	1922512	CBDivE_015345	CCCCCCCC(=O)N/N=C/c1cccc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P06	compound treatment	1.255	-0.00774	-0.1	1.174	-0.0302	-0.41	-0.3646	-0.8594	1922513	CBDivE_015346	COc1ccc(/C=N/NC(=O)C2C3CCCCC23)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P07	compound treatment	1.2	-0.0627	-0.85	1.124	-0.0802	-1.09	-1.3714	-0.992	1922514	CBDivE_015347	Clc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccc(Cl)cc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P08	compound treatment	1.176	-0.0867	-1.17	1.081	-0.123	-1.68	-2.015	-0.9844	1922515	CBDivE_015348	Cc1ccc(/N=C/c2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P09	compound treatment	1.242	-0.0207	-0.28	1.13	-0.0742	-1.01	-0.9129	-0.8701	1922516	CBDivE_015349	OC(=O)c1ccc(cc1)N2C(=O)/C(=C/c3ccc(Br)cc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P10	compound treatment	0.674	-0.589	-7.94	0.799	-0.405	-5.52	-9.5229	-0.9843	1623945	CBDivE_015350	Cc1[nH]nc(c1c2ccc(F)cc2)c3ccc(O)cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P11	compound treatment	1.214	-0.0487	-0.66	1.133	-0.0712	-0.97	-1.1511	-0.982	1058538	CBDivE_015351	CN1CCN(CC1)S(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P12	compound treatment	1.249	-0.0137	-0.19	1.162	-0.0422	-0.57	-0.5376	-0.89	1922517	CBDivE_015352	COC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P13	compound treatment	1.178	-0.0847	-1.14	1.104	-0.1	-1.37	-1.7741	-0.9961	1922518	CBDivE_015353	NC(=O)/C=C/C(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P14	compound treatment	1.277	0.0143	0.19	1.193	-0.0112	-0.15	0.0285	0.116	1922519	CBDivE_015354	CC/1=NN(C(=O)\C1=N/Nc2ccccc2C)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P15	compound treatment	1.199	-0.0637	-0.86	1.122	-0.0822	-1.12	-1.4002	-0.9915	1922520	CBDivE_015355	COC(=O)CCN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P16	compound treatment	1.244	-0.0187	-0.25	1.176	-0.0282	-0.38	-0.4503	-0.9794	1922521	CBDivE_015356	O=C(NNc1ccccc1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P17	compound treatment	1.263	2.6E-4	0.0	1.204	-1.57E-4	0.0	0.001	0.2362	1922522	CBDivE_015357	[O-][N+](=O)c1ccc(NNC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P18	compound treatment	1.265	0.00226	0.03	1.2	-0.00416	-0.06	-0.0185	-0.2877	1922523	CBDivE_015358	NC(=O)c1ccc(/N=C/c2cccc(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P19	compound treatment	1.267	0.00426	0.06	1.179	-0.0252	-0.34	-0.2019	-0.5806	1702225	CBDivE_015359	Brc1cccc(c1)C(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.48	P20	compound treatment	1.314	0.0513	0.69	1.252	0.0478	0.65	0.9503	0.9996	1922524	CBDivE_015360	COc1ccc(/C=C/2\SC(=S)N(CCC(=O)N3CCCCC3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A01	compound treatment	1.268	-6.36E-4	-0.01	1.202	-0.00405	-0.06	-0.0452	-0.8073	1922525	CBDivE_015361	CCCCCCCOc1ccc(/C=N/NC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A02	compound treatment	1.272	0.00336	0.05	1.215	0.00895	0.12	0.1184	0.9093	1922526	CBDivE_015362	Brc1ccccc1c2nc3ccccc3c4nc5ccccc5n24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A03	compound treatment	1.302	0.0334	0.45	1.23	0.0239	0.33	0.5492	0.9876	1922527	CBDivE_015363	CN1C(=O)/C(=C/2\SC(=S)N(C2=O)c3ccccc3C)/c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A04	compound treatment	1.294	0.0254	0.34	1.196	-0.0101	-0.14	0.145	0.3934	1922528	CBDivE_015364	COC(=O)C1C(=O)/C(=C/Nc2ccc(Br)cc2)/C(=O)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A05	compound treatment	1.283	0.0144	0.19	1.218	0.0119	0.16	0.2522	0.9963	1478570	CBDivE_015365	OC(=O)c1cccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A06	compound treatment	1.305	0.0364	0.49	1.255	0.0489	0.67	0.8188	0.9885	1922529	CBDivE_015366	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2[nH]cnc2C(=O)N3CC(=O)Nc4ccccc34)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A07	compound treatment	1.265	-0.00364	-0.05	1.175	-0.0311	-0.42	-0.3341	-0.7838	1922530	CBDivE_015367	[O-][N+](=O)c1ccc(cc1)C2OC(=O)C=C(O2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A08	compound treatment	1.238	-0.0306	-0.41	1.201	-0.00505	-0.07	-0.341	-0.8138	1922531	CBDivE_015368	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A09	compound treatment	1.248	-0.0206	-0.28	1.188	-0.0181	-0.25	-0.3709	-0.9981	1325385	CBDivE_015369	CCOC(=O)C1=C(C)NC(=O)N(C=O)C1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A10	compound treatment	1.259	-0.00964	-0.13	1.154	-0.0521	-0.71	-0.5938	-0.8229	1260987	CBDivE_015370	OC(c1ccccc1)c2ccccc2S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A11	compound treatment	1.274	0.00536	0.07	1.224	0.0179	0.24	0.2242	0.8786	1922532	CBDivE_015371	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A12	compound treatment	1.281	0.0124	0.17	1.236	0.0299	0.41	0.4067	0.922	1922533	CBDivE_015372	CC(=O)C/1C(=O)c2c(cccc2[N+](=O)[O-])\C1=N/c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A13	compound treatment	1.298	0.0294	0.4	1.292	0.0859	1.17	1.1088	0.8963	1922534	CBDivE_015373	COc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A14	compound treatment	1.274	0.00536	0.07	1.263	0.0569	0.78	0.6003	0.7697	1922535	CBDivE_015374	C/C(=N\N=C\c1ccc(cc1)[N+](=O)[O-])/C2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A15	compound treatment	1.26	-0.00864	-0.12	1.205	-0.00105	-0.01	-0.0925	-0.7883	1922536	CBDivE_015375	[O-][N+](=O)c1cc(ccc1Cl)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A16	compound treatment	1.261	-0.00764	-0.1	1.264	0.0579	0.79	0.4859	0.6098	1922537	CBDivE_015376	CCCCCCCC(=O)NNC(=O)C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A17	compound treatment	1.235	-0.0336	-0.45	1.213	0.00695	0.09	-0.2539	-0.5477	1922538	CBDivE_015377	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A18	compound treatment	1.283	0.0144	0.19	1.304	0.0979	1.34	1.0815	0.8013	1922539	CBDivE_015378	Brc1cccc(c1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A19	compound treatment	1.244	-0.0246	-0.33	1.193	-0.0131	-0.18	-0.3609	-0.9572	1456244	CBDivE_015379	COc1ccccc1N2CCN(CC2)C(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	A20	compound treatment	1.271	0.00236	0.03	1.263	0.0569	0.78	0.5717	0.7355	1922540	CBDivE_015380	CC(=O)Nc1ccc(NC2(C)C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B01	compound treatment	1.275	0.00636	0.09	1.22	0.0139	0.19	0.1952	0.9354	1398361	CBDivE_015381	CCc1cc2c(=O)c(c3nc4ccccc4s3)c(C)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B02	compound treatment	1.279	0.0104	0.14	1.229	0.0229	0.31	0.3201	0.9341	1157950	CBDivE_015382	COc1ccc(CC(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B03	compound treatment	1.253	-0.0156	-0.21	1.173	-0.0331	-0.45	-0.4679	-0.9402	1038073	CBDivE_015383	Nc1ccc2c(cccc2c1S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B04	compound treatment	1.315	0.0464	0.63	1.245	0.0389	0.53	0.8178	0.9967	1922541	CBDivE_015384	Clc1ccc(C(=O)NNC(=O)c2cccc(Br)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B05	compound treatment	1.305	0.0364	0.49	1.247	0.0409	0.56	0.7417	0.9979	1922542	CBDivE_015385	CC/1(CCCC\C1=N/O)NO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B06	compound treatment	1.285	0.0164	0.22	1.248	0.0419	0.57	0.5606	0.9143	1922543	CBDivE_015386	O=C(NNC(=O)c1ccccc1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B07	compound treatment	1.295	0.0264	0.36	1.242	0.0359	0.49	0.5981	0.9876	1295268	CBDivE_015387	OC(=O)c1cccc(NC(=O)c2ccc(cc2)N3C(=O)c4ccccc4C3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B08	compound treatment	1.276	0.00736	0.1	1.212	0.00595	0.08	0.1276	0.9949	1159346	CBDivE_015388	Nc1ccc2Oc3ccc(N)cc3S(=O)(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B09	compound treatment	1.266	-0.00264	-0.04	1.208	0.00195	0.03	-0.0064	-0.1437	1922544	CBDivE_015389	CC(C)N(C(C)C)C(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B10	compound treatment	1.305	0.0364	0.49	1.291	0.0849	1.16	1.166	0.9269	1922545	CBDivE_015390	Brc1cccc(c1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B11	compound treatment	1.264	-0.00464	-0.06	1.229	0.0229	0.31	0.177	0.5548	1922546	CBDivE_015391	O=C/1Nc2ccccc2\C1=N/Nc3ncnc4sc5CCCc5c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B12	compound treatment	1.27	0.00136	0.02	1.204	-0.00205	-0.03	-0.0068	-0.2027	1922547	CBDivE_015392	O=C(NCCc1ccccc1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B13	compound treatment	1.236	-0.0326	-0.44	1.169	-0.0371	-0.51	-0.6686	-0.9976	1922548	CBDivE_015393	Cc1ccc(cc1)S(=O)(=O)/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B14	compound treatment	1.29	0.0214	0.29	1.265	0.0589	0.8	0.7722	0.9043	1922549	CBDivE_015394	COc1ccc(/C=N/NC(=O)c2ccccc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B15	compound treatment	1.272	0.00336	0.05	1.235	0.0289	0.39	0.3112	0.7832	1922550	CBDivE_015395	CCCOC(=O)CN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B16	compound treatment	1.252	-0.0166	-0.22	1.221	0.0149	0.2	-0.0146	-0.0481	1922551	CBDivE_015396	Cc1n[nH]c(Nc2ccc(I)cc2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B17	compound treatment	1.294	0.0254	0.34	1.266	0.0599	0.82	0.82	0.9253	1922552	CBDivE_015397	OC(=O)c1ccc(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B18	compound treatment	1.259	-0.00964	-0.13	1.245	0.0389	0.53	0.2836	0.5187	1922553	CBDivE_015398	CC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B19	compound treatment	1.258	-0.0106	-0.14	1.229	0.0229	0.31	0.1198	0.348	1922554	CBDivE_015399	COc1ccccc1N2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	B20	compound treatment	1.273	0.00436	0.06	1.259	0.0529	0.72	0.5522	0.7622	1209399	CBDivE_015400	O=C(NCCc1ccccc1)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C01	compound treatment	1.238	-0.0306	-0.41	1.167	-0.0391	-0.53	-0.6688	-0.9921	1778919	CBDivE_015401	COc1cc(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])c(OC)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C02	compound treatment	1.278	0.00936	0.13	1.219	0.0129	0.18	0.2142	0.9865	1922555	CBDivE_015402	CCOc1ccc(/C=N/c2cccc(c2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C03	compound treatment	1.291	0.0224	0.3	1.2	-0.00605	-0.08	0.155	0.4954	1922556	CBDivE_015403	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C04	compound treatment	1.25	-0.0186	-0.25	1.206	-5.33E-5	0.0	-0.1783	-0.7091	1922557	CBDivE_015404	COc1ccc(/C=N/NC(=O)c2ccccc2O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C05	compound treatment	1.252	-0.0166	-0.22	1.193	-0.0131	-0.18	-0.2846	-0.9934	1514548	CBDivE_015405	COC(=O)c1ccc(OCC(=O)c2c(O)cc(O)cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C06	compound treatment	1.288	0.0194	0.26	1.221	0.0149	0.2	0.3288	0.9925	1922558	CBDivE_015406	CCOC(=O)c1ccccc1NS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C07	compound treatment	1.295	0.0264	0.36	1.216	0.00995	0.14	0.3474	0.9127	1922559	CBDivE_015407	CCCCCCCCNC(=O)Cc1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C08	compound treatment	1.292	0.0234	0.32	1.244	0.0379	0.52	0.5888	0.9717	1785286	CBDivE_015408	C1Oc2ccc(/C=C/c3ccncc3)cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C09	compound treatment	1.244	-0.0246	-0.33	1.15	-0.0561	-0.76	-0.7755	-0.9304	1274617	CBDivE_015409	C(N1CCN(Cc2ccccc2)C1c3cccnc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C10	compound treatment	1.287	0.0184	0.25	1.24	0.0339	0.46	0.5025	0.9571	1922560	CBDivE_015410	FC(F)(F)c1ccc2c(Nc3ccccc3S2(=O)=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C11	compound treatment	1.296	0.0274	0.37	1.219	0.0129	0.18	0.3859	0.943	1267342	CBDivE_015411	NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C12	compound treatment	1.327	0.0584	0.79	1.274	0.0679	0.93	1.2119	0.9967	1922561	CBDivE_015412	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C13	compound treatment	1.303	0.0344	0.46	1.197	-0.00905	-0.12	0.2405	0.5013	1922562	CBDivE_015413	Cc1ccc(cn1)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C14	compound treatment	1.328	0.0594	0.8	1.262	0.0559	0.76	1.1058	0.9997	1922563	CBDivE_015414	O=c1c2nc3ccccc3n2c(=O)n4c5ccccc5nc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C15	compound treatment	1.377	0.108	1.46	1.282	0.0759	1.04	1.766	0.9857	1922564	CBDivE_015415	c1ccc(cc1)c2cc3c4nonc4ccc3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C16	compound treatment	1.315	0.0464	0.63	1.264	0.0579	0.79	1.001	0.9933	1922565	CBDivE_015416	Clc1ccc(OCCCC(=O)NNC(=O)C2C3CCCCC23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C17	compound treatment	1.258	-0.0106	-0.14	1.188	-0.0181	-0.25	-0.2755	-0.967	1922566	CBDivE_015417	CN1C(=O)/C(=C/2\SC(=S)N(C2=O)c3cccc(Br)c3)/c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C18	compound treatment	1.295	0.0264	0.36	1.279	0.0729	0.99	0.9549	0.9039	1922567	CBDivE_015418	Cc1cccc(NC2(C)C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C19	compound treatment	1.296	0.0274	0.37	1.191	-0.0151	-0.21	0.1159	0.2743	1922568	CBDivE_015419	Cc1cc(C)n(/N=C/c2ccc3OCOc3c2)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	C20	compound treatment	1.248	-0.0206	-0.28	1.209	0.00295	0.04	-0.1684	-0.5988	1236707	CBDivE_015420	CCN1C2C(N(C)C(=O)N2C)N(CO)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D01	compound treatment	1.275	0.00636	0.09	1.214	0.00795	0.11	0.1373	0.9933	1922569	CBDivE_015421	OC(=O)CN1C(=O)/C(=C/c2cccc(Br)c2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D02	compound treatment	1.232	-0.0366	-0.49	1.172	-0.0341	-0.46	-0.6778	-0.9995	1922570	CBDivE_015422	Oc1ccc(cc1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D03	compound treatment	1.246	-0.0226	-0.31	1.194	-0.0121	-0.16	-0.3322	-0.9578	1293644	CBDivE_015423	CC(C)C(=O)Nc1c2CCN(C)c2nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D04	compound treatment	1.252	-0.0166	-0.22	1.174	-0.0321	-0.44	-0.4678	-0.952	1922571	CBDivE_015424	Clc1ccc(cc1)C(=O)NNC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D05	compound treatment	1.26	-0.00864	-0.12	1.185	-0.0211	-0.29	-0.2854	-0.9211	1682377	CBDivE_015425	COc1ccccc1c2cc(nc(n2)N3CCCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D06	compound treatment	1.271	0.00236	0.03	1.196	-0.0101	-0.14	-0.0744	-0.5285	1922572	CBDivE_015426	COc1cccc(c1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D07	compound treatment	1.273	0.00436	0.06	1.218	0.0119	0.16	0.1568	0.9053	1922573	CBDivE_015427	CCc1cc2c(=O)c(c3nc4ccccc4s3)c(oc2cc1O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D08	compound treatment	1.257	-0.0116	-0.16	1.162	-0.0441	-0.6	-0.5358	-0.8629	1922574	CBDivE_015428	Clc1cccc(c1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D09	compound treatment	1.278	0.00936	0.13	1.239	0.0329	0.45	0.407	0.8721	1298031	CBDivE_015429	CN1CCN(CC(O)COc2ccccc2CC=C)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D10	compound treatment	1.251	-0.0176	-0.24	1.195	-0.0111	-0.15	-0.2748	-0.9757	1155290	CBDivE_015430	CC(=O)Nc1ccc(OC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D11	compound treatment	1.273	0.00436	0.06	1.19	-0.0161	-0.22	-0.1132	-0.4992	1774442	CBDivE_015431	[O-][N+](=O)c1ccc(cc1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D12	compound treatment	1.305	0.0364	0.49	1.235	0.0289	0.39	0.626	0.9942	1315203	CBDivE_015432	Cc1ccc(Nc2nc(Cl)nc(NC(C)(C)C)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D13	compound treatment	1.325	0.0564	0.76	1.252	0.0459	0.63	0.9807	0.9954	1922575	CBDivE_015433	CCCOC(=O)CCN1C(=O)/C(=C/c2ccccc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D14	compound treatment	1.308	0.0394	0.53	1.266	0.0599	0.82	0.9535	0.9782	1159811	CBDivE_015434	CC1CCN(CN2C(=O)c3ccccc3C2=O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D15	compound treatment	1.254	-0.0146	-0.2	1.143	-0.0631	-0.86	-0.7476	-0.8474	1922576	CBDivE_015435	COc1cccc(c1)C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D16	compound treatment	1.273	0.00436	0.06	1.237	0.0309	0.42	0.34	0.798	1131834	CBDivE_015436	COC(=O)c1cccc(NCN2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D17	compound treatment	1.268	-6.36E-4	-0.01	1.229	0.0229	0.31	0.2152	0.6874	1922577	CBDivE_015437	Cc1[nH]c(=S)[nH]c1C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D18	compound treatment	1.274	0.00536	0.07	1.226	0.0199	0.27	0.2435	0.8651	1922578	CBDivE_015438	OCC(NCc1ccccc1)C#CCN2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D19	compound treatment	1.265	-0.00364	-0.05	1.23	0.0239	0.33	0.1962	0.5942	1922579	CBDivE_015439	[O-][N+](=O)c1ccc(/N=C\2/C(C(=O)c3ccccc23)c4ccccc4)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	D20	compound treatment	1.262	-0.00664	-0.09	1.233	0.0269	0.37	0.1965	0.5196	1646437	CBDivE_015440	Cc1cccc(OCC(=O)Oc2ccc3c(C)cc(=O)oc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E01	compound treatment	1.252	-0.0166	-0.22	1.147	-0.0591	-0.81	-0.7281	-0.871	1922580	CBDivE_015441	Cc1cc(C)c(C(=O)/C=C/c2ccccc2F)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E02	compound treatment	1.288	0.0194	0.26	1.274	0.0679	0.93	0.8399	0.8725	1692637	CBDivE_015442	COC(=O)c1c(c2ccccc2n1C)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E03	compound treatment	1.247	-0.0216	-0.29	1.204	-0.00205	-0.03	-0.2262	-0.7714	1329272	CBDivE_015443	CC1CCN(CC(O)COc2ccccc2CC=C)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E04	compound treatment	1.263	-0.00564	-0.08	1.209	0.00295	0.04	-0.0254	-0.2948	1922581	CBDivE_015444	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NNC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E05	compound treatment	1.239	-0.0296	-0.4	1.204	-0.00205	-0.03	-0.3025	-0.7548	1191984	CBDivE_015445	COc1ccccc1N2CCN(CC2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E06	compound treatment	1.239	-0.0296	-0.4	1.193	-0.0131	-0.18	-0.4086	-0.9336	1922582	CBDivE_015446	Brc1ccc(cc1)C(=O)N/N=C\2/C(C(=O)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E07	compound treatment	1.253	-0.0156	-0.21	1.179	-0.0271	-0.37	-0.41	-0.9648	1922583	CBDivE_015447	CCOC(=O)C(=CNC(=O)N)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E08	compound treatment	1.258	-0.0106	-0.14	1.244	0.0379	0.52	0.2644	0.4924	1922584	CBDivE_015448	Cn1c(cc(c2ccccc2)c(c3ccccc3)c1=O)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E09	compound treatment	1.254	-0.0146	-0.2	1.23	0.0239	0.33	0.0913	0.2392	1922585	CBDivE_015449	CC(C)c1ccc(NC(=O)c2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E10	compound treatment	1.275	0.00636	0.09	1.244	0.0379	0.52	0.4266	0.8133	1922586	CBDivE_015450	Clc1ccccc1C(=O)Nc2ccc3N=C(c4ccccc4)c5cc(NC(=O)c6ccccc6Cl)ccc5N=C(c7ccccc7)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E11	compound treatment	1.276	0.00736	0.1	1.166	-0.0401	-0.55	-0.316	-0.5692	1922587	CBDivE_015451	CC(C)c1ccc(/C=C/C(=O)NNC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E12	compound treatment	1.305	0.0364	0.49	1.262	0.0559	0.76	0.8863	0.9772	1922588	CBDivE_015452	Oc1ccc2ccccc2c1/C=N/Nc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E13	compound treatment	1.295	0.0264	0.36	1.172	-0.0341	-0.46	-0.0769	-0.1314	1922589	CBDivE_015453	COc1ccccc1/C=N/NC(=O)c2ccccc2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E14	compound treatment	1.303	0.0344	0.46	1.261	0.0549	0.75	0.8576	0.9734	1182242	CBDivE_015454	CCc1cc2c(=O)c(c3nc4ccccc4n3C)c(C)oc2cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E15	compound treatment	1.288	0.0194	0.26	1.183	-0.0231	-0.31	-0.0376	-0.0919	1922590	CBDivE_015455	O/C(=C\Nc1cccc(c1)[N+](=O)[O-])/C=C/C=Nc2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E16	compound treatment	1.309	0.0404	0.54	1.249	0.0429	0.59	0.7992	0.9993	1229094	CBDivE_015456	COc1ccc(NCc2ccncc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E17	compound treatment	1.272	0.00336	0.05	1.196	-0.0101	-0.14	-0.0649	-0.4491	1915443	CBDivE_015457	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E18	compound treatment	1.289	0.0204	0.27	1.264	0.0579	0.79	0.753	0.9001	1922591	CBDivE_015458	C/C(=N\N=C(/C)\c1ccccc1)/C2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E19	compound treatment	1.251	-0.0176	-0.24	1.223	0.0169	0.23	-0.0048	-0.0146	1922592	CBDivE_015459	Oc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	E20	compound treatment	1.286	0.0174	0.23	1.265	0.0589	0.8	0.734	0.8767	1922593	CBDivE_015460	CCCCCCCC(=O)N/N=C/c1ccc2OCOc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F01	compound treatment	1.219	-0.0496	-0.67	1.138	-0.0681	-0.93	-1.1297	-0.9872	1922594	CBDivE_015461	O=C1N/C(=N/N=C/c2ccccc2)/SC1(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F02	compound treatment	1.231	-0.0376	-0.51	1.184	-0.0221	-0.3	-0.5717	-0.9687	1922595	CBDivE_015462	CCCOC(C(=O)OC(C)CN(C)C)(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F03	compound treatment	1.241	-0.0276	-0.37	1.175	-0.0311	-0.42	-0.5631	-0.998	1922596	CBDivE_015463	CC1=CN2CC(O)CN=C2C=C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F04	compound treatment	1.259	-0.00964	-0.13	1.173	-0.0331	-0.45	-0.4106	-0.8754	1922597	CBDivE_015464	CCOc1ccc(cc1)C(c2c(O)c3ccccc3oc2=O)c4c(O)c5ccccc5oc4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F05	compound treatment	1.279	0.0104	0.14	1.201	-0.00505	-0.07	0.0501	0.3217	1541931	CBDivE_015465	Cc1cccc(c1)N2CCc3c2nc4ccccc4c3N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F06	compound treatment	1.237	-0.0316	-0.43	1.181	-0.0251	-0.34	-0.5434	-0.9939	1922598	CBDivE_015466	[O-][N+](=O)c1ccc(c(c1)C(F)(F)F)n2nnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F07	compound treatment	1.267	-0.00164	-0.02	1.212	0.00595	0.08	0.0417	0.4965	1922599	CBDivE_015467	Brc1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F08	compound treatment	1.252	-0.0166	-0.22	1.207	9.47E-4	0.01	-0.1496	-0.6653	1692479	CBDivE_015468	CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F09	compound treatment	1.235	-0.0336	-0.45	1.186	-0.0201	-0.27	-0.5142	-0.9706	1922600	CBDivE_015469	Oc1ccc(cc1)C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F10	compound treatment	1.289	0.0204	0.27	1.26	0.0539	0.74	0.7144	0.9098	1182925	CBDivE_015470	CC(NC(=O)C(c1ccccc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F11	compound treatment	1.299	0.0304	0.41	1.276	0.0699	0.95	0.9641	0.9288	1922601	CBDivE_015471	O=C1CC(N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F12	compound treatment	1.296	0.0274	0.37	1.251	0.0449	0.61	0.6944	0.9705	1922602	CBDivE_015472	[O-][N+](=O)c1ccc(/C=N/Nc2n[nH]c(=O)[nH]c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F13	compound treatment	1.271	0.00236	0.03	1.203	-0.00305	-0.04	-0.0069	-0.1314	1922603	CBDivE_015473	CCCCCCCC(=O)NNC(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F14	compound treatment	1.263	-0.00564	-0.08	1.18	-0.0261	-0.36	-0.305	-0.8394	1922604	CBDivE_015474	OC(=O)c1cccc(Nc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F15	compound treatment	1.281	0.0124	0.17	1.205	-0.00105	-0.01	0.1078	0.6438	1922605	CBDivE_015475	COc1ccc(cc1)C(=O)NNC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F16	compound treatment	1.292	0.0234	0.32	1.253	0.0469	0.64	0.6756	0.9467	1922606	CBDivE_015476	CCCCCC(=O)NNC(=O)COc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F17	compound treatment	1.233	-0.0356	-0.48	1.182	-0.0241	-0.33	-0.5719	-0.9826	1922607	CBDivE_015477	Clc1ccc(cc1)C(=O)NCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F18	compound treatment	1.29	0.0214	0.29	1.24	0.0339	0.46	0.5311	0.974	1922608	CBDivE_015478	O=C(NNC(=O)c1ccncc1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F19	compound treatment	1.243	-0.0256	-0.35	1.186	-0.0201	-0.27	-0.4379	-0.9932	1112697	CBDivE_015479	[O-][N+](=O)c1cccc(c1)C(=O)NNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	F20	compound treatment	1.299	0.0304	0.41	1.261	0.0549	0.75	0.8195	0.9596	1604390	CBDivE_015480	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(cc4)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G01	compound treatment	1.226	-0.0426	-0.58	1.177	-0.0291	-0.4	-0.6869	-0.9834	1922609	CBDivE_015481	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G02	compound treatment	1.227	-0.0416	-0.56	1.207	9.47E-4	0.01	-0.3881	-0.6907	1922610	CBDivE_015482	O=C(N/N=C/c1cccnc1)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G03	compound treatment	1.246	-0.0226	-0.31	1.165	-0.0411	-0.56	-0.6118	-0.9594	1922611	CBDivE_015483	Cc1ccc(NC2=C(C(=O)c3ccccc23)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G04	compound treatment	1.242	-0.0266	-0.36	1.192	-0.0141	-0.19	-0.3896	-0.9567	1922612	CBDivE_015484	Cc1nc(co1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G05	compound treatment	1.274	0.00536	0.07	1.155	-0.0511	-0.7	-0.4411	-0.6302	1922613	CBDivE_015485	Clc1ccccc1C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G06	compound treatment	1.252	-0.0166	-0.22	1.225	0.0189	0.26	0.024	0.0701	1605115	CBDivE_015486	Oc1ccccc1c2nsnc2C(=O)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G07	compound treatment	1.289	0.0204	0.27	1.214	0.00795	0.11	0.2709	0.9172	1922614	CBDivE_015487	Oc1ccccc1C(=O)N/N=C/c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G08	compound treatment	1.245	-0.0236	-0.32	1.228	0.0219	0.3	-0.0139	-0.0317	1922615	CBDivE_015488	COc1ccc(cc1)N2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G09	compound treatment	1.271	0.00236	0.03	1.177	-0.0291	-0.4	-0.2576	-0.6481	1922616	CBDivE_015489	Cc1nnc(NC(=O)C2CCCCC2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G10	compound treatment	1.294	0.0254	0.34	1.234	0.0279	0.38	0.5114	0.9986	1922617	CBDivE_015490	CCOC(=O)C1=C(C)N=C(SC)N(C1c2ccccc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G11	compound treatment	1.253	-0.0156	-0.21	1.187	-0.0191	-0.26	-0.3329	-0.9947	1922618	CBDivE_015491	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G12	compound treatment	1.286	0.0174	0.23	1.243	0.0369	0.5	0.5219	0.9393	1292084	CBDivE_015492	COc1ccc(OCC(O)CN2CCN(CC2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G13	compound treatment	1.236	-0.0326	-0.44	1.129	-0.0771	-1.05	-1.0543	-0.9254	1922619	CBDivE_015493	Brc1ccc(cc1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G14	compound treatment	1.312	0.0434	0.59	1.31	0.104	1.42	1.416	0.9234	1922620	CBDivE_015494	Cc1nc2sc3CCCc3c2c4nncn14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G15	compound treatment	1.284	0.0154	0.21	1.217	0.0109	0.15	0.2521	0.987	1922621	CBDivE_015495	Clc1ccc(/C=N/NC(=O)c2ccncc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G16	compound treatment	1.274	0.00536	0.07	1.245	0.0389	0.53	0.4267	0.7961	1922622	CBDivE_015496	Oc1c(Br)cc(Br)cc1/C=N/Nc2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G17	compound treatment	1.299	0.0304	0.41	1.231	0.0249	0.34	0.5302	0.9957	1922623	CBDivE_015497	Clc1ccc(cc1)S(=O)(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G18	compound treatment	1.325	0.0564	0.76	1.283	0.0769	1.05	1.2796	0.9875	1922624	CBDivE_015498	CCc1nnc2c3c4CCCc4sc3ncn12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G19	compound treatment	1.289	0.0204	0.27	1.178	-0.0281	-0.38	-0.0762	-0.1619	1922625	CBDivE_015499	Clc1cccc(c1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	G20	compound treatment	1.263	-0.00564	-0.08	1.242	0.0359	0.49	0.2928	0.5904	1473615	CBDivE_015500	COc1ccc(OCC(O)CN2CCC(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H01	compound treatment	1.231	-0.0376	-0.51	1.164	-0.0421	-0.57	-0.7645	-0.9982	1922626	CBDivE_015501	Brc1ccc(cc1)C(=O)NCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H02	compound treatment	1.264	-0.00464	-0.06	1.194	-0.0121	-0.16	-0.1605	-0.9124	1457854	CBDivE_015502	Cc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(O)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H03	compound treatment	1.235	-0.0336	-0.45	1.187	-0.0191	-0.26	-0.5046	-0.965	1220703	CBDivE_015503	O=C(CCN1C(=O)c2ccccc2C1=O)NCCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H04	compound treatment	1.225	-0.0436	-0.59	1.169	-0.0371	-0.51	-0.7735	-0.9971	1922627	CBDivE_015504	COc1cccc(/C=C\2/C(=NN(C2=O)c3ccc(Cl)cc3)C)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H05	compound treatment	1.265	-0.00364	-0.05	1.225	0.0189	0.26	0.148	0.5628	1922628	CBDivE_015505	Clc1ccccc1C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H06	compound treatment	1.114	-0.155	-2.09	1.159	-0.0471	-0.64	-1.9288	-0.8837	1518366	CBDivE_015506	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H07	compound treatment	1.273	0.00436	0.06	1.216	0.00995	0.14	0.1375	0.9302	1922629	CBDivE_015507	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H08	compound treatment	1.25	-0.0186	-0.25	1.176	-0.0301	-0.41	-0.4676	-0.9725	1922630	CBDivE_015508	Cc1ccc(Nc2nc(N)nc(Cl)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H09	compound treatment	1.261	-0.00764	-0.1	1.175	-0.0311	-0.42	-0.3723	-0.8542	1922631	CBDivE_015509	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H10	compound treatment	1.274	0.00536	0.07	1.202	-0.00405	-0.06	0.0121	0.1327	1922632	CBDivE_015510	COc1cccc(c1)C(=O)Oc2ccc(cc2)c3cccc(n3)c4ccc(OC(=O)c5cccc(OC)c5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H11	compound treatment	1.25	-0.0186	-0.25	1.213	0.00695	0.09	-0.1108	-0.4124	1922633	CBDivE_015511	Clc1ccc(cc1)N2CCN(CC2)C3CC(=O)N(C3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H12	compound treatment	1.253	-0.0156	-0.21	1.205	-0.00105	-0.01	-0.1593	-0.7535	1922634	CBDivE_015512	CC(C)(C)NCC(O)COc1cccc2c3CCCCc3oc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H13	compound treatment	1.303	0.0344	0.46	1.258	0.0519	0.71	0.8287	0.9789	1089276	CBDivE_015513	Cc1ccc(cc1)N2C(=O)CSC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H14	compound treatment	1.279	0.0104	0.14	1.24	0.0339	0.46	0.4262	0.8814	1922635	CBDivE_015514	COc1cc2CCNC(c3cc4OCOc4cc3[N+](=O)[O-])c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H15	compound treatment	1.246	-0.0226	-0.31	1.187	-0.0191	-0.26	-0.3997	-0.9968	1922636	CBDivE_015515	COc1ccccc1N2CCN(CC2)C3CC(=O)N(C3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H16	compound treatment	1.272	0.00336	0.05	1.2	-0.00605	-0.08	-0.0263	-0.279	1570729	CBDivE_015516	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H17	compound treatment	1.231	-0.0376	-0.51	1.186	-0.0201	-0.27	-0.5524	-0.9579	1171422	CBDivE_015517	CCc1nc2sc3CCCCCc3c2c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H18	compound treatment	1.269	3.64E-4	0.0	1.206	-5.33E-5	0.0	0.003	0.5959	1774702	CBDivE_015518	Cc1ccccc1NC(=O)c2c(cccc2[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H19	compound treatment	1.236	-0.0326	-0.44	1.196	-0.0101	-0.14	-0.4083	-0.8854	1922637	CBDivE_015519	OCCCC(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	H20	compound treatment	1.287	0.0184	0.25	1.234	0.0279	0.38	0.4447	0.9782	1922638	CBDivE_015520	COc1cc(/C=N/NC(=O)c2cccnc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I01	compound treatment	1.245	-0.0236	-0.32	1.191	-0.0151	-0.21	-0.3706	-0.9773	1170960	CBDivE_015521	CC(C)NS(=O)(=O)c1cccc2cccnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I02	compound treatment	1.268	-6.36E-4	-0.01	1.213	0.00695	0.09	0.0609	0.6404	1922639	CBDivE_015522	CC(C)C(N1C(=O)/C(=C/c2ccc(Br)cc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I03	compound treatment	1.252	-0.0166	-0.22	1.175	-0.0311	-0.42	-0.4581	-0.9559	1922640	CBDivE_015523	O=C(N/N=C/c1ccncc1)c2ccc(cc2)C(=O)N/N=C/c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I04	compound treatment	1.243	-0.0256	-0.35	1.186	-0.0201	-0.27	-0.4379	-0.9932	1348804	CBDivE_015524	Cc1cccc(c1)C(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I05	compound treatment	1.326	0.0574	0.77	1.269	0.0629	0.86	1.1542	0.9987	1922641	CBDivE_015525	O=C/1N(C(=S)S\C1=C/C=C/c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I06	compound treatment	1.231	-0.0376	-0.51	1.178	-0.0281	-0.38	-0.6295	-0.9903	1922642	CBDivE_015526	CN1CCN(CC1)C(=O)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I07	compound treatment	1.276	0.00736	0.1	1.202	-0.00405	-0.06	0.0312	0.2741	1922643	CBDivE_015527	Nc1ccccc1C(=O)N/N=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I08	compound treatment	1.292	0.0234	0.32	1.198	-0.00805	-0.11	0.1452	0.4351	1922644	CBDivE_015528	Oc1ccc(cc1)N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I09	compound treatment	1.279	0.0104	0.14	1.134	-0.0721	-0.98	-0.5959	-0.6004	1922645	CBDivE_015529	OC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I10	compound treatment	1.271	0.00236	0.03	1.222	0.0159	0.22	0.1763	0.8022	1922646	CBDivE_015530	CN(C)/C=N/c1c(N=Nc2ccccc2)c3ccccc3n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I11	compound treatment	1.265	-0.00364	-0.05	1.166	-0.0401	-0.55	-0.4209	-0.7675	1922647	CBDivE_015531	O=C/1N(Cc2ccccc2)C(=S)S\C1=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I12	compound treatment	1.245	-0.0236	-0.32	1.201	-0.00505	-0.07	-0.2742	-0.8405	1922648	CBDivE_015532	C/C(=N/NC(=O)c1ccccc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I13	compound treatment	1.281	0.0124	0.17	1.2	-0.00605	-0.08	0.0596	0.3201	1170891	CBDivE_015533	O=C1N(Cc2ccccc2)C(=O)C(Cc3ccccc3)(Cc4ccccc4)C(=O)N1Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I14	compound treatment	1.274	0.00536	0.07	1.224	0.0179	0.24	0.2242	0.8786	1922649	CBDivE_015534	Cc1cccc(c1)C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I15	compound treatment	1.252	-0.0166	-0.22	1.163	-0.0431	-0.59	-0.5738	-0.913	1922650	CBDivE_015535	[O-][N+](=O)c1ccc(/C=C/2\SC(=S)N(Cc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I16	compound treatment	1.287	0.0184	0.25	1.235	0.0289	0.39	0.4543	0.9748	1922651	CBDivE_015536	CC1CCCC(C)N1C(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I17	compound treatment	1.281	0.0124	0.17	1.248	0.0419	0.57	0.5224	0.8768	1922652	CBDivE_015537	Cc1nc(Cl)c2c3CCCc3sc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I18	compound treatment	1.288	0.0194	0.26	1.22	0.0139	0.19	0.3192	0.9878	1922653	CBDivE_015538	Clc1cccc(c1)C(=O)NNC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I19	compound treatment	1.274	0.00536	0.07	1.212	0.00595	0.08	0.1085	0.9984	1922654	CBDivE_015539	CCOC(=O)C1=C(CI)NC(=O)NC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	I20	compound treatment	1.19	-0.0786	-1.06	1.143	-0.0631	-0.86	-1.3581	-0.9946	1922655	CBDivE_015540	Cc1ccc(cc1)N2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J01	compound treatment	1.233	-0.0356	-0.48	1.179	-0.0271	-0.37	-0.6008	-0.9914	1922656	CBDivE_015541	Brc1cccc(c1)C(=O)NNC(=O)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J02	compound treatment	1.267	-0.00164	-0.02	1.195	-0.0111	-0.15	-0.1222	-0.8021	1922657	CBDivE_015542	Cc1ccc(NC(=O)c2ccccc2)c(c1)C(=O)CCCCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J03	compound treatment	1.264	-0.00464	-0.06	1.189	-0.0171	-0.23	-0.2087	-0.8665	1922658	CBDivE_015543	Oc1ccccc1C(=O)N/N=C/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J04	compound treatment	1.25	-0.0186	-0.25	1.173	-0.0331	-0.45	-0.4965	-0.962	1922659	CBDivE_015544	NS(=O)(=O)c1ccc(Nc2nc(cs2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J05	compound treatment	1.263	-0.00564	-0.08	1.193	-0.0131	-0.18	-0.1796	-0.928	1922660	CBDivE_015545	O=C(CC1(CC2CC3CC(C2)C1)C3)NNC(=O)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J06	compound treatment	1.266	-0.00264	-0.04	1.186	-0.0201	-0.27	-0.2185	-0.7924	1922661	CBDivE_015546	Brc1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J07	compound treatment	1.252	-0.0166	-0.22	1.182	-0.0241	-0.33	-0.3906	-0.9829	1922662	CBDivE_015547	Brc1ccc(cc1)C(=O)CSc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J08	compound treatment	1.287	0.0184	0.25	1.207	9.47E-4	0.01	0.1843	0.7429	1922663	CBDivE_015548	OC(=O)/C(=N/Nc1nc(cs1)c2ccc(Cl)c(Cl)c2)/Cc3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J09	compound treatment	1.202	-0.0666	-0.9	1.162	-0.0441	-0.6	-1.0604	-0.9808	1922664	CBDivE_015549	Cc1ccc(cc1)S(=O)(=O)NNC(=O)CC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J10	compound treatment	1.252	-0.0166	-0.22	1.19	-0.0161	-0.22	-0.3135	-0.9999	1041551	CBDivE_015550	OC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J11	compound treatment	1.3	0.0314	0.42	1.229	0.0229	0.31	0.5204	0.989	1633778	CBDivE_015551	CN(C)Cc1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J12	compound treatment	1.233	-0.0356	-0.48	1.145	-0.0611	-0.83	-0.9286	-0.9659	1922665	CBDivE_015552	CCC(=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J13	compound treatment	1.261	-0.00764	-0.1	1.204	-0.00205	-0.03	-0.0926	-0.8678	1431446	CBDivE_015553	Brc1ccccc1C(=O)NCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J14	compound treatment	1.255	-0.0136	-0.18	1.189	-0.0171	-0.23	-0.2945	-0.9933	1922666	CBDivE_015554	CCCCOc1ccc(NC(=S)N2CCn3c4C2CCc4c(=O)c5cc(C)ccc35)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J15	compound treatment	1.279	0.0104	0.14	1.226	0.0199	0.27	0.2912	0.9521	1922667	CBDivE_015555	Brc1cccc(c1)C(=O)NNC(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J16	compound treatment	1.262	-0.00664	-0.09	1.189	-0.0171	-0.23	-0.2277	-0.9139	1681279	CBDivE_015556	O=S(=O)(c1ccccc1)c2nc3ccccc3nc2S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J17	compound treatment	1.254	-0.0146	-0.2	1.172	-0.0341	-0.46	-0.468	-0.9274	1922668	CBDivE_015557	Nc1ccccc1C(=O)N/N=C/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J18	compound treatment	1.3	0.0314	0.42	1.219	0.0129	0.18	0.424	0.9249	1645302	CBDivE_015558	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(cc4)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J19	compound treatment	1.246	-0.0226	-0.31	1.177	-0.0291	-0.4	-0.4961	-0.9917	1922669	CBDivE_015559	O/N=C\1/CC(O)(Oc2ccccc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	J20	compound treatment	1.231	-0.0376	-0.51	1.175	-0.0311	-0.42	-0.6585	-0.9959	1733967	CBDivE_015560	Nc1c(c2nc3ccccc3nc2n1CC=C)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K01	compound treatment	1.251	-0.0176	-0.24	1.221	0.0149	0.2	-0.0241	-0.077	1922670	CBDivE_015561	Nc1ccccc1C(=O)N/N=C/c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K02	compound treatment	1.25	-0.0186	-0.25	1.192	-0.0141	-0.19	-0.3133	-0.991	1922671	CBDivE_015562	[O-][N+](=O)c1ccc(Nc2ccc(cc2)N3CCOCC3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K03	compound treatment	1.252	-0.0166	-0.22	1.187	-0.0191	-0.26	-0.3424	-0.9973	1922672	CBDivE_015563	[O-][N+](=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K04	compound treatment	1.25	-0.0186	-0.25	1.192	-0.0141	-0.19	-0.3133	-0.991	3107428	CBDivE_015564	OS(=O)(=O)c1ccc(cc1)N2CCCC2=O.C1NC=NN1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K05	compound treatment	1.284	0.0154	0.21	1.181	-0.0251	-0.34	-0.095	-0.2378	1922674	CBDivE_015565	Brc1cc2OCOc2cc1/C=N/NC(=O)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K06	compound treatment	1.299	0.0304	0.41	1.247	0.0409	0.56	0.6845	0.9884	1922675	CBDivE_015566	CC(=C1C(=O)CC(C)(C)CC1=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K07	compound treatment	1.264	-0.00464	-0.06	1.179	-0.0271	-0.37	-0.3051	-0.8154	1196665	CBDivE_015567	Clc1ccc(cc1)C(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K08	compound treatment	1.25	-0.0186	-0.25	1.208	0.00195	0.03	-0.159	-0.6289	1435859	CBDivE_015568	CCOC(=O)c1ccc(cc1)n2c(C)nc(=O)c(c2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K09	compound treatment	1.247	-0.0216	-0.29	1.17	-0.0361	-0.49	-0.554	-0.969	1922676	CBDivE_015569	COc1ccc(cc1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K10	compound treatment	1.251	-0.0176	-0.24	1.243	0.0369	0.5	0.188	0.3374	1003063	CBDivE_015570	Oc1ccc2cc(cc(c2c1)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K11	compound treatment	1.272	0.00336	0.05	1.19	-0.0161	-0.22	-0.1227	-0.5489	1922677	CBDivE_015571	CC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K12	compound treatment	1.286	0.0174	0.23	1.208	0.00195	0.03	0.1844	0.7822	1922678	CBDivE_015572	CCN(CC)CC(O)CN(C)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K13	compound treatment	1.314	0.0454	0.61	1.192	-0.0141	-0.19	0.2972	0.4635	1922679	CBDivE_015573	Cc1cc(C)n(n1)S(=O)(=O)c2c(C)c(C)cc(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K14	compound treatment	1.343	0.0744	1.0	1.292	0.0859	1.17	1.5381	0.997	1922680	CBDivE_015574	CCCCN1C2C(N(C)C1=O)N(CCCC)C(=O)N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K15	compound treatment	1.277	0.00836	0.11	1.201	-0.00505	-0.07	0.0311	0.2349	1922681	CBDivE_015575	COc1ccc(cc1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K16	compound treatment	1.294	0.0254	0.34	1.246	0.0399	0.54	0.6271	0.9749	1508872	CBDivE_015576	Clc1ccccc1C(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K17	compound treatment	1.274	0.00536	0.07	1.239	0.0329	0.45	0.3689	0.8105	1922682	CBDivE_015577	CC(=O)c1ccc(OC(=O)c2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K18	compound treatment	1.288	0.0194	0.26	1.227	0.0209	0.29	0.3867	0.999	1922683	CBDivE_015578	CCCCCCCC(=O)N/N=C/c1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K19	compound treatment	1.279	0.0104	0.14	1.22	0.0139	0.19	0.2333	0.9885	1922684	CBDivE_015579	OC(c1ccccc1)(c2ccccc2)c3ccccc3S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	K20	compound treatment	1.28	0.0114	0.15	1.24	0.0339	0.46	0.4357	0.8936	1922685	CBDivE_015580	Oc1cc2ccccc2cc1C(=O)NN=C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L01	compound treatment	1.254	-0.0146	-0.2	1.198	-0.00805	-0.11	-0.2173	-0.9617	1922686	CBDivE_015581	CC(NC(=O)c1cccc(C)c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L02	compound treatment	1.252	-0.0166	-0.22	1.144	-0.0621	-0.85	-0.757	-0.8648	1922687	CBDivE_015582	CC(C)Oc1nc2ccccc2nc1OC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L03	compound treatment	1.268	-6.36E-4	-0.01	1.202	-0.00405	-0.06	-0.0452	-0.8073	1922688	CBDivE_015583	COc1ccccc1S(=O)c2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L04	compound treatment	1.26	-0.00864	-0.12	1.151	-0.0551	-0.75	-0.6132	-0.8072	1339965	CBDivE_015584	CCOC(=O)c1c(N)n(CCCO)c2nc3ccccc3nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L05	compound treatment	1.258	-0.0106	-0.14	1.158	-0.0481	-0.66	-0.5648	-0.842	1922689	CBDivE_015585	Oc1ccc(cc1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L06	compound treatment	1.284	0.0154	0.21	1.201	-0.00505	-0.07	0.0978	0.4479	1337760	CBDivE_015586	CCOC(=O)c1c(N)n(c2ccc(C)cc2)c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L07	compound treatment	1.227	-0.0416	-0.56	1.186	-0.0201	-0.27	-0.5905	-0.9453	1922690	CBDivE_015587	[O-][N+](=O)c1cccc(c1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L08	compound treatment	1.23	-0.0386	-0.52	1.134	-0.0721	-0.98	-1.0633	-0.956	1575775	CBDivE_015588	CCCc1n[nH]c2CC(C)(C)C(C(=O)OC)C(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L09	compound treatment	1.273	0.00436	0.06	1.237	0.0309	0.42	0.34	0.798	1922691	CBDivE_015589	Clc1cccc(OC(=O)c2cccs2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L10	compound treatment	1.238	-0.0306	-0.41	1.166	-0.0401	-0.55	-0.6785	-0.9905	1922692	CBDivE_015590	CCOC(=O)c1c(N)n(c2ccc(Br)cc2)c3nc4cc([N+](=O)[O-])c(cc4nc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L11	compound treatment	1.235	-0.0336	-0.45	1.15	-0.0561	-0.76	-0.8614	-0.969	1922693	CBDivE_015591	O=C1CC(N2CCN(Cc3ccc4OCOc4c3)CC2)C(=O)N1c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L12	compound treatment	1.298	0.0294	0.4	1.219	0.0129	0.18	0.4049	0.9337	1922694	CBDivE_015592	C/C(=N\NC(=S)Nc1ccc(C)cc1)/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L13	compound treatment	1.288	0.0194	0.26	1.232	0.0259	0.35	0.4349	0.9889	1922695	CBDivE_015593	COc1cccc(c1)C(=O)NNC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L14	compound treatment	1.292	0.0234	0.32	1.198	-0.00805	-0.11	0.1452	0.4351	1922696	CBDivE_015594	C/C(=N/NC(=S)Nc1ccc(C)cc1)/c2cccc(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L15	compound treatment	1.228	-0.0406	-0.55	1.158	-0.0481	-0.66	-0.851	-0.9961	1922697	CBDivE_015595	COc1cccc(c1)C(=O)NNC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L16	compound treatment	1.263	-0.00564	-0.08	1.18	-0.0261	-0.36	-0.305	-0.8394	1922698	CBDivE_015596	Clc1cc(/N=C/c2ccc[nH]2)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L17	compound treatment	1.296	0.0274	0.37	1.229	0.0229	0.31	0.4823	0.9966	1922699	CBDivE_015597	Oc1ccc(/C=N/c2ccc(cc2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L18	compound treatment	1.242	-0.0266	-0.36	1.157	-0.0491	-0.67	-0.7271	-0.9575	1922700	CBDivE_015598	Oc1cccc(/C=N/NC(=O)c2cc(O)cc(O)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L19	compound treatment	1.222	-0.0466	-0.63	1.156	-0.0501	-0.68	-0.9275	-0.9992	1922701	CBDivE_015599	CC(=O)Nc1ccc(cc1)C(=O)NNC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	L20	compound treatment	1.275	0.00636	0.09	1.205	-0.00105	-0.01	0.0505	0.5807	1922702	CBDivE_015600	COc1ccc(/C=N/NC(=S)Nc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M01	compound treatment	1.285	0.0164	0.22	1.218	0.0119	0.16	0.2713	0.9888	1528554	CBDivE_015601	CC(NC(=O)c1ccco1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M02	compound treatment	1.228	-0.0406	-0.55	1.15	-0.0561	-0.76	-0.9281	-0.9867	1922703	CBDivE_015602	Cc1ccccc1NC(=O)c2cc(/C=N/c3cccc(Cl)c3)c4ccccc4c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M03	compound treatment	1.292	0.0234	0.32	1.188	-0.0181	-0.25	0.0488	0.122	1922704	CBDivE_015603	CCCCCCCC(=O)NNC(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M04	compound treatment	1.272	0.00336	0.05	1.207	9.47E-4	0.01	0.0412	0.8736	1922705	CBDivE_015604	CC[n+]1c2ccccc2nc3ccc(NCCO)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M05	compound treatment	1.243	-0.0256	-0.35	1.185	-0.0211	-0.29	-0.4476	-0.9957	1922706	CBDivE_015605	CN(C)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)N\N=C\c3ccc(cc3)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M06	compound treatment	1.226	-0.0426	-0.58	1.16	-0.0461	-0.63	-0.8508	-0.999	1922707	CBDivE_015606	CC(C)C(N1C(=O)/C(=C/c2ccc(Cl)cc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M07	compound treatment	1.283	0.0144	0.19	1.167	-0.0391	-0.53	-0.2395	-0.4227	1922708	CBDivE_015607	CCSC(C)CC1CC(=O)/C(=C\Nc2ccc(Cl)c(Cl)c2)/C(=O)C1C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M08	compound treatment	1.236	-0.0326	-0.44	1.186	-0.0201	-0.27	-0.5047	-0.9738	1922709	CBDivE_015608	CCOC(=O)C1=C(NC(=O)NC1c2ccccc2)C(Br)Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M09	compound treatment	1.264	-0.00464	-0.06	1.151	-0.0551	-0.75	-0.5751	-0.7634	1922710	CBDivE_015609	COc1ccc(cc1)S(=O)(=O)N/N=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M10	compound treatment	1.256	-0.0126	-0.17	1.229	0.0229	0.31	0.1007	0.2827	1221065	CBDivE_015610	CN(C)CCOC(=O)c1ccc2n(Cc3ccccc3)c(C)c(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M11	compound treatment	1.289	0.0204	0.27	1.198	-0.00805	-0.11	0.1166	0.3941	1922711	CBDivE_015611	Clc1cccc(c1)C(=O)NNC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M12	compound treatment	1.296	0.0274	0.37	1.229	0.0229	0.31	0.4823	0.9966	1018245	CBDivE_015612	CCN(CC)C(=O)C(c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M13	compound treatment	1.264	-0.00464	-0.06	1.195	-0.0111	-0.15	-0.1508	-0.9241	1922712	CBDivE_015613	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M14	compound treatment	1.299	0.0304	0.41	1.271	0.0649	0.89	0.9159	0.9386	1009548	CBDivE_015614	Nc1cc2c(cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M15	compound treatment	1.261	-0.00764	-0.1	1.198	-0.00805	-0.11	-0.1505	-0.9995	1922713	CBDivE_015615	CCCCCCCCNC(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M16	compound treatment	1.269	3.64E-4	0.0	1.205	-0.00105	-0.01	-0.0067	-0.4406	1922714	CBDivE_015616	OC(=O)/C=C/C(=O)Nc1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M17	compound treatment	1.269	3.64E-4	0.0	1.201	-0.00505	-0.07	-0.0453	-0.6551	1922715	CBDivE_015617	[O-][N+](=O)c1cccc(c1)C(=O)NNC(=O)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M18	compound treatment	1.262	-0.00664	-0.09	1.222	0.0159	0.22	0.0905	0.3847	1922716	CBDivE_015618	CCO/N=C/C1C(=O)CC(C)(C)C(Cl)(C(=O)OC)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M19	compound treatment	1.256	-0.0126	-0.17	1.184	-0.0221	-0.3	-0.3332	-0.9639	1417285	CBDivE_015619	Cc1ccc2n(CCN(Cc3ccccc3)Cc4ccccc4)c5C(=O)CCCc5c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	M20	compound treatment	1.267	-0.00164	-0.02	1.242	0.0359	0.49	0.331	0.6746	1922717	CBDivE_015620	Cc1ccc(o1)c2c(C)[n+]([O-])c3CCCCc3[n+]2[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N01	compound treatment	1.24	-0.0286	-0.39	1.185	-0.0211	-0.29	-0.4762	-0.9893	1922718	CBDivE_015621	CCCCCCCC(=O)NNC(=O)c1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N02	compound treatment	1.236	-0.0326	-0.44	1.149	-0.0571	-0.78	-0.8615	-0.9637	1922719	CBDivE_015622	Cc1ccc(/N=C/c2ccc(O)cc2)cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N03	compound treatment	1.223	-0.0456	-0.62	1.152	-0.0541	-0.74	-0.9565	-0.996	1022542	CBDivE_015623	COc1ccc2[nH]c(cc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N04	compound treatment	1.248	-0.0206	-0.28	1.134	-0.0721	-0.98	-0.8916	-0.8731	1922720	CBDivE_015624	[O-][N+](=O)c1cc(/N=C/c2ccc[nH]2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N05	compound treatment	1.23	-0.0386	-0.52	1.179	-0.0271	-0.37	-0.6294	-0.9857	1922721	CBDivE_015625	OC(=O)CCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N06	compound treatment	1.221	-0.0476	-0.64	1.128	-0.0781	-1.06	-1.207	-0.9708	1922722	CBDivE_015626	Oc1ccccc1c2[nH]c(nc2C(=O)N3CCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N07	compound treatment	1.241	-0.0276	-0.37	1.176	-0.0301	-0.41	-0.5534	-0.9989	2709	CBDivE_015627	Cc1ncc(CO)c(CO)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N08	compound treatment	1.232	-0.0366	-0.49	1.164	-0.0421	-0.57	-0.755	-0.9973	1922723	CBDivE_015628	Brc1cncc(c1)C(=O)NC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N09	compound treatment	1.266	-0.00264	-0.04	1.213	0.00695	0.09	0.0418	0.4134	1922724	CBDivE_015629	Brc1ccccc1C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N10	compound treatment	1.243	-0.0256	-0.35	1.183	-0.0231	-0.31	-0.4668	-0.9989	1922725	CBDivE_015630	[O-][N+](=O)c1ccc(cc1)C(=O)/C=C/2\Nc3ccccc3OC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N11	compound treatment	1.231	-0.0376	-0.51	1.168	-0.0381	-0.52	-0.726	-0.9999	1922726	CBDivE_015631	OCCN1CCN(CC1)C2CC(=O)N(C2=O)c3ccc(cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N12	compound treatment	1.259	-0.00964	-0.13	1.17	-0.0361	-0.49	-0.4396	-0.8644	1565284	CBDivE_015632	CN(C)c1ccc(cc1)C2N(Cc3ccccc3)CCN2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N13	compound treatment	1.28	0.0114	0.15	1.219	0.0129	0.18	0.2332	0.9975	1922727	CBDivE_015633	O=C(N/N=C/c1cccnc1)c2ccc(cc2)C(=O)N/N=C/c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N14	compound treatment	1.276	0.00736	0.1	1.178	-0.0281	-0.38	-0.2003	-0.5067	1186785	CBDivE_015634	O=C1CCCN1c2ccc(cc2)S(=O)(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N15	compound treatment	1.24	-0.0286	-0.39	1.176	-0.0301	-0.41	-0.563	-0.9996	1922728	CBDivE_015635	Nc1ccccc1C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N16	compound treatment	1.265	-0.00364	-0.05	1.185	-0.0211	-0.29	-0.2377	-0.8161	1342176	CBDivE_015636	CC1CCN(Cn2c(=S)oc3ccccc23)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N17	compound treatment	1.245	-0.0236	-0.32	1.155	-0.0511	-0.7	-0.7178	-0.9373	1922729	CBDivE_015637	Oc1ccc(/C=C/2\SC(=S)N(C2=O)c3ccc(O)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N18	compound treatment	1.246	-0.0226	-0.31	1.17	-0.0361	-0.49	-0.5636	-0.9738	1922730	CBDivE_015638	Oc1ccc(cc1)S(=O)(=O)c2ccc(Oc3ccc(cc3)C(=O)C(=O)c4ccccc4)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N19	compound treatment	1.267	-0.00164	-0.02	1.242	0.0359	0.49	0.331	0.6746	1922731	CBDivE_015639	Cc1onc2CC(CC(=O)c12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	N20	compound treatment	1.256	-0.0126	-0.17	1.183	-0.0231	-0.31	-0.3428	-0.9587	1922732	CBDivE_015640	OCCNC(=O)/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O01	compound treatment	1.286	0.0174	0.23	1.215	0.00895	0.12	0.2519	0.9538	1431722	CBDivE_015641	COc1ccccc1S(=O)(=O)c2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O02	compound treatment	1.311	0.0424	0.57	1.282	0.0759	1.04	1.1364	0.9607	1363876	CBDivE_015642	O=C(COCC(=O)N1CCCC1)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O03	compound treatment	1.321	0.0524	0.71	1.251	0.0449	0.61	0.9329	0.9975	1922733	CBDivE_015643	[O-][N+](=O)c1ccc(NNC(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O04	compound treatment	1.298	0.0294	0.4	1.248	0.0419	0.57	0.6846	0.9839	1922734	CBDivE_015644	Clc1ccc(OC(=O)COc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O05	compound treatment	1.31	0.0414	0.56	1.216	0.00995	0.14	0.4905	0.8541	1530806	CBDivE_015645	COc1cc(cc(OC)c1OC)C(=O)N2CCn3c4C2CCCc4c5cc(C)ccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O06	compound treatment	1.262	-0.00664	-0.09	1.189	-0.0171	-0.23	-0.2277	-0.9139	1922735	CBDivE_015646	O=C(CN1C(=O)/C(=C/c2ccccc2)/SC1=S)NN3C(=O)CSC3=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O07	compound treatment	1.282	0.0134	0.18	1.19	-0.0161	-0.22	-0.0273	-0.0963	1922736	CBDivE_015647	CN(/N=C\C=C\c1ccccc1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O08	compound treatment	1.267	-0.00164	-0.02	1.188	-0.0181	-0.25	-0.1897	-0.7674	1606413	CBDivE_015648	O=C(OCC(c1ccccc1)c2ccccc2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O09	compound treatment	1.338	0.0694	0.94	1.274	0.0679	0.93	1.3169	1.0	1922737	CBDivE_015649	CC(C)c1ccc(C)cc1OC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O10	compound treatment	1.29	0.0214	0.29	1.255	0.0489	0.67	0.6758	0.9295	1922738	CBDivE_015650	C/C(=N/Nc1nc(cc(n1)c2ccccc2)c3ccccc3)/c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O11	compound treatment	1.312	0.0434	0.59	1.193	-0.0131	-0.18	0.2878	0.4706	1111690	CBDivE_015651	COc1ccc(cc1)S(=O)(=O)c2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O12	compound treatment	1.374	0.105	1.42	1.274	0.0679	0.93	1.6603	0.9785	1922739	CBDivE_015652	Oc1ccccc1/C=C\2/SCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O13	compound treatment	1.329	0.0604	0.81	1.207	9.47E-4	0.01	0.585	0.7182	1922740	CBDivE_015653	CCCCOc1ccc(NC(=S)N2CCn3c4C2CCCc4c5cc(ccc35)C6CCCCC6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O14	compound treatment	1.309	0.0404	0.54	1.24	0.0339	0.46	0.7124	0.9967	1722165	CBDivE_015654	Oc1ccc2c(=O)c(coc2c1)c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O15	compound treatment	1.264	-0.00464	-0.06	1.24	0.0339	0.46	0.2831	0.6061	1922741	CBDivE_015655	Fc1ccc(/C=N/NC(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O16	compound treatment	1.315	0.0464	0.63	1.223	0.0169	0.23	0.6057	0.9083	1922742	CBDivE_015656	Clc1ccc(/C=N/c2ccc3N=C(c4ccccc4)c5cc(\N=C\c6ccc(Cl)cc6)ccc5N=C(c7ccccc7)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O17	compound treatment	1.314	0.0454	0.61	1.215	0.00895	0.12	0.519	0.8317	1922743	CBDivE_015657	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O18	compound treatment	1.284	0.0154	0.21	1.204	-0.00205	-0.03	0.1268	0.6061	1922744	CBDivE_015658	Cc1nc(c(C)o1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O19	compound treatment	1.319	0.0504	0.68	1.209	0.00295	0.04	0.5088	0.7476	1617656	CBDivE_015659	CC(C)OC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	O20	compound treatment	1.337	0.0684	0.92	1.308	0.102	1.39	1.6352	0.9801	1686069	CBDivE_015660	CCc1nn(C(=O)c2ccccc2)c3CC(C)(C)CC(=O)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P01	compound treatment	1.293	0.0244	0.33	1.231	0.0249	0.34	0.473	0.9999	1922745	CBDivE_015661	CCCCCCCC(=O)NNC(=O)c1cccc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P02	compound treatment	1.263	-0.00564	-0.08	1.165	-0.0411	-0.56	-0.4496	-0.7958	1922746	CBDivE_015662	COc1cccc(c1)C(=O)NNC(=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P03	compound treatment	1.297	0.0284	0.38	1.213	0.00695	0.09	0.3376	0.8563	1922747	CBDivE_015663	Clc1cccc(c1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P04	compound treatment	1.208	-0.0606	-0.82	1.103	-0.103	-1.41	-1.5721	-0.9668	1922748	CBDivE_015664	Cc1ccccc1S(=O)(=O)NC(=O)NS(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P05	compound treatment	1.283	0.0144	0.19	1.237	0.0309	0.42	0.4354	0.9377	1922749	CBDivE_015665	Oc1nnc(O)n1/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P06	compound treatment	1.271	0.00236	0.03	1.188	-0.0181	-0.25	-0.1515	-0.6104	1267337	CBDivE_015666	Cn1c(=N)n(CC(O)C2(CC3CC4CC(C3)C2)C4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P07	compound treatment	1.24	-0.0286	-0.39	1.154	-0.0521	-0.71	-0.7751	-0.9591	1111689	CBDivE_015667	COc1cccc(c1)S(=O)(=O)c2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P08	compound treatment	1.198	-0.0706	-0.95	1.102	-0.104	-1.42	-1.6771	-0.9812	1922750	CBDivE_015668	O=C(N/N=C/c1cccs1)c2ccc(cc2)C(=O)N/N=C/c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P09	compound treatment	1.226	-0.0426	-0.58	1.141	-0.0651	-0.89	-1.034	-0.978	1922751	CBDivE_015669	C/C(=N\NS(=O)(=O)c1ccc(C)cc1)/c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P10	compound treatment	0.579	-0.69	-9.3	0.841	-0.365	-4.98	-10.0987	-0.9571	1287397	CBDivE_015670	Cc1oc(nc1C2(CC3CC4CC(C3)C2)C4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P11	compound treatment	1.233	-0.0356	-0.48	1.154	-0.0521	-0.71	-0.8419	-0.982	1922752	CBDivE_015671	[O-][N+](=O)c1ccc(NNC(=O)C2(CC3CC4CC(C3)C2)C4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P12	compound treatment	1.292	0.0234	0.32	1.182	-0.0241	-0.33	-0.0091	-0.0199	1922753	CBDivE_015672	COc1cccc(c1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P13	compound treatment	1.202	-0.0666	-0.9	1.126	-0.0801	-1.09	-1.4076	-0.9953	1922754	CBDivE_015673	O=C(NCCCCc1ccccc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P14	compound treatment	1.278	0.00936	0.13	1.191	-0.0151	-0.21	-0.0558	-0.2316	1709807	CBDivE_015674	Cc1ccc(Nc2nc(cs2)c3ccc(F)cc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P15	compound treatment	1.211	-0.0576	-0.78	1.143	-0.0631	-0.86	-1.1578	-0.9987	1607366	CBDivE_015675	CCCC(=C1C(=O)CC(CC(C)SCC)CC1=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P16	compound treatment	1.256	-0.0126	-0.17	1.177	-0.0291	-0.4	-0.4007	-0.929	1922755	CBDivE_015676	CC1CCN(CC1)C2CC(=O)N(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P17	compound treatment	1.261	-0.00764	-0.1	1.223	0.0169	0.23	0.0906	0.3579	1922756	CBDivE_015677	CC(C)NC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P18	compound treatment	1.296	0.0274	0.37	1.215	0.00895	0.12	0.3473	0.8933	1257870	CBDivE_015678	O=C(COc1ccccc1)NCCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P19	compound treatment	1.284	0.0154	0.21	1.199	-0.00705	-0.1	0.0785	0.3438	1922757	CBDivE_015679	O=C(N/N=C/c1cccs1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.49	P20	compound treatment	1.334	0.0654	0.88	1.281	0.0749	1.02	1.3462	0.9973	1922758	CBDivE_015680	Oc1ccc(cc1)N2C(=O)/C(=C/c3ccc(cc3)[N+](=O)[O-])/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A01	compound treatment	1.27	-0.00929	-0.13	1.218	0.00972	0.13	0.005	0.0276	1432983	CBDivE_015681	O=C(CC1(CC2CC3CC(C2)C1)C3)N4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A02	compound treatment	1.273	-0.00629	-0.08	1.21	0.00172	0.02	-0.0435	-0.4936	1922759	CBDivE_015682	Clc1cccc(NC(=O)OCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A03	compound treatment	1.396	0.117	1.57	1.254	0.0457	0.62	1.5541	0.9178	1580324	CBDivE_015683	CCOC(=O)C1=C(C)NC(=S)N(C=O)C1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A04	compound treatment	1.317	0.0377	0.51	1.196	-0.0123	-0.17	0.2413	0.4505	1922760	CBDivE_015684	COc1ccc(cc1)C/2=NOC(=O)\C2=N/Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A05	compound treatment	1.306	0.0267	0.36	1.179	-0.0293	-0.4	-0.0276	-0.0513	1922761	CBDivE_015685	CC(=O)Oc1ccc(cc1)c2ccc(/C=N/c3ccc(cc3C)C4(CC5CC6CC(C5)C4)C6)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A06	compound treatment	1.288	0.00871	0.12	1.236	0.0277	0.38	0.3503	0.8851	1922762	CBDivE_015686	Clc1cccc(NC(=O)N(Cc2ccccc2)Cc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A07	compound treatment	1.282	0.00271	0.04	1.218	0.00972	0.13	0.1195	0.8695	1922763	CBDivE_015687	O=C(NNC(=O)c1cccs1)[C@H]2C[C@H]2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A08	compound treatment	1.289	0.00971	0.13	1.237	0.0287	0.39	0.3695	0.8948	1922764	CBDivE_015688	OC(=O)c1cc(/N=C/c2ccccc2O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A09	compound treatment	1.259	-0.0203	-0.27	1.203	-0.00528	-0.07	-0.2445	-0.8637	1085887	CBDivE_015689	COc1ccccc1NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A10	compound treatment	1.245	-0.0343	-0.46	1.161	-0.0473	-0.64	-0.7831	-0.9867	1214658	CBDivE_015690	Oc1ccc(CCNC(=O)c2c(NC(=O)c3ccccc3)sc4CCCCc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A11	compound treatment	1.283	0.00371	0.05	1.214	0.00572	0.08	0.0905	0.9769	1777638	CBDivE_015691	[O-][N+](=O)c1cc(ccc1Cl)C(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A12	compound treatment	1.311	0.0317	0.43	1.217	0.00872	0.12	0.3865	0.8706	1922765	CBDivE_015692	CC(=N)c1c(O)c2cc(ccc2oc1=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A13	compound treatment	1.326	0.0467	0.63	1.268	0.0597	0.81	1.0214	0.992	1922766	CBDivE_015693	Oc1ccccc1/C=N/c2ccc(cc2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A14	compound treatment	1.307	0.0277	0.37	1.243	0.0347	0.47	0.5991	0.9932	1922767	CBDivE_015694	C[n+]1ccc2ccccc2c1Cc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A15	compound treatment	1.295	0.0157	0.21	1.162	-0.0463	-0.63	-0.2965	-0.4453	1922768	CBDivE_015695	COc1ccc(cc1)C(=O)N/N=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A16	compound treatment	1.304	0.0247	0.33	1.234	0.0257	0.35	0.4837	0.9997	1922769	CBDivE_015696	NNC(=O)c1ccccc1NS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A17	compound treatment	1.239	-0.0403	-0.54	1.169	-0.0393	-0.54	-0.7632	-1.0	1922770	CBDivE_015697	Cc1cccc(c1)C(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A18	compound treatment	1.318	0.0387	0.52	1.293	0.0847	1.16	1.1861	0.9356	1922771	CBDivE_015698	Clc1cc(Cl)c2c(c3ccccc3)n(nc(c4ccccc4)c12)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A19	compound treatment	1.259	-0.0203	-0.27	1.156	-0.0523	-0.71	-0.6977	-0.9136	1922772	CBDivE_015699	Clc1cccc(c1)C(=O)NNC(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	A20	compound treatment	1.291	0.0117	0.16	1.251	0.0427	0.58	0.5236	0.8675	1922773	CBDivE_015700	C=CC/N=C/c1c(NC(=O)c2ccccc2)sc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B01	compound treatment	1.277	-0.00229	-0.03	1.201	-0.00728	-0.1	-0.0921	-0.8855	1075531	CBDivE_015701	OS(=O)(=O)c1cccc2c(cccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B02	compound treatment	1.282	0.00271	0.04	1.21	0.00172	0.02	0.0424	0.977	1922774	CBDivE_015702	Clc1ccc(/C=N/NC(=O)CSCc2cccc(Br)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B03	compound treatment	1.249	-0.0303	-0.41	1.184	-0.0243	-0.33	-0.5231	-0.9945	1213891	CBDivE_015703	O=C1CCCc2c1[nH]c3ccc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B04	compound treatment	1.31	0.0307	0.41	1.225	0.0167	0.23	0.4541	0.9604	1072756	CBDivE_015704	Brc1ccc(cc1)C(=O)C[n+]2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B05	compound treatment	1.288	0.00871	0.12	1.255	0.0467	0.64	0.5335	0.8236	1436557	CBDivE_015705	O=C(Nc1ccc2ccccc2c1)N(Cc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B06	compound treatment	1.294	0.0147	0.2	1.234	0.0257	0.35	0.3883	0.9636	1922775	CBDivE_015706	C/C(=N\NC(=O)CSCc1cccc(Br)c1)/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B07	compound treatment	1.294	0.0147	0.2	1.224	0.0157	0.21	0.2918	0.9993	1922776	CBDivE_015707	CCOC(=O)C1=C(C)N=C(SC)N(C)C1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B08	compound treatment	1.294	0.0147	0.2	1.219	0.0107	0.15	0.2436	0.9887	1922777	CBDivE_015708	COc1ccc(cc1)/C(=N/NC(=O)CSCc2cccc(Br)c2)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B09	compound treatment	1.286	0.00671	0.09	1.23	0.0217	0.3	0.2734	0.8828	1922778	CBDivE_015709	COC(=O)c1cc2ccc(Br)cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B10	compound treatment	1.318	0.0387	0.52	1.314	0.106	1.44	1.3886	0.9056	1922779	CBDivE_015710	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc3c(NC(=O)c4cccc(c4)[N+](=O)[O-])cccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B11	compound treatment	1.277	-0.00229	-0.03	1.22	0.0117	0.16	0.0911	0.5597	1864899	CBDivE_015711	[O-][N+](=O)c1ccc(Sc2nc3ccccc3o2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B12	compound treatment	1.271	-0.00829	-0.11	1.189	-0.0193	-0.26	-0.2651	-0.9275	1922780	CBDivE_015712	Cc1[nH]c2ccccc2c1/C=N\NC(=O)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B13	compound treatment	1.261	-0.0183	-0.25	1.165	-0.0433	-0.59	-0.5919	-0.9252	1160800	CBDivE_015713	CC(Oc1ccc2c(C)cc(=O)oc2c1)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B14	compound treatment	1.301	0.0217	0.29	1.268	0.0597	0.81	0.7829	0.9047	1239336	CBDivE_015714	CCOP(OCC)N1CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B15	compound treatment	1.293	0.0137	0.18	1.218	0.00972	0.13	0.2244	0.9867	1683171	CBDivE_015715	COc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B16	compound treatment	1.266	-0.0133	-0.18	1.21	0.00172	0.02	-0.1103	-0.6096	1922781	CBDivE_015716	Cc1ccc(cc1)c2nc3sc(nc3s2)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B17	compound treatment	1.284	0.00471	0.06	1.253	0.0447	0.61	0.4761	0.7765	1922782	CBDivE_015717	Nc1nnnn1/N=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B18	compound treatment	1.261	-0.0183	-0.25	1.221	0.0127	0.17	-0.0519	-0.172	1922783	CBDivE_015718	[O-][N+](=O)c1cc(Cl)ccc1NC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B19	compound treatment	1.263	-0.0163	-0.22	1.225	0.0167	0.23	0.0058	0.0182	1500747	CBDivE_015719	Cc1cc(C)c(c(C)c1)S(=O)(=O)n2cnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	B20	compound treatment	1.275	-0.00429	-0.06	1.221	0.0127	0.17	0.0817	0.4466	1104643	CBDivE_015720	Clc1ccc(NCC(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C01	compound treatment	1.255	-0.0243	-0.33	1.154	-0.0543	-0.74	-0.7552	-0.9328	1300346	CBDivE_015721	Clc1ccc(C(=O)NCc2cccnc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C02	compound treatment	1.274	-0.00529	-0.07	1.25	0.0417	0.57	0.3518	0.6135	1922784	CBDivE_015722	Cc1ccc2n(C)c3/C(=N/O)/CCCc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C03	compound treatment	1.314	0.0347	0.47	1.206	-0.00228	-0.03	0.3091	0.6587	1922785	CBDivE_015723	[O-][N+](=O)c1ccc(cc1)C(=O)NNC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C04	compound treatment	1.316	0.0367	0.5	1.249	0.0407	0.56	0.7428	0.9984	1461595	CBDivE_015724	Cc1[nH]nc(c1Oc2ccc(Cl)cc2Cl)c3ccc(OCC(=O)O)cc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C05	compound treatment	1.28	7.05E-4	0.01	1.191	-0.0173	-0.24	-0.1599	-0.678	1922786	CBDivE_015725	Clc1ccc(cc1)C(=O)NNC(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C06	compound treatment	1.298	0.0187	0.25	1.241	0.0327	0.45	0.4939	0.9636	1718584	CBDivE_015726	CC(C)(C)NC(=O)c1ccc(cc1)C(=O)NC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C07	compound treatment	1.285	0.00571	0.08	1.208	-2.82E-4	0.0	0.0517	0.6709	1922787	CBDivE_015727	CC(=NNC(=O)C1CC1(c2ccccc2)c3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C08	compound treatment	1.294	0.0147	0.2	1.249	0.0407	0.56	0.5329	0.9038	1922788	CBDivE_015728	CCSc1nc(=O)n(c(C)c1C(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C09	compound treatment	1.273	-0.00629	-0.08	1.149	-0.0593	-0.81	-0.6317	-0.7771	1922789	CBDivE_015729	Clc1nc2ccccc2cc1/C=N/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C10	compound treatment	1.351	0.0717	0.97	1.266	0.0577	0.79	1.2406	0.9948	1774595	CBDivE_015730	OC1(CCCC1)c2ccc3n4CCN(Cc5ccccc5)C6CCCc(c64)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C11	compound treatment	1.326	0.0467	0.63	1.232	0.0237	0.32	0.6742	0.952	1922790	CBDivE_015731	Clc1ccc(/C=N/NC(=O)C2CC2(c3ccccc3)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C12	compound treatment	1.35	0.0707	0.95	1.257	0.0487	0.66	1.1442	0.9844	1346356	CBDivE_015732	COc1cccc(CCNC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C13	compound treatment	1.321	0.0417	0.56	1.194	-0.0143	-0.19	0.2601	0.4369	1922791	CBDivE_015733	Brc1ccc(cc1)C(=O)/C=C/2\NCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C14	compound treatment	1.321	0.0417	0.56	1.239	0.0307	0.42	0.694	0.9894	1922792	CBDivE_015734	CC(N/C=C\1/C2CCC(C)(C1=O)C2(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C15	compound treatment	1.353	0.0737	0.99	1.264	0.0557	0.76	1.2404	0.9912	1922793	CBDivE_015735	O=C(/C=C/1\NCCNC1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C16	compound treatment	1.321	0.0417	0.56	1.24	0.0317	0.43	0.7037	0.9916	1922794	CBDivE_015736	CC(Cc1c[nH]c2ccccc12)NCc3ccc(cc3)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C17	compound treatment	1.275	-0.00429	-0.06	1.184	-0.0243	-0.33	-0.2751	-0.8184	1922795	CBDivE_015737	Clc1ccc(cc1)C(=O)/C=C/2\NCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C18	compound treatment	1.299	0.0197	0.27	1.233	0.0247	0.34	0.4263	0.9931	1922796	CBDivE_015738	COC(=O)C(CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C19	compound treatment	1.277	-0.00229	-0.03	1.179	-0.0293	-0.4	-0.3042	-0.7596	1774988	CBDivE_015739	COC(=O)Oc1c(cc(cc1[N+](=O)[O-])N2CCCC2=O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	C20	compound treatment	1.295	0.0157	0.21	1.195	-0.0133	-0.18	0.0217	0.078	1922797	CBDivE_015740	[O-][N+](=O)c1cccc(NN=C2C(=O)NC(=S)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D01	compound treatment	1.261	-0.0183	-0.25	1.207	-0.00128	-0.02	-0.1869	-0.7553	1922798	CBDivE_015741	CC(=O)c1ccc(NS(=O)(=O)c2c(C)cc(C)cc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D02	compound treatment	1.235	-0.0443	-0.6	1.176	-0.0323	-0.44	-0.7338	-0.9887	1922799	CBDivE_015742	CC(C)NC(=O)CSCc1cccc(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D03	compound treatment	1.255	-0.0243	-0.33	1.18	-0.0283	-0.39	-0.5045	-0.9967	1922800	CBDivE_015743	CC(=O)CSc1nc2ccccc2o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D04	compound treatment	1.261	-0.0183	-0.25	1.181	-0.0273	-0.37	-0.4376	-0.9801	1922801	CBDivE_015744	CC1OC(CC(=C1)C)c2ccc(OCC(O)CN3CCCCC3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D05	compound treatment	1.28	7.05E-4	0.01	1.184	-0.0243	-0.33	-0.2274	-0.6865	1186021	CBDivE_015745	Cc1ccc(cc1)n2nc(cc2N)c3ccc(N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D06	compound treatment	1.293	0.0137	0.18	1.216	0.00772	0.11	0.2052	0.9643	1922802	CBDivE_015746	C(c1nc2ccccc2o1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D07	compound treatment	1.272	-0.00729	-0.1	1.233	0.0247	0.34	0.1688	0.4806	1922803	CBDivE_015747	Cc1cc(ccc1NC(=O)c2ccc(cc2)C(C)(C)C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D08	compound treatment	1.279	-2.95E-4	0.0	1.183	-0.0253	-0.34	-0.2466	-0.7152	1460682	CBDivE_015748	COC(=O)c1ccccc1NC2CC3=C(CC2(C)C)C(C)(C)CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D09	compound treatment	1.302	0.0227	0.31	1.23	0.0217	0.3	0.426	0.9999	1074541	CBDivE_015749	COc1ccccc1N2C(=O)CSC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D10	compound treatment	1.282	0.00271	0.04	1.188	-0.0203	-0.28	-0.1698	-0.6085	1922804	CBDivE_015750	Brc1cccc(CSCC(=O)N/N=C/c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D11	compound treatment	1.295	0.0157	0.21	1.184	-0.0243	-0.33	-0.0843	-0.2145	1922805	CBDivE_015751	Cc1ccccc1N2C(=O)/C(=C\3/C(=O)Nc4ccc(Br)cc34)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D12	compound treatment	1.302	0.0227	0.31	1.222	0.0137	0.19	0.3489	0.972	1922806	CBDivE_015752	Cc1ccccc1NCCNc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D13	compound treatment	1.319	0.0397	0.54	1.264	0.0557	0.76	0.916	0.9854	1922807	CBDivE_015753	C1Oc2ccc(/C=N/c3ccc(\N=C\c4ccc5OCOc5c4)cc3)cc2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D14	compound treatment	1.321	0.0417	0.56	1.237	0.0287	0.39	0.6748	0.9843	1922808	CBDivE_015754	CC(=CCC(C)(C)CN(C(=O)C)c1ccccc1)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D15	compound treatment	1.271	-0.00829	-0.11	1.156	-0.0523	-0.71	-0.5833	-0.8082	1922809	CBDivE_015755	COC(=O)c1ccc(cc1)N2Cc3ccccc3CC2=N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D16	compound treatment	1.303	0.0237	0.32	1.232	0.0237	0.32	0.4548	1.0	1922810	CBDivE_015756	FC(F)(C(=O)NNC(=O)c1ccco1)C2(F)OC(F)(F)C(F)(F)C2(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D17	compound treatment	1.287	0.00771	0.1	1.205	-0.00328	-0.04	0.0419	0.3698	1922811	CBDivE_015757	Clc1ccc(cc1)S(=O)(=O)Nc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D18	compound treatment	1.279	-2.95E-4	0.0	1.216	0.00772	0.11	0.0716	0.6799	1922812	CBDivE_015758	CC1=C(C)OC(C)(CC1)C(=O)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D19	compound treatment	1.303	0.0237	0.32	1.214	0.00572	0.08	0.2813	0.8545	1922813	CBDivE_015759	NN1C(=O)/C(=C\c2cccc(c2)[N+](=O)[O-])/SC1=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	D20	compound treatment	1.296	0.0167	0.23	1.239	0.0307	0.42	0.4556	0.9577	1922814	CBDivE_015760	CC/1=NNC(=O)\C1=N\Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E01	compound treatment	1.242	-0.0373	-0.5	1.149	-0.0593	-0.81	-0.9274	-0.974	1922815	CBDivE_015761	COc1ccc([C@H]2NCC[C@@]3(O)CCCC[C@H]23)c(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E02	compound treatment	1.305	0.0257	0.35	1.251	0.0427	0.58	0.6571	0.9693	1922816	CBDivE_015762	Cc1nn(c(Cl)c1S(=O)(=O)O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E03	compound treatment	1.271	-0.00829	-0.11	1.214	0.00572	0.08	-0.024	-0.1759	1922817	CBDivE_015763	Clc1ccc(/C=N/OC(=O)c2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E04	compound treatment	1.271	-0.00829	-0.11	1.251	0.0427	0.58	0.3328	0.561	1922818	CBDivE_015764	Cc1ccc(NN=C2C(=O)NC(=S)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E05	compound treatment	1.255	-0.0243	-0.33	1.199	-0.00928	-0.13	-0.3213	-0.9144	1922819	CBDivE_015765	CC(C)(C)C1=CC(=C(C(=O)C1=O)C(C)(C)C)Nc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E06	compound treatment	1.263	-0.0163	-0.22	1.215	0.00672	0.09	-0.0907	-0.3807	1922820	CBDivE_015766	CCCNC(=O)c1ccc(cc1)C(=O)NCCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E07	compound treatment	1.269	-0.0103	-0.14	1.202	-0.00628	-0.09	-0.1588	-0.973	1173156	CBDivE_015767	O=c1[nH]nc(Sc2ncnc3[nH]cnc23)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E08	compound treatment	1.284	0.00471	0.06	1.238	0.0297	0.41	0.3314	0.808	1922821	CBDivE_015768	CC1(C)CC(=C/C(=N\Nc2ccccn2)/C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E09	compound treatment	1.282	0.00271	0.04	1.23	0.0217	0.3	0.2352	0.7883	1077865	CBDivE_015769	CC[n+]1ccc2cc(OC)c(OC)cc2c1Cc3ccc(OC)c(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E10	compound treatment	1.306	0.0267	0.36	1.233	0.0247	0.34	0.4931	0.9994	1279518	CBDivE_015770	Nc1cnn(C2OC(COC(=O)c3ccccc3)C(O)C2O)c(=O)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E11	compound treatment	1.271	-0.00829	-0.11	1.155	-0.0533	-0.73	-0.5929	-0.8065	1922822	CBDivE_015771	Clc1ccc(NC(=O)N(Cc2ccccc2)Cc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E12	compound treatment	1.295	0.0157	0.21	1.243	0.0347	0.47	0.4846	0.9343	1122556	CBDivE_015772	c1[nH]c2ccccc2c1c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E13	compound treatment	1.265	-0.0143	-0.19	1.179	-0.0293	-0.4	-0.4187	-0.9443	1352774	CBDivE_015773	COc1nc(OC)nc(n1)N(C)CCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E14	compound treatment	1.299	0.0197	0.27	1.241	0.0327	0.45	0.5035	0.9694	1922823	CBDivE_015774	O=C(NC(=S)N1CCOCC1)/C=C/c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E15	compound treatment	1.272	-0.00729	-0.1	1.173	-0.0353	-0.48	-0.4098	-0.8345	1530771	CBDivE_015775	C[N+]1(CC(O)CO)CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E16	compound treatment	1.302	0.0227	0.31	1.25	0.0417	0.57	0.6189	0.9578	1922824	CBDivE_015776	Cc1nnc(o1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E17	compound treatment	1.287	0.00771	0.1	1.189	-0.0193	-0.26	-0.1124	-0.3976	1697826	CBDivE_015777	Oc1c(Br)ccc2c1sc3nc4CCCCCn4c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E18	compound treatment	1.339	0.0597	0.81	1.228	0.0197	0.27	0.7597	0.8946	1922825	CBDivE_015778	CC[n+]1c2ccccc2nc3ccc(N)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E19	compound treatment	1.275	-0.00429	-0.06	1.21	0.00172	0.02	-0.0244	-0.3905	1517211	CBDivE_015779	Clc1ccccc1S(=O)(=O)NC(=O)n2c3CCCCc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	E20	compound treatment	1.297	0.0177	0.24	1.251	0.0427	0.58	0.5808	0.9225	1922826	CBDivE_015780	CC[n+]1c2ccccc2nc3ccc(cc13)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F01	compound treatment	1.215	-0.0643	-0.87	1.149	-0.0593	-0.81	-1.185	-0.9994	1922827	CBDivE_015781	Cc1ccc(cc1)N2C(=O)/C(=C/c3ccc(cc3)[N+](=O)[O-])/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F02	compound treatment	1.239	-0.0403	-0.54	1.171	-0.0373	-0.51	-0.7439	-0.9994	1922828	CBDivE_015782	OCCCCC1OC2CCCCC2C3=CCCCC13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F03	compound treatment	1.252	-0.0273	-0.37	1.173	-0.0353	-0.48	-0.6006	-0.9913	1922829	CBDivE_015783	CCN(C(=O)c1cccs1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F04	compound treatment	1.247	-0.0323	-0.44	1.17	-0.0383	-0.52	-0.6772	-0.996	1922830	CBDivE_015784	Brc1ccc(NN=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F05	compound treatment	1.273	-0.00629	-0.08	1.255	0.0467	0.64	0.3904	0.6075	1922831	CBDivE_015785	CC(C)(C)c1cc([nH]n1)c2cc([nH]n2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F06	compound treatment	1.256	-0.0233	-0.31	1.171	-0.0373	-0.51	-0.5817	-0.9733	1922832	CBDivE_015786	[O-][N+](=O)c1ccc(N/N=C\2/C(=O)NC(=O)N(C2=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F07	compound treatment	1.249	-0.0303	-0.41	1.174	-0.0343	-0.47	-0.6196	-0.9978	1922833	CBDivE_015787	Oc1ccc(/N=C/c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F08	compound treatment	1.258	-0.0213	-0.29	1.184	-0.0243	-0.33	-0.4373	-0.9975	1417975	CBDivE_015788	COc1ccccc1NCC(C)(C)CC=C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F09	compound treatment	1.248	-0.0313	-0.42	1.191	-0.0173	-0.24	-0.4652	-0.9621	1922834	CBDivE_015789	Cc1ccccc1Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F10	compound treatment	1.319	0.0397	0.54	1.288	0.0797	1.09	1.1474	0.9468	1922835	CBDivE_015790	CC(=CCC/C(=C/CC(C)(C)C1OCCN1C(=O)C)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F11	compound treatment	1.326	0.0467	0.63	1.295	0.0867	1.18	1.2817	0.9566	1922836	CBDivE_015791	C(=N/c1ccc(cc1)c2ccc(\N=C\c3cccs3)cc2)\c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F12	compound treatment	1.301	0.0217	0.29	1.291	0.0827	1.13	1.0047	0.8621	1922837	CBDivE_015792	COc1ccccc1N(CC(C)(C)CC=C(C)C)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F13	compound treatment	1.265	-0.0143	-0.19	1.207	-0.00128	-0.02	-0.1487	-0.7681	1656070	CBDivE_015793	COc1cccc(OC)c1C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F14	compound treatment	1.26	-0.0193	-0.26	1.187	-0.0213	-0.29	-0.3893	-0.9985	1922838	CBDivE_015794	CCOC(=O)CCCCNC(O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F15	compound treatment	1.286	0.00671	0.09	1.187	-0.0213	-0.29	-0.1412	-0.4647	1922839	CBDivE_015795	O=C(NC1C[C@@H]1c2ccccc2)[C@@H]3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F16	compound treatment	1.309	0.0297	0.4	1.244	0.0357	0.49	0.6278	0.9953	1922840	CBDivE_015796	CCOP(=S)(OCC)OCC1(COP(=S)(OCC)OCC)CCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F17	compound treatment	1.282	0.00271	0.04	1.19	-0.0183	-0.25	-0.1505	-0.5972	1922841	CBDivE_015797	CCOC(=O)c1cccc(N=Nc2c(C)nn(c2O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F18	compound treatment	1.315	0.0357	0.48	1.232	0.0237	0.32	0.5693	0.9812	1922842	CBDivE_015798	Cc1[nH]c2ccccc2c1/C=N/NC(=O)COc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F19	compound treatment	1.259	-0.0203	-0.27	1.185	-0.0233	-0.32	-0.4181	-0.9973	1922843	CBDivE_015799	CC(C)CC(O)CNC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	F20	compound treatment	1.266	-0.0133	-0.18	1.239	0.0307	0.42	0.1694	0.3717	1922844	CBDivE_015800	CCOC(=O)C(C(=O)N)c1ccccn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G01	compound treatment	1.227	-0.0523	-0.71	1.182	-0.0263	-0.36	-0.7523	-0.9507	1922845	CBDivE_015801	[O-][N+](=O)c1cccc(c1)/C(=N/OC(=O)c2ccccc2)/NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G02	compound treatment	1.231	-0.0483	-0.65	1.203	-0.00528	-0.07	-0.5116	-0.7805	1922846	CBDivE_015802	c1nc2cc3nc4ccccc4nc3cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G03	compound treatment	1.261	-0.0183	-0.25	1.192	-0.0163	-0.22	-0.3315	-0.9986	1785740	CBDivE_015803	[O-][N+](=O)c1ccccc1S(=O)(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G04	compound treatment	1.258	-0.0213	-0.29	1.222	0.0137	0.19	-0.0709	-0.2067	1057925	CBDivE_015804	Oc1ccc(O)c2C3c4ccccc4C(c5ccccc35)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G05	compound treatment	1.265	-0.0143	-0.19	1.176	-0.0323	-0.44	-0.4476	-0.9314	1922847	CBDivE_015805	CCN(CC)CCC(=O)C=C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G06	compound treatment	1.274	-0.00529	-0.07	1.217	0.00872	0.12	0.0336	0.2419	1922848	CBDivE_015806	Cc1cccc(c1)c2ccc(/C=N/O)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G07	compound treatment	1.239	-0.0403	-0.54	1.22	0.0117	0.16	-0.2714	-0.479	1175914	CBDivE_015807	CC(C)C(=O)N1C2CCN(C)CC2c3cc(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G08	compound treatment	1.277	-0.00229	-0.03	1.223	0.0147	0.2	0.12	0.5911	1922849	CBDivE_015808	OC(c1ccccc1)C(F)(F)C2(F)OC(F)(F)C(F)(F)C2(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G09	compound treatment	1.295	0.0157	0.21	1.215	0.00672	0.09	0.2146	0.9297	1922850	CBDivE_015809	Cc1ccc(NC(=S)N/N=C/c2ccc(s2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G10	compound treatment	1.337	0.0577	0.78	1.228	0.0197	0.27	0.7406	0.8992	1922851	CBDivE_015810	Cc1ccc(cc1)S(=O)(=O)N/N=C(\c2ccccc2)/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G11	compound treatment	1.314	0.0347	0.47	1.18	-0.0283	-0.39	0.0584	0.0962	1922852	CBDivE_015811	ClC(Cl)(Cl)C(=O)NC(=O)NC1CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G12	compound treatment	1.329	0.0497	0.67	1.289	0.0807	1.1	1.2525	0.9718	1922853	CBDivE_015812	CC(=O)/C(=N\Nc1ccc(Br)cc1)/C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G13	compound treatment	1.266	-0.0133	-0.18	1.154	-0.0543	-0.74	-0.6502	-0.8537	1922854	CBDivE_015813	O=c1[nH]c2CCCc2c(=O)n1C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G14	compound treatment	1.35	0.0707	0.95	1.304	0.0957	1.31	1.5974	0.9881	1922855	CBDivE_015814	CCN(CC)CCNC(=O)c1cc([N+](=O)[O-])c(cc1OC)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G15	compound treatment	1.289	0.00971	0.13	1.192	-0.0163	-0.22	-0.0644	-0.2499	1922856	CBDivE_015815	Ic1ccccc1C(=O)NN=C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G16	compound treatment	1.27	-0.00929	-0.13	1.216	0.00772	0.11	-0.0142	-0.087	1922857	CBDivE_015816	CC(C)(C)NC(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G17	compound treatment	1.327	0.0477	0.64	1.26	0.0517	0.71	0.9538	0.999	1922858	CBDivE_015817	CN1CCN(Cc2n[nH]c(=S)n2c3ccccc3Cl)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G18	compound treatment	1.347	0.0677	0.91	1.247	0.0387	0.53	1.0192	0.9661	1922859	CBDivE_015818	Oc1ccccc1/C=C/NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G19	compound treatment	1.331	0.0517	0.7	1.233	0.0247	0.34	0.7316	0.9443	1684390	CBDivE_015819	Cc1ccc(cc1)C(O)(COc2ccc(F)cc2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	G20	compound treatment	1.293	0.0137	0.18	1.245	0.0367	0.5	0.4848	0.9083	1563267	CBDivE_015820	COc1cccc(C2NCCc3cc(OC)c(OC)cc23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H01	compound treatment	1.224	-0.0553	-0.75	1.17	-0.0383	-0.52	-0.8966	-0.9848	1922860	CBDivE_015821	COc1ccc(/C=N/C2C3CCCCC23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H02	compound treatment	1.24	-0.0393	-0.53	1.177	-0.0313	-0.43	-0.6765	-0.9942	1610201	CBDivE_015822	Cc1ccc(NC2=CC(=O)CC(C)(C)C2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H03	compound treatment	1.236	-0.0433	-0.58	1.195	-0.0133	-0.18	-0.5411	-0.8848	1922861	CBDivE_015823	Cc1ccc(cc1N)C(=O)C(=O)c2ccc(C)c(N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H04	compound treatment	1.234	-0.0453	-0.61	1.17	-0.0383	-0.52	-0.8012	-0.9969	1922862	CBDivE_015824	CC1(C)CC(=O)C=C(C1)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H05	compound treatment	1.278	-0.00129	-0.02	1.234	0.0257	0.35	0.2356	0.6711	1922863	CBDivE_015825	Clc1ccc(/C=N/n2cnnc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H06	compound treatment	1.13	-0.149	-2.01	1.165	-0.0433	-0.59	-1.8415	-0.8774	1922864	CBDivE_015826	COc1ccccc1NC2=CC(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H07	compound treatment	1.3	0.0207	0.28	1.222	0.0137	0.19	0.3298	0.981	1922865	CBDivE_015827	OC(=O)C1CC=CC[C@@H]1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H08	compound treatment	1.285	0.00571	0.08	1.195	-0.0133	-0.18	-0.0736	-0.3742	1349443	CBDivE_015828	OC(=O)c1ccccc1C(=O)Nc2ccccc2C#Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H09	compound treatment	1.274	-0.00529	-0.07	1.192	-0.0163	-0.22	-0.2075	-0.8897	1922866	CBDivE_015829	Cc1cc(C)c(C(=O)/C=C/c2ccc(I)cc2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H10	compound treatment	1.295	0.0157	0.21	1.195	-0.0133	-0.18	0.0217	0.078	1922867	CBDivE_015830	CCCN1CCC2(CC1)NC(Cc3c2[nH]c4ccccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H11	compound treatment	1.293	0.0137	0.18	1.19	-0.0183	-0.25	-0.0455	-0.1467	1922868	CBDivE_015831	CC(=O)Oc1ccc2n(C)c(C)c(C(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H12	compound treatment	1.289	0.00971	0.13	1.178	-0.0303	-0.41	-0.1994	-0.4603	1219059	CBDivE_015832	COc1ccc(NC2=CC(=O)CC(C)(C)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H13	compound treatment	1.305	0.0257	0.35	1.291	0.0827	1.13	1.0428	0.8837	1922869	CBDivE_015833	CN1CC[C@@](O)([C@H]2CCCC[C@H]21)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H14	compound treatment	1.29	0.0107	0.14	1.235	0.0267	0.36	0.3597	0.9179	438	CBDivE_015834	CCOC(=O)C1=C(C)NC(=S)NC1c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H15	compound treatment	1.264	-0.0153	-0.21	1.192	-0.0163	-0.22	-0.3029	-0.9993	1922870	CBDivE_015835	Cc1cc(C)c(C(=O)/C=C/c2cccs2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H16	compound treatment	1.265	-0.0143	-0.19	1.194	-0.0143	-0.19	-0.2741	-1.0	1267572	CBDivE_015836	CC1(C)CC(=O)C=C(C1)Nc2ccc-3c(Cc4ccccc43)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H17	compound treatment	1.26	-0.0193	-0.26	1.202	-0.00628	-0.09	-0.2446	-0.8927	1922871	CBDivE_015837	C/C(=N/O)/C1=NCCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H18	compound treatment	1.278	-0.00129	-0.02	1.185	-0.0233	-0.32	-0.2368	-0.7449	1922872	CBDivE_015838	Clc1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccc5OCOc5c4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H19	compound treatment	1.238	-0.0413	-0.56	1.193	-0.0153	-0.21	-0.5413	-0.91	1922873	CBDivE_015839	CCCCOC(=O)N/N=C/C=C/c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	H20	compound treatment	1.296	0.0167	0.23	1.229	0.0207	0.28	0.3591	0.9937	1922874	CBDivE_015840	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(Cc4ccc5OCOc5c4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I01	compound treatment	1.25	-0.0293	-0.4	1.186	-0.0223	-0.3	-0.4943	-0.9916	1243544	CBDivE_015841	CCOc1ccc(cc1OC)C2(CC(=O)Nc3ccccc3)C(=O)c4ccccc4C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I02	compound treatment	1.262	-0.0173	-0.23	1.216	0.00772	0.11	-0.0906	-0.3538	1922875	CBDivE_015842	CCN(CC)C(=O)C1(CC2CC3C1)CC(C2)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I03	compound treatment	1.276	-0.00329	-0.04	1.196	-0.0123	-0.17	-0.1499	-0.8648	1922876	CBDivE_015843	Cc1[n+](C)ccc2c(cccc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I04	compound treatment	1.257	-0.0223	-0.3	1.205	-0.00328	-0.04	-0.2443	-0.8035	1922877	CBDivE_015844	Oc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I05	compound treatment	1.33	0.0507	0.68	1.248	0.0397	0.54	0.8667	0.9933	1922878	CBDivE_015845	OC(=O)c1cc(/N=C/c2cc(ccc2O)[N+](=O)[O-])ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I06	compound treatment	1.187	-0.0923	-1.25	1.202	-0.00628	-0.09	-0.941	-0.754	1922879	CBDivE_015846	Fc1ccc(/C=C/C(=O)NC(=S)N2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I07	compound treatment	1.245	-0.0343	-0.46	1.187	-0.0213	-0.29	-0.5324	-0.9748	1362445	CBDivE_015847	CCNC(=O)N1C2CCN(C)CC2c3cc(C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I08	compound treatment	1.273	-0.00629	-0.08	1.208	-2.82E-4	0.0	-0.0628	-0.7384	1922880	CBDivE_015848	CN(C)CCN1CCc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I09	compound treatment	1.268	-0.0113	-0.15	1.25	0.0417	0.57	0.2945	0.5001	1922881	CBDivE_015849	CC(=O)N1[C@@H](CSC1c2ccc(cc2)[N+](=O)[O-])C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I10	compound treatment	1.287	0.00771	0.1	1.211	0.00272	0.04	0.0997	0.9035	1361625	CBDivE_015850	CC(C)Nc1nc(Oc2ccccc2)nc(Oc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I11	compound treatment	1.274	-0.00529	-0.07	1.174	-0.0343	-0.47	-0.3811	-0.8058	1132518	CBDivE_015851	COc1ccc2n(C)c(C)c(C(=O)O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I12	compound treatment	1.287	0.00771	0.1	1.249	0.0407	0.56	0.4661	0.8252	1922882	CBDivE_015852	Cc1ccc(O)c(c1)C2=Nc3ccccc3C2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I13	compound treatment	1.317	0.0377	0.51	1.254	0.0457	0.62	0.8005	0.9949	1922883	CBDivE_015853	CCOc1ccc(/C=N/c2ccc3nc(C)[nH]c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I14	compound treatment	1.286	0.00671	0.09	1.236	0.0277	0.38	0.3312	0.8523	1922884	CBDivE_015854	CC1(C)CC(=O)CC(O)(O1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I15	compound treatment	1.26	-0.0193	-0.26	1.19	-0.0183	-0.25	-0.3603	-0.9998	1922885	CBDivE_015855	OCC/N=C/1\CCCc2c1[nH]c3ccc(F)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I16	compound treatment	1.306	0.0267	0.36	1.215	0.00672	0.09	0.3195	0.8596	1922886	CBDivE_015856	CCN(CC)C(=S)NC(=O)/C=C/c1ccc(F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I17	compound treatment	1.334	0.0547	0.74	1.231	0.0227	0.31	0.7409	0.9257	3024182	CBDivE_015857	CCCC1NCCn2cccc12.OC(=O)/C=C/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I18	compound treatment	1.311	0.0317	0.43	1.213	0.00472	0.06	0.3479	0.8044	1064168	CBDivE_015858	Cc1cc(C)[n+]2ccccc2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I19	compound treatment	1.291	0.0117	0.16	1.204	-0.00428	-0.06	0.0704	0.418	1922888	CBDivE_015859	Cc1ccc(O)c(/C=N/NC(=O)COc2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	I20	compound treatment	1.264	-0.0153	-0.21	1.226	0.0177	0.24	0.0249	0.0785	1922889	CBDivE_015860	Clc1ccc(NC(=O)N2CCC=CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J01	compound treatment	1.248	-0.0313	-0.42	1.204	-0.00428	-0.06	-0.3398	-0.7973	1922890	CBDivE_015861	FC(F)(F)c1nccc2n(Cc3ccccc3)ccc(=O)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J02	compound treatment	1.242	-0.0373	-0.5	1.188	-0.0203	-0.28	-0.5513	-0.9603	1922891	CBDivE_015862	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J03	compound treatment	1.258	-0.0213	-0.29	1.221	0.0127	0.17	-0.0805	-0.2399	1922892	CBDivE_015863	N/C(=N\C(NC(=O)c1ccc(Cl)cc1)C(Cl)(Cl)Cl)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J04	compound treatment	1.235	-0.0443	-0.6	1.168	-0.0403	-0.55	-0.811	-0.9991	1922893	CBDivE_015864	CCOc1ccc(cc1)N2C(=O)CC(N3CCN(C/C=C/c4ccccc4)CC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J05	compound treatment	1.259	-0.0203	-0.27	1.201	-0.00728	-0.1	-0.2638	-0.9058	1922894	CBDivE_015865	Cc1nc2ccc(/N=C/c3cc(ccc3O)[N+](=O)[O-])cc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J06	compound treatment	1.254	-0.0253	-0.34	1.179	-0.0293	-0.4	-0.5236	-0.9969	1922895	CBDivE_015866	CN1C(=O)CC(N2CCN(Cc3ccc4OCOc4c3)CC2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J07	compound treatment	1.265	-0.0143	-0.19	1.201	-0.00728	-0.1	-0.2066	-0.9524	1922896	CBDivE_015867	CN(c1cccc(c1)[N+](=O)[O-])S(=O)(=O)N(C)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J08	compound treatment	1.275	-0.00429	-0.06	1.185	-0.0233	-0.32	-0.2655	-0.8226	1922897	CBDivE_015868	O=C1CC(N2CCN(CC2)c3ccccn3)C(=O)N1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J09	compound treatment	1.248	-0.0313	-0.42	1.225	0.0167	0.23	-0.1373	-0.2862	1922898	CBDivE_015869	CNc1nc(OC)nc(OC(C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J10	compound treatment	1.254	-0.0253	-0.34	1.186	-0.0223	-0.3	-0.4561	-0.9983	1922899	CBDivE_015870	OC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccccn4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J11	compound treatment	1.321	0.0417	0.56	1.249	0.0407	0.56	0.7905	1.0	1922900	CBDivE_015871	OC(=O)C1C[C@H](Br)C(Br)C[C@@H]1Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J12	compound treatment	1.259	-0.0203	-0.27	1.165	-0.0433	-0.59	-0.6109	-0.939	1922901	CBDivE_015872	COc1ccc(cc1)C2CC(=NN2c3nc(cs3)c4ccc(cc4)c5ccccc5)c6ccc(OC)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J13	compound treatment	1.259	-0.0203	-0.27	1.192	-0.0163	-0.22	-0.3506	-0.9946	1922902	CBDivE_015873	Brc1ccc(/C=N/NC(=O)CCc2ccccc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J14	compound treatment	1.243	-0.0363	-0.49	1.147	-0.0613	-0.84	-0.9371	-0.9676	1922903	CBDivE_015874	CC1(C)CC(=O)C=C(C1)NCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J15	compound treatment	1.291	0.0117	0.16	1.231	0.0227	0.31	0.3307	0.9511	1922904	CBDivE_015875	O=S(=O)(N/N=C/c1cccnc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J16	compound treatment	1.251	-0.0283	-0.38	1.169	-0.0393	-0.54	-0.6487	-0.9862	1922905	CBDivE_015876	CC1(C)CC(=O)C(=CNCCCNC2CCCCC2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J17	compound treatment	1.281	0.00171	0.02	1.221	0.0127	0.17	0.1389	0.794	1695631	CBDivE_015877	Brc1ccc(cc1)S(=O)(=O)NC2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J18	compound treatment	1.316	0.0367	0.5	1.218	0.00972	0.13	0.4438	0.8659	1922906	CBDivE_015878	CC1(C)CC(=O)C=C(C1)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J19	compound treatment	1.255	-0.0243	-0.33	1.206	-0.00228	-0.03	-0.2538	-0.7708	1922907	CBDivE_015879	Brc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	J20	compound treatment	1.257	-0.0223	-0.3	1.183	-0.0253	-0.34	-0.4565	-0.9977	1922908	CBDivE_015880	CCCCCCC/N=C\c1c(C)[nH]n(c2nc3ccccc3s2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K01	compound treatment	1.259	-0.0203	-0.27	1.223	0.0147	0.2	-0.0517	-0.1522	1922909	CBDivE_015881	Cc1nc2sc3CCCCc3c2c(=S)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K02	compound treatment	1.252	-0.0273	-0.37	1.201	-0.00728	-0.1	-0.3306	-0.8668	1420118	CBDivE_015882	NC1(CC2CC3C1)CC(O)(C2)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K03	compound treatment	1.273	-0.00629	-0.08	1.196	-0.0123	-0.17	-0.1785	-0.9504	1922910	CBDivE_015883	OC(CC(=O)/C=C/c1ccccc1)(c2ccccc2)C(F)(F)C(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K04	compound treatment	1.263	-0.0163	-0.22	1.196	-0.0123	-0.17	-0.2739	-0.991	1922911	CBDivE_015884	Cc1ccc(cc1)N2C(=O)/C(=C\3/C(=O)Nc4ccccc34)/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K05	compound treatment	1.289	0.00971	0.13	1.205	-0.00328	-0.04	0.0609	0.4404	1922912	CBDivE_015885	OC(CC(=O)/C=C/c1ccccc1)(c2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K06	compound treatment	1.314	0.0347	0.47	1.258	0.0497	0.68	0.8105	0.9837	1922913	CBDivE_015886	OC(=O)C1CSC(N1)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K07	compound treatment	1.294	0.0147	0.2	1.165	-0.0433	-0.59	-0.2771	-0.445	1922914	CBDivE_015887	O=C1NN=C2CC34CCC12CC4=NNC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K08	compound treatment	1.294	0.0147	0.2	1.222	0.0137	0.19	0.2726	0.9996	1922915	CBDivE_015888	OC(CN1CCC(=CC1)/C=C/c2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K09	compound treatment	1.273	-0.00629	-0.08	1.186	-0.0223	-0.3	-0.2749	-0.8713	1922916	CBDivE_015889	CCCCCCc1cc(C=O)c(O)cc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K10	compound treatment	1.282	0.00271	0.04	1.268	0.0597	0.81	0.6016	0.7381	1922917	CBDivE_015890	CC/1=NN(C(=O)\C1=N/Nc2ccc(Cl)cc2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K11	compound treatment	1.289	0.00971	0.13	1.196	-0.0123	-0.17	-0.0258	-0.1216	1922918	CBDivE_015891	CC(=CC(=O)CC(O)(c1ccccc1)C(F)(F)C(F)F)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K12	compound treatment	1.299	0.0197	0.27	1.202	-0.00628	-0.09	0.1274	0.4561	1922919	CBDivE_015892	Fc1ccc(/C=C/2\SC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K13	compound treatment	1.309	0.0297	0.4	1.192	-0.0163	-0.22	0.1264	0.2758	1922920	CBDivE_015893	OC1CS(=O)(=O)CC1S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K14	compound treatment	1.365	0.0857	1.16	1.298	0.0897	1.22	1.6827	0.9996	1922921	CBDivE_015894	Oc1ccc(/C=N/n2c(nnc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K15	compound treatment	1.271	-0.00829	-0.11	1.199	-0.00928	-0.13	-0.1686	-0.9981	1922922	CBDivE_015895	OCc1nc(cs1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K16	compound treatment	1.305	0.0257	0.35	1.233	0.0247	0.34	0.4836	0.9999	1922923	CBDivE_015896	Brc1cccc(/C=C/2\SC(=O)NC2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K17	compound treatment	1.313	0.0337	0.45	1.248	0.0397	0.54	0.7045	0.9962	1922924	CBDivE_015897	CC(=O)C[n+]1cccc2cc(O)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K18	compound treatment	1.302	0.0227	0.31	1.249	0.0407	0.56	0.6092	0.9607	1594050	CBDivE_015898	Oc1c(Br)ccc2c1sc3nc4COCCn4c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K19	compound treatment	1.301	0.0217	0.29	1.21	0.00172	0.02	0.2236	0.7612	1922925	CBDivE_015899	O[C@@]12CCCC[C@@H]2[C@H](NCC1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	K20	compound treatment	1.307	0.0277	0.37	1.23	0.0217	0.3	0.4737	0.9934	1922926	CBDivE_015900	Cc1cc(C)nc(NC(=O)Nc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L01	compound treatment	1.251	-0.0283	-0.38	1.203	-0.00528	-0.07	-0.3208	-0.826	1779745	CBDivE_015901	COc1cc(C2NCCc3cc(OC)c(OC)cc23)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L02	compound treatment	1.261	-0.0183	-0.25	1.161	-0.0473	-0.64	-0.6304	-0.9132	1922927	CBDivE_015902	FC(F)(F)c1cc(NC=C2C(=O)NC(=O)NC2=O)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L03	compound treatment	1.27	-0.00929	-0.13	1.215	0.00672	0.09	-0.0239	-0.1538	1922928	CBDivE_015903	Fc1ccc(/C=C/C(=O)NC(=S)N2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L04	compound treatment	1.248	-0.0313	-0.42	1.17	-0.0383	-0.52	-0.6677	-0.9945	1922929	CBDivE_015904	CC1(C)CC(=O)C(=CNCc2cccs2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L05	compound treatment	1.25	-0.0293	-0.4	1.179	-0.0293	-0.4	-0.5618	-1.0	1922930	CBDivE_015905	Cc1ccc(cc1)/C(=N/NS(=O)(=O)c2ccc(C)cc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L06	compound treatment	1.289	0.00971	0.13	1.218	0.00972	0.13	0.1863	1.0	1922931	CBDivE_015906	O=C1NC(=O)C(=CNCc2cccs2)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L07	compound treatment	1.264	-0.0153	-0.21	1.176	-0.0323	-0.44	-0.4572	-0.9404	1169311	CBDivE_015907	OC(=O)CSC1(CC2CC3CC(C2)C1)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L08	compound treatment	1.232	-0.0473	-0.64	1.161	-0.0473	-0.64	-0.9071	-1.0	1922932	CBDivE_015908	CC1(C)CC(=O)C(=CNCc2ccc(Cl)cc2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L09	compound treatment	1.28	7.05E-4	0.01	1.236	0.0277	0.38	0.274	0.7247	1922933	CBDivE_015909	O=C(/C=C/c1cccnc1)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L10	compound treatment	1.245	-0.0343	-0.46	1.178	-0.0303	-0.41	-0.6191	-0.9984	1121637	CBDivE_015910	CCOc1ccc(NC(=O)c2c(OC)cccc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L11	compound treatment	1.246	-0.0333	-0.45	1.15	-0.0583	-0.79	-0.8796	-0.9635	1922934	CBDivE_015911	Brc1ccc(cc1)c2nc3ccccc3nc2c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L12	compound treatment	1.285	0.00571	0.08	1.226	0.0177	0.24	0.2253	0.8884	1922935	CBDivE_015912	CC1CCC/C(=N/NC(=O)c2cccc(c2)[N+](=O)[O-])/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L13	compound treatment	1.326	0.0467	0.63	1.238	0.0297	0.41	0.7321	0.9772	1922936	CBDivE_015913	O=C(C(=O)c1ccc(cc1)c2ccc(cc2)C(=O)C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L14	compound treatment	1.294	0.0147	0.2	1.204	-0.00428	-0.06	0.099	0.4787	1702358	CBDivE_015914	CN(C)CCn1c2nc(cn2c3ccccc13)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L15	compound treatment	1.247	-0.0323	-0.44	1.174	-0.0343	-0.47	-0.6386	-0.9994	1922937	CBDivE_015915	NNC(=O)C1C[C@@H]1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L16	compound treatment	1.27	-0.00929	-0.13	1.231	0.0227	0.31	0.1304	0.3901	1922938	CBDivE_015916	Oc1ccccc1/C=N/NC(=O)C2C3CCCCC23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L17	compound treatment	1.291	0.0117	0.16	1.229	0.0207	0.28	0.3114	0.9622	1922939	CBDivE_015917	COc1ccccc1N2C(=O)/C(=C/c3ccc(cc3)[N+](=O)[O-])/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L18	compound treatment	1.237	-0.0423	-0.57	1.175	-0.0333	-0.45	-0.7244	-0.9936	1618902	CBDivE_015918	Cc1c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c(=O)n(c3ccccc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L19	compound treatment	1.228	-0.0513	-0.69	1.187	-0.0213	-0.29	-0.6945	-0.9256	1922940	CBDivE_015919	CC/1=NN(C(=O)\C1=N/Nc2cccc(C)c2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	L20	compound treatment	1.268	-0.0113	-0.15	1.199	-0.00928	-0.13	-0.1972	-0.9958	1641224	CBDivE_015920	C(N1CCN(CC1)C2C3CC4CC(C3)CC2C4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M01	compound treatment	1.293	0.0137	0.18	1.207	-0.00128	-0.02	0.1184	0.6374	1234055	CBDivE_015921	CCOC(=O)Nc1ccc2CCc3ccccc3N(C(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M02	compound treatment	1.237	-0.0423	-0.57	1.157	-0.0513	-0.7	-0.8979	-0.9949	1922941	CBDivE_015922	CC/1=NN(C(=O)\C1=N/Nc2ccc(C)cc2C)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M03	compound treatment	1.28	7.05E-4	0.01	1.202	-0.00628	-0.09	-0.0538	-0.6247	1337776	CBDivE_015923	CC(=O)Nc1ccc2CCc3ccccc3N(C(=O)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M04	compound treatment	1.285	0.00571	0.08	1.225	0.0167	0.23	0.2156	0.8961	1922942	CBDivE_015924	C[N+]1(CC2COC3(O2)C(=CC(=[N+]([O-])[O-])C=C3[N+](=O)[O-])[N+](=O)[O-])CCOCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M05	compound treatment	1.271	-0.00829	-0.11	1.207	-0.00128	-0.02	-0.0915	-0.8078	1121064	CBDivE_015925	CCCC(CCC)C(=O)Nc1ccc2CCc3ccccc3Nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M06	compound treatment	1.247	-0.0323	-0.44	1.176	-0.0323	-0.44	-0.6193	-1.0	1577607	CBDivE_015926	OC(=O)c1cc(nc2ccccc12)c3ccc(I)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M07	compound treatment	1.265	-0.0143	-0.19	1.179	-0.0293	-0.4	-0.4187	-0.9443	1922943	CBDivE_015927	Nc1ccc2cc(O)cc(c2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M08	compound treatment	1.269	-0.0103	-0.14	1.222	0.0137	0.19	0.0341	0.1462	1922944	CBDivE_015928	[O-][N+](=O)c1cc(ccc1N2CCCC2=O)S(=O)(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M09	compound treatment	1.309	0.0297	0.4	1.217	0.00872	0.12	0.3674	0.879	3107546	CBDivE_015929	Cc1[nH]c2c(C)cccc2c1CCN.OC(C(O)C(=O)O)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M10	compound treatment	1.295	0.0157	0.21	1.232	0.0237	0.32	0.3785	0.979	1677559	CBDivE_015930	CCc1ccc2[nH]cc(CCN)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M11	compound treatment	1.268	-0.0113	-0.15	1.216	0.00772	0.11	-0.0333	-0.18	1922945	CBDivE_015931	CCN(CC)/C(=N\O)/c1cccc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M12	compound treatment	1.282	0.00271	0.04	1.217	0.00872	0.12	0.1099	0.8835	1247014	CBDivE_015932	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M13	compound treatment	1.312	0.0327	0.44	1.204	-0.00428	-0.06	0.2707	0.6082	1922946	CBDivE_015933	CC(=O)/C(=N\Nc1ccc(C)cc1)/C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M14	compound treatment	1.326	0.0467	0.63	1.254	0.0457	0.62	0.8864	1.0	1183773	CBDivE_015934	CCN(CC)CCOc1c(Br)ccc2c1sc3nc4CCCn4c(=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M15	compound treatment	1.277	-0.00229	-0.03	1.215	0.00672	0.09	0.0429	0.4435	1922947	CBDivE_015935	CCNCC(O)CNC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M16	compound treatment	1.288	0.00871	0.12	1.217	0.00872	0.12	0.1671	1.0	1633823	CBDivE_015936	COc1ccc2[nH]c(nc2c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M17	compound treatment	1.266	-0.0133	-0.18	1.205	-0.00328	-0.04	-0.1585	-0.8573	1922948	CBDivE_015937	Cc1cc(ccc1/N=C/c2cccnc2)c3ccc(/N=C/c4cccnc4)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M18	compound treatment	1.271	-0.00829	-0.11	1.224	0.0157	0.21	0.0724	0.2996	1922949	CBDivE_015938	Oc1ccccc1Oc2ccc([N+](=O)[O-])c3no[n+]([O-])c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M19	compound treatment	1.253	-0.0263	-0.35	1.195	-0.0133	-0.18	-0.3789	-0.9513	1183542	CBDivE_015939	COc1nc(N)nc(n1)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	M20	compound treatment	1.28	7.05E-4	0.01	1.247	0.0387	0.53	0.3801	0.7197	1922950	CBDivE_015940	O=C(Nc1scc(c1C(=O)OCc2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N01	compound treatment	1.261	-0.0183	-0.25	1.185	-0.0233	-0.32	-0.399	-0.9922	1922951	CBDivE_015941	COc1ccc(/C=C/2\SC(=S)N(C2=O)c3ccccc3OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N02	compound treatment	1.23	-0.0493	-0.67	1.191	-0.0173	-0.24	-0.6369	-0.9027	1922952	CBDivE_015942	Fc1ccc(Nc2nc(cs2)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N03	compound treatment	1.223	-0.0563	-0.76	1.164	-0.0443	-0.6	-0.964	-0.9935	1922953	CBDivE_015943	CC/1=NN(C(=O)\C1=N/Nc2ccc(C)cc2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N04	compound treatment	1.241	-0.0383	-0.52	1.165	-0.0433	-0.59	-0.7826	-0.9978	1120190	CBDivE_015944	Cc1ccc(Nc2nc(cs2)c3cccc(c3)N4C(=O)c5ccccc5C4=O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N05	compound treatment	1.24	-0.0393	-0.53	1.206	-0.00228	-0.03	-0.3968	-0.7473	1922954	CBDivE_015945	[O-][N+](=O)c1cccc(c1)C(=O)NN=C2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N06	compound treatment	1.215	-0.0643	-0.87	1.124	-0.0843	-1.15	-1.426	-0.9904	1922955	CBDivE_015946	COc1ccc(Nc2ccc3C(=O)c4ccccc4-c5c6cc(C)ccc6nc2c35)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N07	compound treatment	1.248	-0.0313	-0.42	1.17	-0.0383	-0.52	-0.6677	-0.9945	1922956	CBDivE_015947	CC/1=NN(C(=O)\C1=N/Nc2ccccc2Cl)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N08	compound treatment	1.236	-0.0433	-0.58	1.125	-0.0833	-1.14	-1.216	-0.9522	1922957	CBDivE_015948	CC(=O)c1nnn(c1C)c2ccnc(n2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N09	compound treatment	1.273	-0.00629	-0.08	1.158	-0.0503	-0.69	-0.5449	-0.7887	1525644	CBDivE_015949	CC(C)C(=O)Oc1ccc2c(C)cc(=O)oc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N10	compound treatment	1.253	-0.0263	-0.35	1.176	-0.0323	-0.44	-0.5621	-0.9943	1922958	CBDivE_015950	Cc1ccc(cc1)S(=O)(=O)c2ccc3C(=O)c4ccccc4-c5c6cc(C)ccc6nc2c35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N11	compound treatment	1.239	-0.0403	-0.54	1.142	-0.0663	-0.9	-1.0235	-0.9704	1922959	CBDivE_015951	CC/1=NN(C(=O)\C1=N/Nc2cccc(Cl)c2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N12	compound treatment	1.242	-0.0373	-0.5	1.19	-0.0183	-0.25	-0.532	-0.9475	1289066	CBDivE_015952	CC(C)(C)c1cc(cc(c1)S(=O)(=O)N)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N13	compound treatment	1.281	0.00171	0.02	1.198	-0.0103	-0.14	-0.0829	-0.5833	1406484	CBDivE_015953	CCOC(=O)c1c(N)n(c2ccc(N)cc2)c3nc4ccccc4nc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N14	compound treatment	1.282	0.00271	0.04	1.177	-0.0313	-0.43	-0.2758	-0.6443	1531373	CBDivE_015954	CC(C)c1ccc(cc1S(=O)(=O)N)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N15	compound treatment	1.255	-0.0243	-0.33	1.166	-0.0423	-0.58	-0.6395	-0.9642	1207275	CBDivE_015955	Oc1ccccc1NS(=O)(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N16	compound treatment	1.268	-0.0113	-0.15	1.189	-0.0193	-0.26	-0.2937	-0.9663	1922960	CBDivE_015956	NS(=O)(=O)c1ccc(/N=C/c2cc(Br)ccc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N17	compound treatment	1.275	-0.00429	-0.06	1.218	0.00972	0.13	0.0527	0.3646	1375283	CBDivE_015957	CCC(C)(CC)C(O)(C#CCN1CCCCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N18	compound treatment	1.275	-0.00429	-0.06	1.185	-0.0233	-0.32	-0.2655	-0.8226	1922961	CBDivE_015958	C/C(=N\NC(=S)N)/CC(c1ccccc1)c2c(O)c3ccccc3oc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N19	compound treatment	1.293	0.0137	0.18	1.227	0.0187	0.26	0.3112	0.9875	1922962	CBDivE_015959	CCOC(=O)/C=C/C1C[C@@H]1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	N20	compound treatment	1.256	-0.0233	-0.31	1.172	-0.0363	-0.49	-0.5721	-0.976	1922963	CBDivE_015960	NC(=O)c1ccc(/N=C/c2ccc(s2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O01	compound treatment	1.295	0.0157	0.21	1.224	0.0157	0.21	0.3014	1.0	1922964	CBDivE_015961	Clc1cccc(NC(=O)NC2CCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O02	compound treatment	1.326	0.0467	0.63	1.273	0.0647	0.88	1.0696	0.9864	1922965	CBDivE_015962	CCN(CC)CC#CC(CN1CCCCC1)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O03	compound treatment	1.32	0.0407	0.55	1.246	0.0377	0.51	0.752	0.9995	1922966	CBDivE_015963	N/N=C/c1ccc(o1)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O04	compound treatment	1.298	0.0187	0.25	1.242	0.0337	0.46	0.5036	0.9601	1922967	CBDivE_015964	COC(=O)c1ccc(cc1)N2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O05	compound treatment	1.295	0.0157	0.21	1.242	0.0337	0.46	0.4749	0.9381	1002188	CBDivE_015965	O=C1NC(C(=N1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O06	compound treatment	1.251	-0.0283	-0.38	1.175	-0.0333	-0.45	-0.5908	-0.9963	1922968	CBDivE_015966	ClC(=C/C=C/C(=O)c1ccc2OCOc2c1)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O07	compound treatment	1.305	0.0257	0.35	1.186	-0.0223	-0.3	0.0304	0.0658	1922969	CBDivE_015967	Cn1nc2CCc3nn(C)nc3-c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O08	compound treatment	1.253	-0.0263	-0.35	1.197	-0.0113	-0.15	-0.3596	-0.9301	1922970	CBDivE_015968	COc1ccc(/C=C/2\SC(=S)N(C2=O)c3ccccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O09	compound treatment	1.349	0.0697	0.94	1.268	0.0597	0.81	1.2408	0.9974	1922971	CBDivE_015969	[O-][N+](=O)c1ccc(NC(=S)NC(=C(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)F)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O10	compound treatment	1.322	0.0427	0.58	1.271	0.0627	0.86	1.0121	0.9815	1922972	CBDivE_015970	Cc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O11	compound treatment	1.293	0.0137	0.18	1.212	0.00372	0.05	0.1666	0.8689	1922973	CBDivE_015971	O=C(NC(=S)N1CCOCC1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O12	compound treatment	1.389	0.11	1.48	1.265	0.0567	0.77	1.5934	0.9542	1244739	CBDivE_015972	Cn1cccc1C(=O)NS(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O13	compound treatment	1.327	0.0477	0.64	1.211	0.00272	0.04	0.4813	0.7466	1922974	CBDivE_015973	O=C(NC(=S)N1CCOCC1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O14	compound treatment	1.343	0.0637	0.86	1.238	0.0297	0.41	0.8943	0.9411	1922975	CBDivE_015974	COc1ccc(/C=C/2\SC(=S)N(C2=O)c3ccc(C)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O15	compound treatment	1.284	0.00471	0.06	1.246	0.0377	0.51	0.4086	0.7884	1922976	CBDivE_015975	O=C(NC(=S)N1CCCCC1)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O16	compound treatment	1.29	0.0107	0.14	1.212	0.00372	0.05	0.138	0.9014	1922977	CBDivE_015976	COc1ccccc1N2C(=O)/C(=C/c3cccc(c3)[N+](=O)[O-])/SC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O17	compound treatment	1.313	0.0337	0.45	1.211	0.00272	0.04	0.3477	0.7622	1922978	CBDivE_015977	CC1(C)CC(=C/C(=N\NC(=O)c2ccccn2)/C1)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O18	compound treatment	1.272	-0.00729	-0.1	1.218	0.00972	0.13	0.0241	0.1461	1922979	CBDivE_015978	CCN1/C(=C\C(=O)c2ccc(C)cc2)/Sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O19	compound treatment	1.288	0.00871	0.12	1.189	-0.0193	-0.26	-0.1029	-0.3573	1922980	CBDivE_015979	Cc1ccccc1NN=C2C(=O)NC(=S)NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	O20	compound treatment	1.369	0.0897	1.21	1.299	0.0907	1.24	1.7305	0.9999	1777308	CBDivE_015980	Cc1ccc(cc1[N+](=O)[O-])C(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P01	compound treatment	1.302	0.0227	0.31	1.222	0.0137	0.19	0.3489	0.972	1922981	CBDivE_015981	CC(=O)C1=C(C)NC(=S)NC1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P02	compound treatment	1.26	-0.0193	-0.26	1.164	-0.0443	-0.6	-0.611	-0.9293	1922982	CBDivE_015982	COC(=O)/C(=C\C(=O)c1ccccc1)/Nc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P03	compound treatment	1.289	0.00971	0.13	1.196	-0.0123	-0.17	-0.0258	-0.1216	1275697	CBDivE_015983	O=C(N(Cc1ccccc1)C2C3CCCCC23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P04	compound treatment	1.205	-0.0743	-1.0	1.113	-0.0953	-1.3	-1.6275	-0.9918	1922983	CBDivE_015984	O/C(=C/C(=O)c1ccccc1)/C(=O)NNC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P05	compound treatment	1.285	0.00571	0.08	1.236	0.0277	0.38	0.3217	0.834	1922984	CBDivE_015985	O=C(/C=C\1/NC(=S)N(C1=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P06	compound treatment	1.247	-0.0323	-0.44	1.2	-0.00828	-0.11	-0.3879	-0.8619	1922985	CBDivE_015986	CC1CCC/C(=N/NC(=S)Nc2ccc(C)cc2)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P07	compound treatment	1.23	-0.0493	-0.67	1.154	-0.0543	-0.74	-0.9936	-0.9986	1922986	CBDivE_015987	O=C(N(Cc1ccccc1)[C@H]2C[C@@H]2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P08	compound treatment	1.185	-0.0943	-1.27	1.089	-0.119	-1.63	-2.0497	-0.9926	1922987	CBDivE_015988	CCCCCC1CC1C(=O)N/N=C/c2ccc(C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P09	compound treatment	1.282	0.00271	0.04	1.16	-0.0483	-0.66	-0.4397	-0.6669	1922988	CBDivE_015989	CCC/C(=N\OCC=C)/C1=C(C(=O)OC)C(C)(C)CC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P10	compound treatment	0.715	-0.564	-7.61	0.72	-0.488	-6.66	-10.0912	-0.9978	1922989	CBDivE_015990	NC(=O)c1ccc(/N=C/c2ccc[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P11	compound treatment	1.242	-0.0373	-0.5	1.158	-0.0503	-0.69	-0.8406	-0.9884	1922990	CBDivE_015991	[O-][N+](=O)c1ccc(N/N=C\2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P12	compound treatment	1.27	-0.00929	-0.13	1.172	-0.0363	-0.49	-0.4385	-0.8592	1922991	CBDivE_015992	Cn1ncc(Br)c1C(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P13	compound treatment	1.21	-0.0693	-0.93	1.093	-0.115	-1.57	-1.7726	-0.9692	1247820	CBDivE_015993	COc1ccc(NC2CC(=O)N(C2=O)c3cccc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P14	compound treatment	1.281	0.00171	0.02	1.196	-0.0123	-0.17	-0.1022	-0.6043	1922992	CBDivE_015994	NC(=O)c1ccc(/N=C/c2ccc(Br)s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P15	compound treatment	1.213	-0.0663	-0.89	1.146	-0.0623	-0.85	-1.233	-0.9997	1922993	CBDivE_015995	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccc4C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P16	compound treatment	1.254	-0.0253	-0.34	1.181	-0.0273	-0.37	-0.5044	-0.9991	1922994	CBDivE_015996	COc1ccc(/N=C/c2ccc(O)cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P17	compound treatment	1.258	-0.0213	-0.29	1.209	7.18E-4	0.01	-0.1962	-0.6826	1922995	CBDivE_015997	CC(C)CCOCC(O)Cn1c2ccccc2c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P18	compound treatment	1.272	-0.00729	-0.1	1.214	0.00572	0.08	-0.0145	-0.1151	1459916	CBDivE_015998	COc1ccccc1c2nsnc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P19	compound treatment	1.276	-0.00329	-0.04	1.191	-0.0173	-0.24	-0.1981	-0.8259	1922996	CBDivE_015999	Brc1ccc(cc1)N2C(=O)CC(N3CCCCCC3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.50	P20	compound treatment	1.315	0.0357	0.48	1.232	0.0237	0.32	0.5693	0.9812	1922997	CBDivE_016000	Oc1ccccc1/C=N/NC(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A01	compound treatment	1.272	-0.0171	-0.23	1.224	0.00113	0.02	-0.1521	-0.6586	1922998	CBDivE_016001	Oc1ccccc1/C=N/NC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A02	compound treatment	1.277	-0.0121	-0.16	1.206	-0.0169	-0.23	-0.278	-0.9857	1922999	CBDivE_016002	[O-][n+]1c2CCCc2[n+]([O-])c3CCCCc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A03	compound treatment	1.353	0.0639	0.86	1.264	0.0411	0.56	1.0063	0.9783	1923000	CBDivE_016003	COc1ccc(/C=N/c2ccccc2OC)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A04	compound treatment	1.309	0.0199	0.27	1.2	-0.0229	-0.31	-0.0306	-0.0742	1923001	CBDivE_016004	CC(C)(C)c1cc(CCCSCCCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A05	compound treatment	1.303	0.0139	0.19	1.216	-0.00687	-0.09	0.0665	0.3168	1923002	CBDivE_016005	C1CN=C(N1)C2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A06	compound treatment	1.307	0.0179	0.24	1.231	0.00813	0.11	0.2493	0.9374	1923003	CBDivE_016006	[O-][n+]1c2CCCCc2[n+]([O-])c3CCCCc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A07	compound treatment	1.29	9.18E-4	0.01	1.233	0.0101	0.14	0.1064	0.7675	1923004	CBDivE_016007	CCOC(=O)c1ccc2n(Cc3ccccc3)c(C)c(C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A08	compound treatment	1.262	-0.0271	-0.37	1.231	0.00813	0.11	-0.18	-0.4715	1923005	CBDivE_016008	CCn1c(C)nc2cc(ccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A09	compound treatment	1.27	-0.0191	-0.26	1.209	-0.0139	-0.19	-0.3158	-0.9885	1923006	CBDivE_016009	Cn1c(=N)n(CC(=O)NC2C3CC4CC(C3)CC2C4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A10	compound treatment	1.241	-0.0481	-0.65	1.207	-0.0159	-0.22	-0.6117	-0.8946	1923007	CBDivE_016010	CCN1/C(=C/C(=S)CC)/Sc2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A11	compound treatment	1.292	0.00292	0.04	1.256	0.0331	0.45	0.3472	0.7658	1923008	CBDivE_016011	CCCn1nnc(C(=O)N2CCCCC2)c1c3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A12	compound treatment	1.285	-0.00408	-0.06	1.231	0.00813	0.11	0.0394	0.3185	1923009	CBDivE_016012	Cc1ccc(C)n1c2cccc(c2)C(=O)Nc3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A13	compound treatment	1.329	0.0399	0.54	1.274	0.0511	0.7	0.8738	0.9919	1782467	CBDivE_016013	[O-][N+](=O)c1ccc2oc(=O)c3nsnc3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A14	compound treatment	1.305	0.0159	0.21	1.259	0.0361	0.49	0.5002	0.9308	1075814	CBDivE_016014	Fc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A15	compound treatment	1.271	-0.0181	-0.24	1.202	-0.0209	-0.28	-0.3738	-0.997	1923010	CBDivE_016015	CCCCNC(=O)c1nsnc1c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A16	compound treatment	1.28	-0.00908	-0.12	1.25	0.0271	0.37	0.1749	0.4489	1250713	CBDivE_016016	CC(C)(C)C1CCC(CC1)C(=O)Oc2cccc3cccnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A17	compound treatment	1.264	-0.0251	-0.34	1.193	-0.0299	-0.41	-0.5273	-0.9957	1923011	CBDivE_016017	CCCCNC(=O)c1nn[nH]c1c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A18	compound treatment	1.309	0.0199	0.27	1.286	0.0631	0.86	0.7987	0.8857	1923012	CBDivE_016018	C1Oc2ccc(cc2O1)C3NCCc4c3[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A19	compound treatment	1.282	-0.00708	-0.1	1.181	-0.0419	-0.57	-0.4713	-0.8141	1715899	CBDivE_016019	O=C(Nc1ccccc1)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	A20	compound treatment	1.319	0.0299	0.4	1.26	0.0371	0.51	0.6434	0.9937	1923013	CBDivE_016020	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccc(cc3)[N+](=O)[O-])c4ccc(NC(=O)C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B01	compound treatment	1.28	-0.00908	-0.12	1.211	-0.0119	-0.16	-0.2011	-0.9905	1923014	CBDivE_016021	CCN(/N=C/c1cccs1)c2cc(=O)n(C)c(=O)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B02	compound treatment	1.282	-0.00708	-0.1	1.226	0.00313	0.04	-0.0374	-0.3577	1923015	CBDivE_016022	Cc1cccc(C)c1Nc2c(C)cc(cc2C)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B03	compound treatment	1.272	-0.0171	-0.23	1.211	-0.0119	-0.16	-0.2774	-0.9851	1923016	CBDivE_016023	[O-][N+](=O)c1cccc(NC(=O)c2ccc(Cl)c(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B04	compound treatment	1.323	0.0339	0.46	1.243	0.0201	0.27	0.5176	0.9701	1923017	CBDivE_016024	[O-][N+](=O)c1cccc(NC(=O)c2c(F)cccc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B05	compound treatment	1.311	0.0219	0.3	1.242	0.0191	0.26	0.3935	0.998	1923018	CBDivE_016025	COc1ccc(/C=N/C2CCCCC2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B06	compound treatment	1.295	0.00592	0.08	1.234	0.0111	0.15	0.1637	0.9551	1185165	CBDivE_016026	Cc1cc(cc(C)c1NS(=O)(=O)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B07	compound treatment	1.329	0.0399	0.54	1.235	0.0121	0.17	0.4977	0.8835	1923019	CBDivE_016027	CC(C)OC1(N2C(=O)C(=C1C(=O)c3ccc(C)cc3)O)C(=O)Oc4cc(C)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B08	compound treatment	1.284	-0.00508	-0.07	1.23	0.00713	0.1	0.0202	0.1701	1923020	CBDivE_016028	Cc1cccc(C)c1NC(=O)N/N=C\c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B09	compound treatment	1.278	-0.0111	-0.15	1.222	-8.75E-4	-0.01	-0.1141	-0.7611	1923021	CBDivE_016029	CN(Cc1ccccc1)C2CC(=O)N(C2=O)c3ccc(cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B10	compound treatment	1.316	0.0269	0.36	1.302	0.0791	1.08	1.0197	0.8957	1923022	CBDivE_016030	CC(C)(C)NC(=O)c1c(F)cccc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B11	compound treatment	1.286	-0.00308	-0.04	1.237	0.0141	0.19	0.1068	0.542	1923023	CBDivE_016031	COc1ccc(/N=C/c2ccc(OC)cc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B12	compound treatment	1.265	-0.0241	-0.32	1.209	-0.0139	-0.19	-0.3635	-0.9669	1923024	CBDivE_016032	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B13	compound treatment	1.284	-0.00508	-0.07	1.188	-0.0349	-0.48	-0.3847	-0.8008	1923025	CBDivE_016033	[O-][N+](=O)c1ccc(/C=N/Cc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B14	compound treatment	1.316	0.0269	0.36	1.298	0.0751	1.02	0.9812	0.9027	1923026	CBDivE_016034	Cc1cccc(NC(=O)c2c(F)cccc2F)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B15	compound treatment	1.294	0.00492	0.07	1.204	-0.0189	-0.26	-0.1351	-0.5082	1923027	CBDivE_016035	CN(C)c1ccc(/C=C\2/N=C(OC2=O)c3ccc(Cl)cc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B16	compound treatment	1.271	-0.0181	-0.24	1.222	-8.75E-4	-0.01	-0.1809	-0.7408	1923028	CBDivE_016036	[O-][N+](=O)c1cccc(/C=N/C2CCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B17	compound treatment	1.284	-0.00508	-0.07	1.277	0.0541	0.74	0.4734	0.6387	1923029	CBDivE_016037	CC(=O)N(CN1C(=O)c2ccccc2C1=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B18	compound treatment	1.255	-0.0341	-0.46	1.228	0.00513	0.07	-0.2757	-0.5928	1923030	CBDivE_016038	Clc1ccc(C2=N/C(=C\c3c4ccccc4cc5ccccc35)/C(=O)O2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B19	compound treatment	1.298	0.00892	0.12	1.237	0.0141	0.19	0.2213	0.9743	1923031	CBDivE_016039	COc1ccc2ccccc2c1/C=C/c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	B20	compound treatment	1.288	-0.00108	-0.01	1.243	0.0201	0.27	0.1837	0.6686	1923032	CBDivE_016040	[O-][N+](=O)c1ccc(cc1)c2nc(c3ccccc3)c4ccccc4n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C01	compound treatment	1.248	-0.0411	-0.55	1.142	-0.0809	-1.1	-1.1717	-0.9493	1923033	CBDivE_016041	Oc1ccccc1c2nsnc2C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C02	compound treatment	1.289	-8.15E-5	0.0	1.246	0.0231	0.32	0.2222	0.7046	1923034	CBDivE_016042	CC1(C)C(=NC(=[N+]1[O-])c2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C03	compound treatment	1.379	0.0899	1.21	1.226	0.00313	0.04	0.8879	0.7315	1404633	CBDivE_016043	C1CN(CCO1)C2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C04	compound treatment	1.294	0.00492	0.07	1.241	0.0181	0.25	0.2217	0.8663	1923035	CBDivE_016044	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccc(Br)cc3)c4ccc(NC(=O)C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C05	compound treatment	1.328	0.0389	0.53	1.217	-0.00587	-0.08	0.3146	0.5924	1923036	CBDivE_016045	S=C(NC1(CC2CC3CC(C2)C1)C3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C06	compound treatment	1.313	0.0239	0.32	1.242	0.0191	0.26	0.4126	0.9944	1252769	CBDivE_016046	CC(=O)Nc1ccc(cc1)c2cc(ncn2)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C07	compound treatment	1.318	0.0289	0.39	1.235	0.0121	0.17	0.3928	0.927	1923037	CBDivE_016047	C/C(=N/NS(=O)(=O)c1ccc(C)cc1)/C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C08	compound treatment	1.309	0.0199	0.27	1.268	0.0451	0.62	0.6251	0.931	1164911	CBDivE_016048	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C09	compound treatment	1.335	0.0459	0.62	1.207	-0.0159	-0.22	0.285	0.4343	1923038	CBDivE_016049	CN(C)c1ccc(/C=N/c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C10	compound treatment	1.322	0.0329	0.44	1.262	0.0391	0.53	0.6913	0.9958	1923039	CBDivE_016050	CCCCCc1ccc(cc1)c2ccc(cc2)c3ncc(N)cn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C11	compound treatment	1.328	0.0389	0.53	1.247	0.0241	0.33	0.6039	0.9746	1923040	CBDivE_016051	NS(=O)(=O)c1ccc(/N=C/c2ccc(s2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C12	compound treatment	1.321	0.0319	0.43	1.26	0.0371	0.51	0.6625	0.9968	1590430	CBDivE_016052	Brc1ccc(cc1)C(=O)Nc2ccc3oc(=O)ccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C13	compound treatment	1.321	0.0319	0.43	1.226	0.00313	0.04	0.3346	0.7733	1923041	CBDivE_016053	NS(=O)(=O)c1ccc(/N=C/c2cccc(O)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C14	compound treatment	1.324	0.0349	0.47	1.264	0.0411	0.56	0.7296	0.9962	1923042	CBDivE_016054	COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc2nc(OC)nc(n2)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C15	compound treatment	1.358	0.0689	0.93	1.282	0.0591	0.81	1.2275	0.9975	1923043	CBDivE_016055	NS(=O)(=O)c1ccc(/N=C/c2ccc(Br)s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C16	compound treatment	1.322	0.0329	0.44	1.267	0.0441	0.6	0.7395	0.9888	1923044	CBDivE_016056	CC/C(=N/Nc1nc2ccccc2s1)/N=Nc3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C17	compound treatment	1.285	-0.00408	-0.06	1.222	-8.75E-4	-0.01	-0.0474	-0.8408	1923045	CBDivE_016057	CC/C(=N\NC(=S)Nc1ccc(C)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C18	compound treatment	1.307	0.0179	0.24	1.272	0.0491	0.67	0.6446	0.9051	1923046	CBDivE_016058	Cc1ccc(Oc2ccccc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C19	compound treatment	1.31	0.0209	0.28	1.206	-0.0169	-0.23	0.0368	0.1012	1923047	CBDivE_016059	CCOC(=O)C/C(=N/NC(=S)Nc1ccc(C)cc1)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	C20	compound treatment	1.286	-0.00308	-0.04	1.214	-0.00887	-0.12	-0.115	-0.8985	1923048	CBDivE_016060	[O-][N+](=O)c1ccc(cc1)n2nnnc2/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D01	compound treatment	1.263	-0.0261	-0.35	1.209	-0.0139	-0.19	-0.3826	-0.9577	1923049	CBDivE_016061	Cc1ccc(NC(=O)C(F)(F)F)cc1NC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D02	compound treatment	1.234	-0.0551	-0.74	1.187	-0.0359	-0.49	-0.8714	-0.9794	1923050	CBDivE_016062	O=C/1OC(=N\C1=C/c2ccccc2)C3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D03	compound treatment	1.275	-0.0141	-0.19	1.191	-0.0319	-0.43	-0.4417	-0.9311	1923051	CBDivE_016063	O=C1C2C(C3c4ccccc4C2c5ccccc35)C(=O)N1c6ccc7c(c6)oc8ccccc87
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D04	compound treatment	1.273	-0.0161	-0.22	1.207	-0.0159	-0.22	-0.3065	-1.0	1923052	CBDivE_016064	CCCCCCCC/N=C/c1cccc(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D05	compound treatment	1.319	0.0299	0.4	1.22	-0.00287	-0.04	0.2577	0.6354	1923053	CBDivE_016065	COc1ccc(/C=C/2\N=C(OC2=O)c3ccco3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D06	compound treatment	1.322	0.0329	0.44	1.24	0.0171	0.23	0.4792	0.955	1923054	CBDivE_016066	NC(=S)NNC(=O)Nc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D07	compound treatment	1.292	0.00292	0.04	1.234	0.0111	0.15	0.1351	0.8621	1923055	CBDivE_016067	[O-][N+](=O)c1cccc(/N=C/c2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D08	compound treatment	1.291	0.00192	0.03	1.22	-0.00287	-0.04	-0.0094	-0.2005	1923056	CBDivE_016068	CC(NC(=O)/C=C/c1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D09	compound treatment	1.319	0.0299	0.4	1.251	0.0281	0.38	0.5566	0.9997	1734841	CBDivE_016069	COc1cc(ccc1O)C2C3=C(CC(C)(C)CC3=O)OC4=C2C(=O)CC(C)(C)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D10	compound treatment	1.303	0.0139	0.19	1.229	0.00613	0.08	0.1918	0.9335	1923057	CBDivE_016070	COc1ccc(/C=N/c2cccc(C)c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D11	compound treatment	1.306	0.0169	0.23	1.193	-0.0299	-0.41	-0.1267	-0.2713	1923058	CBDivE_016071	Cc1ccccc1/N=C/c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D12	compound treatment	1.309	0.0199	0.27	1.245	0.0221	0.3	0.4034	0.9983	1923059	CBDivE_016072	CCN(CC)C(=O)CCCOc1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D13	compound treatment	1.344	0.0549	0.74	1.291	0.0681	0.93	1.1808	0.9937	1923060	CBDivE_016073	[O-][N+](=O)c1ccc(/C=N/Nc2cc[n+]([O-])c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D14	compound treatment	1.323	0.0339	0.46	1.261	0.0381	0.52	0.6912	0.998	1923061	CBDivE_016074	COc1ccc(CC(=O)N2CCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D15	compound treatment	1.274	-0.0151	-0.2	1.169	-0.0539	-0.73	-0.6633	-0.8702	1923062	CBDivE_016075	CC(=O)Oc1ccc(/C=C\2/N=C(OC2=O)c3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D16	compound treatment	1.31	0.0209	0.28	1.264	0.0411	0.56	0.5961	0.9495	1923063	CBDivE_016076	CCN(C(=O)c1ccc(F)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D17	compound treatment	1.286	-0.00308	-0.04	1.209	-0.0139	-0.19	-0.1632	-0.8424	1534603	CBDivE_016077	CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D18	compound treatment	1.295	0.00592	0.08	1.218	-0.00487	-0.07	0.0095	0.091	1923064	CBDivE_016078	Fc1cccc(c1)C(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D19	compound treatment	1.297	0.00792	0.11	1.224	0.00113	0.02	0.0864	0.8005	1923065	CBDivE_016079	Fc1ccccc1/C=C\2/N=C(OC2=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	D20	compound treatment	1.288	-0.00108	-0.01	1.243	0.0201	0.27	0.1837	0.6686	1370704	CBDivE_016080	CCN(C(=O)Cc1ccc(OC)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E01	compound treatment	1.283	-0.00608	-0.08	1.183	-0.0399	-0.54	-0.4425	-0.8047	1470918	CBDivE_016081	Cc1cc(C)cc(NCC(=O)Nc2c(C)cccc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E02	compound treatment	1.343	0.0539	0.73	1.286	0.0631	0.86	1.123	0.9965	1007952	CBDivE_016082	OC(=O)C(=O)Cc1ccccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E03	compound treatment	1.289	-8.15E-5	0.0	1.248	0.0251	0.34	0.2415	0.7048	1923066	CBDivE_016083	C/C(=N\NC(=S)Nc1ccc(C)cc1)/c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E04	compound treatment	1.267	-0.0221	-0.3	1.261	0.0381	0.52	0.157	0.262	1923067	CBDivE_016084	C/C(=N/Nc1nc2ccccc2s1)/N=Nc3ccccc3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E05	compound treatment	1.28	-0.00908	-0.12	1.227	0.00413	0.06	-0.0469	-0.3475	1923068	CBDivE_016085	COc1ccc(cc1)C2N/C(=N/O)/c3ccccc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E06	compound treatment	1.256	-0.0331	-0.45	1.245	0.0221	0.3	-0.1022	-0.1898	1923069	CBDivE_016086	COC(=O)CCS(=O)CCC(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E07	compound treatment	1.289	-8.15E-5	0.0	1.237	0.0141	0.19	0.1354	0.7031	1923070	CBDivE_016087	CC1(C)CC(=O)C/C(=N/NC(=O)c2ccc(Br)cc2)/C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E08	compound treatment	1.304	0.0149	0.2	1.258	0.0351	0.48	0.481	0.9258	1923071	CBDivE_016088	O=C(Cc1ccncn1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E09	compound treatment	1.298	0.00892	0.12	1.274	0.0511	0.7	0.578	0.8171	1923072	CBDivE_016089	COc1ccc(/C=C/C2=CCN(CC(O)c3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E10	compound treatment	1.309	0.0199	0.27	1.252	0.0291	0.4	0.4708	0.9819	1464611	CBDivE_016090	Oc1ccccc1c2nc3ccccc3c(=O)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E11	compound treatment	1.34	0.0509	0.69	1.213	-0.00987	-0.13	0.3905	0.5579	1680695	CBDivE_016091	CC(=O)Nc1cccc(c1)c2cc(nc(n2)c3ccccc3)c4cccc(NC(=O)C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E12	compound treatment	1.32	0.0309	0.42	1.278	0.0551	0.75	0.8265	0.9614	1923073	CBDivE_016092	ClC(C(=O)c1ccccc1)c2ncc(Cl)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E13	compound treatment	1.412	0.123	1.66	1.214	-0.00887	-0.12	1.087	0.6538	1779747	CBDivE_016093	COc1ccc2oc(=O)c(cc2c1)C(=O)Nc3nc(cs3)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E14	compound treatment	1.316	0.0269	0.36	1.237	0.0141	0.19	0.393	0.956	1026267	CBDivE_016094	OS(=O)(=O)c1ccc2C(=O)c3ccc(cc3C(=O)c2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E15	compound treatment	1.271	-0.0181	-0.24	1.218	-0.00487	-0.07	-0.2195	-0.8681	1279128	CBDivE_016095	CC(=O)Nc1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4cccc(NC(=O)C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E16	compound treatment	1.312	0.0229	0.31	1.26	0.0371	0.51	0.5766	0.972	1003012	CBDivE_016096	OS(=O)(=O)c1cccc2C(=O)c3cccc(c3C(=O)c12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E17	compound treatment	1.3	0.0109	0.15	1.184	-0.0389	-0.53	-0.2707	-0.492	1923074	CBDivE_016097	CCC1=NC(NC(=N)N)Nc2cc(C)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E18	compound treatment	1.338	0.0489	0.66	1.26	0.0371	0.51	0.8246	0.9914	1005863	CBDivE_016098	c1ccc(cc1)c2nn(c3ccccc3)[n+](n2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E19	compound treatment	1.273	-0.0161	-0.22	1.189	-0.0339	-0.46	-0.48	-0.9406	1453070	CBDivE_016099	CCN(CC)c1ccc(cc1)C2Nc3ccccc3NC4=C2C(=O)CC(C)(C)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	E20	compound treatment	1.313	0.0239	0.32	1.261	0.0381	0.52	0.5958	0.9737	1076031	CBDivE_016100	Nc1c(ccc2C(=O)c3ccccc3C(=O)c12)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F01	compound treatment	1.239	-0.0501	-0.68	1.161	-0.0619	-0.84	-1.0744	-0.9939	1007896	CBDivE_016101	Nc1ccc(Nc2ccc(cc2S(=O)(=O)O)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F02	compound treatment	1.248	-0.0411	-0.55	1.209	-0.0139	-0.19	-0.5257	-0.8976	1199231	CBDivE_016102	CN1CCN(CC1)C(=O)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F03	compound treatment	1.264	-0.0251	-0.34	1.188	-0.0349	-0.48	-0.5755	-0.9861	1923075	CBDivE_016103	O=C1CCCN1CCSC(=S)N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F04	compound treatment	1.246	-0.0431	-0.58	1.185	-0.0379	-0.52	-0.7762	-0.9983	1923076	CBDivE_016104	CC(=CCC/C(=C/CC(C)(C)C1NCCO1)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F05	compound treatment	1.28	-0.00908	-0.12	1.237	0.0141	0.19	0.0496	0.2172	1194650	CBDivE_016105	OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)N(CC=C)CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F06	compound treatment	1.254	-0.0351	-0.47	1.199	-0.0239	-0.33	-0.5649	-0.9833	1005014	CBDivE_016106	CCOC(=O)CC(C)(O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F07	compound treatment	1.29	9.18E-4	0.01	1.24	0.0171	0.23	0.1739	0.7436	1923077	CBDivE_016107	Clc1ccc(cc1Cl)N/2CCC\C2=N/c3c4CCN(c4nc5ccccc35)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F08	compound treatment	1.277	-0.0121	-0.16	1.208	-0.0149	-0.2	-0.2587	-0.9941	1923078	CBDivE_016108	Clc1ccc(OCCCC(=O)N2CCCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F09	compound treatment	1.284	-0.00508	-0.07	1.199	-0.0239	-0.33	-0.2787	-0.8376	1923079	CBDivE_016109	O=C/1OC(=N\C1=C/c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F10	compound treatment	1.321	0.0319	0.43	1.304	0.0811	1.11	1.0867	0.9154	1665059	CBDivE_016110	COc1ccc(CC(=O)Nc2ccccc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F11	compound treatment	1.339	0.0499	0.67	1.316	0.0931	1.27	1.3741	0.956	1923080	CBDivE_016111	CN(C)c1ccc(/C=C/2\N=C(OC2=O)c3ccco3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F12	compound treatment	1.298	0.00892	0.12	1.303	0.0801	1.09	0.8577	0.7803	1923081	CBDivE_016112	CCCCCC(C)NC(=O)c1ccc(Br)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F13	compound treatment	1.285	-0.00408	-0.06	1.241	0.0181	0.25	0.1358	0.5364	1620575	CBDivE_016113	c1coc(c1)c2nc(c3ccccc3)c4ccccn24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F14	compound treatment	1.268	-0.0211	-0.28	1.206	-0.0169	-0.23	-0.3638	-0.9945	1353441	CBDivE_016114	COc1ccc(CC(=O)N2CCN(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F15	compound treatment	1.283	-0.00608	-0.08	1.193	-0.0299	-0.41	-0.3461	-0.8328	1923082	CBDivE_016115	CC(C)(C)NCC(=O)Nc1c2CCCc2nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F16	compound treatment	1.311	0.0219	0.3	1.248	0.0251	0.34	0.4514	0.9973	1923083	CBDivE_016116	Clc1ccc(C(=O)N2CCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F17	compound treatment	1.276	-0.0131	-0.18	1.181	-0.0419	-0.57	-0.5286	-0.8844	1923084	CBDivE_016117	CC(=O)/C=C/c1c(C)n(C)c2ccc(cc12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F18	compound treatment	1.319	0.0299	0.4	1.252	0.0291	0.4	0.5662	1.0	1200153	CBDivE_016118	Ic1ccc2N3CCN(CC3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F19	compound treatment	1.264	-0.0251	-0.34	1.193	-0.0299	-0.41	-0.5273	-0.9957	1923085	CBDivE_016119	[O-][N+](=O)c1cccc(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	F20	compound treatment	1.282	-0.00708	-0.1	1.241	0.0181	0.25	0.1072	0.4046	1923086	CBDivE_016120	CN(C(=O)COc1ccccc1C)c2ccc(NC(=O)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G01	compound treatment	1.233	-0.0561	-0.76	1.188	-0.0349	-0.48	-0.8713	-0.975	1923087	CBDivE_016121	CCOC(=O)C1=C(Cc2ccc(cc2)N(C)C)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G02	compound treatment	1.269	-0.0201	-0.27	1.22	-0.00287	-0.04	-0.2193	-0.8011	1917520	CBDivE_016122	OS(=O)(=O)c1ccc(cc1)N2CCC(=N2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G03	compound treatment	1.327	0.0379	0.51	1.201	-0.0219	-0.3	0.1508	0.2546	1923088	CBDivE_016123	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G04	compound treatment	1.258	-0.0311	-0.42	1.233	0.0101	0.14	-0.1989	-0.4505	1923089	CBDivE_016124	OS(=O)(=O)c1ccc2C(=O)c3cc(Cl)ccc3C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G05	compound treatment	1.301	0.0119	0.16	1.198	-0.0249	-0.34	-0.1262	-0.3361	1342171	CBDivE_016125	CCOC(=O)C1=C(C(=O)c2ccccc2C1=O)c3ccc(CC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G06	compound treatment	1.311	0.0219	0.3	1.251	0.0281	0.38	0.4803	0.9917	1923090	CBDivE_016126	CC(=C)C(=O)Nc1ccc(Cl)c(NC2=NN(C(=O)C2)c3c(Cl)cc(Cl)cc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G07	compound treatment	1.33	0.0409	0.55	1.246	0.0231	0.32	0.6133	0.9647	1923091	CBDivE_016127	CCOC(=O)CC1(C(=O)c2ccccc2C1=O)c3ccc(CC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G08	compound treatment	1.301	0.0119	0.16	1.251	0.0281	0.38	0.3849	0.9255	1923092	CBDivE_016128	CC(=C)C(=O)NC1=NN(C(=O)C1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G09	compound treatment	1.321	0.0319	0.43	1.239	0.0161	0.22	0.46	0.9513	1615764	CBDivE_016129	CCOC(=O)C1=C(Cc2ccc(F)cc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G10	compound treatment	1.329	0.0399	0.54	1.225	0.00213	0.03	0.4013	0.7441	1008156	CBDivE_016130	Oc1ccc2cc(ccc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G11	compound treatment	1.376	0.0869	1.17	1.208	-0.0149	-0.2	0.6857	0.5762	1206393	CBDivE_016131	CCOC(=O)C1=C(Cc2ccc(OC)cc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G12	compound treatment	1.307	0.0179	0.24	1.291	0.0681	0.93	0.8278	0.8624	1011012	CBDivE_016132	OS(=O)(=O)c1ccc2ccc(cc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G13	compound treatment	1.265	-0.0241	-0.32	1.172	-0.0509	-0.69	-0.7203	-0.9402	1923093	CBDivE_016133	CCOC(=O)C1=C(Cc2ccc(Cl)cc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G14	compound treatment	1.385	0.0959	1.29	1.297	0.0741	1.01	1.6297	0.9925	1442478	CBDivE_016134	CC(C)(CO)C(O)C(=O)NC1CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G15	compound treatment	1.323	0.0339	0.46	1.248	0.0251	0.34	0.5658	0.9898	1616955	CBDivE_016135	COc1ccc(CC2=C(O)C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G16	compound treatment	1.293	0.00392	0.05	1.235	0.0121	0.17	0.1543	0.8889	1055021	CBDivE_016136	O=C1NC(=O)C(=Cc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2)C(=O)N1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G17	compound treatment	1.35	0.0609	0.82	1.258	0.0351	0.48	0.9198	0.967	1145754	CBDivE_016137	CCOC(=O)CC1(C(=O)c2ccccc2C1=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G18	compound treatment	1.356	0.0669	0.9	1.241	0.0181	0.25	0.8131	0.8687	1025860	CBDivE_016138	Oc1cc(cc2cc(cc(c12)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G19	compound treatment	1.213	-0.0761	-1.03	1.306	0.0831	1.13	0.0758	0.0495	1923094	CBDivE_016139	CCOC(=O)C1=C(Cc2ccc(C)cc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	G20	compound treatment	1.296	0.00692	0.09	1.259	0.0361	0.49	0.4143	0.8264	1923095	CBDivE_016140	Cc1cc(C)n(/N=C\c2ccco2)c(=O)c1C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H01	compound treatment	1.228	-0.0611	-0.82	1.154	-0.0689	-0.94	-1.2468	-0.9979	1458974	CBDivE_016141	COc1ccc(cc1OC)c2nc(N)nc(N)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H02	compound treatment	1.245	-0.0441	-0.59	1.189	-0.0339	-0.46	-0.7471	-0.9922	1777095	CBDivE_016142	CCN(C(=O)c1cc(ccc1Cl)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H03	compound treatment	1.258	-0.0311	-0.42	1.191	-0.0319	-0.43	-0.6038	-0.9998	1923096	CBDivE_016143	CC(C)NC(=O)Nc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H04	compound treatment	1.252	-0.0371	-0.5	1.193	-0.0299	-0.41	-0.6418	-0.9948	1777090	CBDivE_016144	[O-][N+](=O)c1cc(ccc1Cl)C(=O)N(Cc2ccccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H05	compound treatment	1.308	0.0189	0.26	1.245	0.0221	0.3	0.3938	0.9965	1075831	CBDivE_016145	Cc1cccc(C)c1NC(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H06	compound treatment	1.259	-0.0301	-0.41	1.18	-0.0429	-0.58	-0.7004	-0.9841	1923097	CBDivE_016146	CC(=O)Nc1cccc(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H07	compound treatment	1.288	-0.00108	-0.01	1.235	0.0121	0.17	0.1066	0.6422	1923098	CBDivE_016147	C/C(=N\NC(=S)N1CCCCC1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H08	compound treatment	1.267	-0.0221	-0.3	1.184	-0.0389	-0.53	-0.5855	-0.9629	1923099	CBDivE_016148	Nc1ccc(cc1)c2nc(c3ccccc3)c4ccccc4n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H09	compound treatment	1.289	-8.15E-5	0.0	1.186	-0.0369	-0.5	-0.3563	-0.7087	1923100	CBDivE_016149	Cc1nnc2ccc(N/N=C/c3ccc(Br)cc3)nn12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H10	compound treatment	1.284	-0.00508	-0.07	1.199	-0.0239	-0.33	-0.2787	-0.8376	1923101	CBDivE_016150	Ic1cc2N3CCN(CC3)c2cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H11	compound treatment	1.303	0.0139	0.19	1.188	-0.0349	-0.48	-0.2035	-0.398	1923102	CBDivE_016151	Clc1cccc(c1)C(=O)NNC(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H12	compound treatment	1.309	0.0199	0.27	1.226	0.00313	0.04	0.2201	0.8091	1442889	CBDivE_016152	CCCCc1ccc(cc1)C(=O)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H13	compound treatment	1.361	0.0719	0.97	1.287	0.0641	0.87	1.3044	0.9987	1923103	CBDivE_016153	COc1ccc(/C=C/2\N=C(OC2=O)C3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H14	compound treatment	1.306	0.0169	0.23	1.265	0.0421	0.57	0.5676	0.9182	1923104	CBDivE_016154	O/N=C/1\c2ccccc2-c3c1c(F)c(F)c(F)c3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H15	compound treatment	1.29	9.18E-4	0.01	1.206	-0.0169	-0.23	-0.154	-0.6681	1923105	CBDivE_016155	CN(NC(=O)CN1CCOCC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H16	compound treatment	1.274	-0.0151	-0.2	1.218	-0.00487	-0.07	-0.1909	-0.8917	1923106	CBDivE_016156	COc1cccc(/C=N/NC(=O)N)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H17	compound treatment	1.28	-0.00908	-0.12	1.154	-0.0689	-0.94	-0.7507	-0.7926	1923107	CBDivE_016157	Cc1ccc(cc1)C(=O)C2=C3N(C(=O)C2=O)c4ccccc4OC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H18	compound treatment	1.287	-0.00208	-0.03	1.213	-0.00987	-0.13	-0.1151	-0.8366	1923108	CBDivE_016158	OC1(CC(=O)N/N=C/c2ccc(Br)cc2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H19	compound treatment	1.262	-0.0271	-0.37	1.213	-0.00987	-0.13	-0.3536	-0.908	1923109	CBDivE_016159	OC(=O)/C=C\C(=O)Nc1ccccc1C#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	H20	compound treatment	1.197	-0.0921	-1.24	1.26	0.0371	0.51	-0.5204	-0.388	1923110	CBDivE_016160	COc1cc2COCCOCCOCCOCCOCc(c1)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I01	compound treatment	1.266	-0.0231	-0.31	1.208	-0.0149	-0.2	-0.3636	-0.9784	1081416	CBDivE_016161	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I02	compound treatment	1.297	0.00792	0.11	1.206	-0.0169	-0.23	-0.0872	-0.3436	1002713	CBDivE_016162	Oc1ccc2ccc(cc2c1)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I03	compound treatment	1.289	-8.15E-5	0.0	1.201	-0.0219	-0.3	-0.2117	-0.7097	1663913	CBDivE_016163	COc1ccc(C2Nc3ccccc3NC4=C2C(=O)CC(C)(C)C4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I04	compound treatment	1.258	-0.0311	-0.42	1.212	-0.0109	-0.15	-0.4014	-0.9024	1776228	CBDivE_016164	CCOC(=O)c1c(C)n(O)c2ccc3[n+]([O-])onc3c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I05	compound treatment	1.348	0.0589	0.79	1.285	0.0621	0.85	1.1611	0.9995	1783134	CBDivE_016165	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2/C=C/c4ccccc4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I06	compound treatment	1.244	-0.0451	-0.61	1.187	-0.0359	-0.49	-0.776	-0.9942	1923111	CBDivE_016166	On1c2CCCCc2c3c1cc(c4nonc43)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I07	compound treatment	1.322	0.0329	0.44	1.194	-0.0289	-0.39	0.0356	0.06	1782663	CBDivE_016167	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I08	compound treatment	1.354	0.0649	0.88	1.241	0.0181	0.25	0.7941	0.8726	1774639	CBDivE_016168	[O-][n+]1onc2c3cc([nH]c3ccc12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I09	compound treatment	1.29	9.18E-4	0.01	1.22	-0.00287	-0.04	-0.019	-0.4611	1779774	CBDivE_016169	O=c1oc2ccccc2c3[nH]c(nc13)c4cc(nn4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I10	compound treatment	1.33	0.0409	0.55	1.225	0.00213	0.03	0.4108	0.7432	1776231	CBDivE_016170	ON1C(CC2(O)C1CCc3c2no[n+]3[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I11	compound treatment	1.272	-0.0171	-0.23	1.195	-0.0279	-0.38	-0.4317	-0.9712	1923112	CBDivE_016171	CCCCn1nnc2c(=O)oc3ccc(cc3c12)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I12	compound treatment	1.288	-0.00108	-0.01	1.255	0.0321	0.44	0.2994	0.6832	1774910	CBDivE_016172	Cc1cnnc2CCc3c(no[n+]3[O-])-c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I13	compound treatment	1.313	0.0239	0.32	1.216	-0.00687	-0.09	0.1619	0.4818	1923113	CBDivE_016173	OC(=O)c1cc(/N=C/c2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I14	compound treatment	1.282	-0.00708	-0.1	1.272	0.0491	0.67	0.4061	0.6002	1923114	CBDivE_016174	[O-][n+]1onc-2c1CCc3nnccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I15	compound treatment	1.298	0.00892	0.12	1.19	-0.0329	-0.45	-0.2319	-0.4996	1923115	CBDivE_016175	CN(C(=O)c1c(C)n(nc1c2ccccc2)c3ccccc3)C4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I16	compound treatment	1.302	0.0129	0.17	1.228	0.00513	0.07	0.1727	0.9195	1923116	CBDivE_016176	Clc1ccccc1/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I17	compound treatment	1.332	0.0429	0.58	1.235	0.0121	0.17	0.5263	0.8741	1923117	CBDivE_016177	CC/1=NN(C(=O)\C1=N/Nc2ccc(O)cc2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I18	compound treatment	1.308	0.0189	0.26	1.243	0.0201	0.27	0.3745	0.9993	1923118	CBDivE_016178	[O-][N+](=O)c1ccc(/C=N\Nc2nc(cc(n2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I19	compound treatment	1.303	0.0139	0.19	1.2	-0.0229	-0.31	-0.0878	-0.2411	1923119	CBDivE_016179	OC1(CC(=O)N/N=C/c2cccs2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	I20	compound treatment	1.273	-0.0161	-0.22	1.238	0.0151	0.21	-0.0076	-0.0253	1923120	CBDivE_016180	ON1CCC2(O)C1CCc3c2no[n+]3[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J01	compound treatment	1.252	-0.0371	-0.5	1.236	0.0131	0.18	-0.2272	-0.4276	1923121	CBDivE_016181	C/C(=N\Nc1nc(cs1)C(=O)O)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J02	compound treatment	1.244	-0.0451	-0.61	1.191	-0.0319	-0.43	-0.7374	-0.9864	1923122	CBDivE_016182	CCN(/N=C/c1ccccc1)c2cc(=O)n(C)c(=O)[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J03	compound treatment	1.287	-0.00208	-0.03	1.216	-0.00687	-0.09	-0.0861	-0.8803	1923123	CBDivE_016183	CCNC1=NN=C(CS1)/C(=N\OC)/C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J04	compound treatment	1.234	-0.0551	-0.74	1.193	-0.0299	-0.41	-0.8135	-0.96	541	CBDivE_016184	Cc1c(C)c(CONC(=O)c2ccccc2)c(C)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J05	compound treatment	1.296	0.00692	0.09	1.215	-0.00787	-0.11	-0.0099	-0.0698	1923124	CBDivE_016185	Fc1ccc(Nc2nc(cs2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J06	compound treatment	1.25	-0.0391	-0.53	1.193	-0.0299	-0.41	-0.6609	-0.9919	1923125	CBDivE_016186	CCOc1ccc(cc1)N2C(=O)CC(N(C)Cc3ccccc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J07	compound treatment	1.305	0.0159	0.21	1.202	-0.0209	-0.28	-0.0494	-0.1386	1923126	CBDivE_016187	Fc1ccc(cc1)N2C(=O)CC(NCc3ccco3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J08	compound treatment	1.296	0.00692	0.09	1.229	0.00613	0.08	0.1251	0.9985	1923127	CBDivE_016188	COc1cc(C=O)ccc1OCc2c(C)c(C)c(Br)c(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J09	compound treatment	1.287	-0.00208	-0.03	1.26	0.0371	0.51	0.3381	0.6669	1265631	CBDivE_016189	OC(=O)CCC(=O)Nc1ccccc1C#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J10	compound treatment	1.252	-0.0371	-0.5	1.204	-0.0189	-0.26	-0.5357	-0.9523	1723989	CBDivE_016190	COc1cccc(Nc2nc(cs2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J11	compound treatment	1.327	0.0379	0.51	1.25	0.0271	0.37	0.6233	0.9873	1494697	CBDivE_016191	CC1(C)CC(=O)C=C(C1)Nc2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J12	compound treatment	1.232	-0.0571	-0.77	1.178	-0.0449	-0.61	-0.9772	-0.9935	1376238	CBDivE_016192	CCS(=O)(=O)c1ccc2oc(nc2c1)c3ccc(c4nc5cc(ccc5o4)S(=O)(=O)CC)c6ccccc36
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J13	compound treatment	1.285	-0.00408	-0.06	1.204	-0.0189	-0.26	-0.2209	-0.8394	1923128	CBDivE_016193	Clc1ccc(cc1)C2=CC(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J14	compound treatment	1.246	-0.0431	-0.58	1.168	-0.0549	-0.75	-0.9401	-0.9922	1923129	CBDivE_016194	C/C(=N\NC(=O)N)/CC1CCCCCCCCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J15	compound treatment	1.281	-0.00808	-0.11	1.238	0.0151	0.21	0.0688	0.2947	1573064	CBDivE_016195	NC(=S)n1[nH]c(cc1=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J16	compound treatment	1.272	-0.0171	-0.23	1.17	-0.0529	-0.72	-0.6728	-0.8888	1923130	CBDivE_016196	CCCCCn1c(Sc2nc3n(C)c(=O)[nH]c(=O)c3n2CCCCC)nc4n(C)c(=O)[nH]c(=O)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J17	compound treatment	1.274	-0.0151	-0.2	1.204	-0.0189	-0.26	-0.3259	-0.9932	1923131	CBDivE_016197	O=C(Nc1nnc[nH]1)/C=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J18	compound treatment	1.31	0.0209	0.28	1.245	0.0221	0.3	0.4129	0.9994	1923132	CBDivE_016198	COc1ccc(cc1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J19	compound treatment	1.264	-0.0251	-0.34	1.196	-0.0269	-0.37	-0.4984	-0.9992	1245994	CBDivE_016199	CC(C)Cc1ccc(cc1)C(C)C(=O)Nc2ncccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	J20	compound treatment	1.248	-0.0411	-0.55	1.203	-0.0199	-0.27	-0.5835	-0.9459	1273359	CBDivE_016200	COc1cc(N)c(C)cc1NC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K01	compound treatment	1.316	0.0269	0.36	1.207	-0.0159	-0.22	0.1037	0.2453	1923133	CBDivE_016201	CCC/C(=N\NC(=S)N)/c1cc(O)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K02	compound treatment	1.312	0.0229	0.31	1.206	-0.0169	-0.23	0.0559	0.1451	1923134	CBDivE_016202	CN(/N=C/c1c(F)c(F)c(F)c(F)c1F)c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K03	compound treatment	1.275	-0.0141	-0.19	1.199	-0.0239	-0.33	-0.3645	-0.9671	1923135	CBDivE_016203	CC(C)(C#CC#CC(C)(C)N1CCC(=O)CC1)N2CCC(=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K04	compound treatment	1.267	-0.0221	-0.3	1.183	-0.0399	-0.54	-0.5951	-0.9599	1923136	CBDivE_016204	CN(/N=C\c1cc(Cl)cc(Cl)c1O)c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K05	compound treatment	1.3	0.0109	0.15	1.233	0.0101	0.14	0.2018	0.9995	1923137	CBDivE_016205	COc1ccc(/C=N/c2ccc3[nH]c(nc3c2)c4ccc(Cl)cc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K06	compound treatment	1.296	0.00692	0.09	1.272	0.0491	0.67	0.5397	0.7979	1923138	CBDivE_016206	CN(/N=C\c1ccc(cc1)[N+](=O)[O-])c2nc(cc(n2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K07	compound treatment	1.258	-0.0311	-0.42	1.184	-0.0389	-0.53	-0.6713	-0.9933	1923139	CBDivE_016207	CC(C)(C)CC(C)(C)c1ccc(OC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K08	compound treatment	1.26	-0.0291	-0.39	1.206	-0.0169	-0.23	-0.4401	-0.9677	1923140	CBDivE_016208	CC1=[N+]([O-])C2(N)CCc3c(no[n+]3[O-])C2(O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K09	compound treatment	1.276	-0.0131	-0.18	1.177	-0.0459	-0.63	-0.5671	-0.8725	1923141	CBDivE_016209	ClCCOCCOCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K10	compound treatment	1.298	0.00892	0.12	1.272	0.0491	0.67	0.5588	0.821	1923142	CBDivE_016210	CC1(CC2(O)C(=[N+]1[O-])CCc3c2no[n+]3[O-])N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K11	compound treatment	1.287	-0.00208	-0.03	1.235	0.0121	0.17	0.0971	0.5787	1923143	CBDivE_016211	Oc1ccc(/C=N/Cc2ccccc2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K12	compound treatment	1.285	-0.00408	-0.06	1.217	-0.00587	-0.08	-0.0956	-0.9833	1923144	CBDivE_016212	COc1ccc(Nc2ccc3=[N+]([O-])C4(CCCCC4)N=c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K13	compound treatment	1.313	0.0239	0.32	1.219	-0.00387	-0.05	0.1908	0.5836	1658367	CBDivE_016213	CN1CCN(CC1)C(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K14	compound treatment	1.361	0.0719	0.97	1.315	0.0921	1.26	1.5744	0.9918	1923145	CBDivE_016214	OC12CC(N3CCOCC3)[N+](=C2CCc4c1no[n+]4[O-])[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K15	compound treatment	1.284	-0.00508	-0.07	1.228	0.00513	0.07	9.0E-4	0.0097	1441687	CBDivE_016215	COc1cc(cc(OC)c1OC)C(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K16	compound treatment	1.308	0.0189	0.26	1.25	0.0271	0.37	0.442	0.9836	1923146	CBDivE_016216	On1c(nc-2c1CCc3c2no[n+]3[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K17	compound treatment	1.324	0.0349	0.47	1.254	0.0311	0.42	0.6332	0.9986	1923147	CBDivE_016217	C/C=C/C(=O)Nc1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K18	compound treatment	1.308	0.0189	0.26	1.247	0.0241	0.33	0.4131	0.9921	1923148	CBDivE_016218	NC12CCc3c(no[n+]3[O-])C2(O)CC(=[N+]1[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K19	compound treatment	1.306	0.0169	0.23	1.224	0.00113	0.02	0.1722	0.753	1923149	CBDivE_016219	Cc1cccc(OP(=O)(Oc2ccc(Cl)cc2)Oc3cccc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	K20	compound treatment	1.3	0.0109	0.15	1.244	0.0211	0.29	0.3079	0.9515	1779748	CBDivE_016220	CC1CN(O)C2CCc3c(no[n+]3[O-])C12O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L01	compound treatment	1.298	0.00892	0.12	1.228	0.00513	0.07	0.1345	0.9666	1707737	CBDivE_016221	Cc1cc(=O)n2N=C(Cc2n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L02	compound treatment	1.274	-0.0151	-0.2	1.172	-0.0509	-0.69	-0.6344	-0.8775	1923150	CBDivE_016222	CN1C(=O)c2cccc3c(NC(=O)C)ccc(C1=O)c23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L03	compound treatment	1.29	9.18E-4	0.01	1.199	-0.0239	-0.33	-0.2214	-0.6797	1556777	CBDivE_016223	O=C(Nc1cc(n[nH]1)c2ccccc2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L04	compound treatment	1.256	-0.0331	-0.45	1.176	-0.0469	-0.64	-0.7676	-0.9846	1358235	CBDivE_016224	Cc1cc(C)n(n1)C2CC(=O)N(C2=O)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L05	compound treatment	1.276	-0.0131	-0.18	1.191	-0.0319	-0.43	-0.4321	-0.9212	1685147	CBDivE_016225	Cc1cccc(n1)C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L06	compound treatment	1.281	-0.00808	-0.11	1.224	0.00113	0.02	-0.0662	-0.6016	1923151	CBDivE_016226	S=c1ccc(n[nH]1)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L07	compound treatment	1.264	-0.0251	-0.34	1.202	-0.0209	-0.28	-0.4405	-0.9963	1688790	CBDivE_016227	O=c1cc(nc2CC(=Nn21)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L08	compound treatment	1.237	-0.0521	-0.7	1.161	-0.0619	-0.84	-1.0934	-0.9959	1165403	CBDivE_016228	CCn1cc(C(=O)O)c(=O)c2cc(Br)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L09	compound treatment	1.3	0.0109	0.15	1.259	0.0361	0.49	0.4525	0.88	1923152	CBDivE_016229	O=c1cc([nH]c2nncn12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L10	compound treatment	1.241	-0.0481	-0.65	1.248	0.0251	0.34	-0.2164	-0.295	1923153	CBDivE_016230	[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)OCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L11	compound treatment	1.224	-0.0651	-0.88	1.179	-0.0439	-0.6	-1.0439	-0.9825	1514300	CBDivE_016231	CC1(C)CC(=O)C=C(C1)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L12	compound treatment	1.28	-0.00908	-0.12	1.236	0.0131	0.18	0.0399	0.1841	1923154	CBDivE_016232	Cc1cc(C)c(C(=O)/C=C/c2ccco2)c(=O)[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L13	compound treatment	1.334	0.0449	0.61	1.258	0.0351	0.48	0.7672	0.9932	1923155	CBDivE_016233	O=C(C[n+]1cc[nH]c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L14	compound treatment	1.307	0.0179	0.24	1.228	0.00513	0.07	0.2204	0.8757	1459518	CBDivE_016234	COn1c2CCCCc2c3c1cc(Br)c4nonc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L15	compound treatment	1.248	-0.0411	-0.55	1.165	-0.0579	-0.79	-0.9499	-0.985	1151208	CBDivE_016235	O=C1OC2(CCCCC2)C(=C1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L16	compound treatment	1.273	-0.0161	-0.22	1.228	0.00513	0.07	-0.104	-0.4562	1923156	CBDivE_016236	CCCCCCS(=O)(=O)Nc1ccc(cc1O)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L17	compound treatment	1.324	0.0349	0.47	1.247	0.0241	0.33	0.5657	0.9846	1923157	CBDivE_016237	COc1ccc(/C=C/C(=O)C2(O)CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L18	compound treatment	1.255	-0.0341	-0.46	1.184	-0.0389	-0.53	-0.7	-0.9975	1923158	CBDivE_016238	COc1ccccc1C(=O)Nc2ccc(NC(=O)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L19	compound treatment	1.248	-0.0411	-0.55	1.179	-0.0439	-0.6	-0.8149	-0.9993	1644286	CBDivE_016239	O=C1OC2(CCCCC2)C(=C1)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	L20	compound treatment	1.275	-0.0141	-0.19	1.213	-0.00987	-0.13	-0.2295	-0.9858	1923159	CBDivE_016240	Oc1cccc(/C=N/Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M01	compound treatment	1.307	0.0179	0.24	1.277	0.0541	0.74	0.6928	0.8921	1923160	CBDivE_016241	CCN(C(=O)CCCOc1ccc(Cl)cc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M02	compound treatment	1.231	-0.0581	-0.78	1.165	-0.0579	-0.79	-1.1121	-1.0	1923161	CBDivE_016242	CN(N)c1cc(nc(n1)c2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M03	compound treatment	1.329	0.0399	0.54	1.251	0.0281	0.38	0.652	0.9862	1923162	CBDivE_016243	NC(=O)CC(N1C(=O)/C(=C/c2ccccc2)/SC1=S)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M04	compound treatment	1.272	-0.0171	-0.23	1.236	0.0131	0.18	-0.0364	-0.1247	1923163	CBDivE_016244	Cc1cccc(/N=C/c2cccc(c2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M05	compound treatment	1.249	-0.0401	-0.54	1.208	-0.0149	-0.2	-0.5258	-0.9104	1923164	CBDivE_016245	CC1CCCC(C)N1C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M06	compound treatment	1.23	-0.0591	-0.8	1.183	-0.0399	-0.54	-0.9481	-0.9826	1645278	CBDivE_016246	CC1(C)CC(=O)C(C(C2C(=O)CC(C)(C)CC2=O)c3cccs3)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M07	compound treatment	1.268	-0.0211	-0.28	1.196	-0.0269	-0.37	-0.4602	-0.9921	1273732	CBDivE_016247	Brc1ccc(cc1)C(=O)NCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M08	compound treatment	1.266	-0.0231	-0.31	1.235	0.0121	0.17	-0.1033	-0.2929	1923165	CBDivE_016248	OC(=O)c1cccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M09	compound treatment	1.27	-0.0191	-0.26	1.224	0.00113	0.02	-0.1712	-0.6638	1923166	CBDivE_016249	CC(C)c1ccc(NC(=O)c2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M10	compound treatment	1.292	0.00292	0.04	1.251	0.0281	0.38	0.299	0.7756	1923167	CBDivE_016250	CC1(C)CC(=O)C2=C(C1)OC3=C(C2c4ccc(I)cc4)C(=O)CC(C)(C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M11	compound treatment	1.296	0.00692	0.09	1.24	0.0171	0.23	0.2311	0.919	1923168	CBDivE_016251	CCCCCCOC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M12	compound treatment	1.298	0.00892	0.12	1.244	0.0211	0.29	0.2888	0.925	1923169	CBDivE_016252	CC/C=C(\Cl)/c1c(Cl)cc(C)oc1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M13	compound treatment	1.278	-0.0111	-0.15	1.217	-0.00587	-0.08	-0.1624	-0.9572	1923170	CBDivE_016253	FC(F)(F)C(F)(F)C(F)(F)OC(F)(C(=O)Oc1ccc(Cl)cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M14	compound treatment	1.328	0.0389	0.53	1.279	0.0561	0.77	0.9124	0.9831	1923171	CBDivE_016254	COC(=O)c1c(C)cc(O)c(C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M15	compound treatment	1.296	0.00692	0.09	1.229	0.00613	0.08	0.1251	0.9985	1559860	CBDivE_016255	CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)N2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M16	compound treatment	1.274	-0.0151	-0.2	1.232	0.00913	0.12	-0.0559	-0.2343	1923172	CBDivE_016256	Oc1ccc(/C=N/Cc2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M17	compound treatment	1.292	0.00292	0.04	1.238	0.0151	0.21	0.1737	0.8272	1458957	CBDivE_016257	CCCC1CCC(CC1=O)c2ccc(OCC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M18	compound treatment	1.287	-0.00208	-0.03	1.238	0.0151	0.21	0.126	0.6053	1923173	CBDivE_016258	Cc1cccc(/N=C/c2cccc(O)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M19	compound treatment	1.265	-0.0241	-0.32	1.22	-0.00287	-0.04	-0.2574	-0.7867	1445426	CBDivE_016259	COc1cccc(OC)c1C(=O)Nc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	M20	compound treatment	1.287	-0.00208	-0.03	1.254	0.0311	0.42	0.2803	0.6589	1923174	CBDivE_016260	OC(=O)/C=C\C(=O)Nc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N01	compound treatment	1.258	-0.0311	-0.42	1.206	-0.0169	-0.23	-0.4592	-0.9601	1479651	CBDivE_016261	O=C1OC2(CCCCC2)C(=C1)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N02	compound treatment	1.235	-0.0541	-0.73	1.181	-0.0419	-0.57	-0.9197	-0.9926	1923175	CBDivE_016262	Cc1ccc(/N=C/c2ccc(s2)[N+](=O)[O-])cc1I
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N03	compound treatment	1.233	-0.0561	-0.76	1.194	-0.0289	-0.39	-0.8134	-0.9537	1649077	CBDivE_016263	O=C1OC2(CCCCC2)C(=C1)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N04	compound treatment	1.253	-0.0361	-0.49	1.163	-0.0599	-0.82	-0.9215	-0.9695	1332505	CBDivE_016264	NNc1nnc2c3ccccc3[nH]c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N05	compound treatment	1.246	-0.0431	-0.58	1.198	-0.0249	-0.34	-0.6508	-0.9671	1923176	CBDivE_016265	CC1(C)CC(=O)C(=CNc2ccc(Cl)c(c2)C(F)(F)F)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N06	compound treatment	1.216	-0.0731	-0.99	1.146	-0.0769	-1.05	-1.4384	-0.9995	1923177	CBDivE_016266	Cc1cccc(C)c1NC(=O)c2ccc(Cl)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N07	compound treatment	1.254	-0.0351	-0.47	1.183	-0.0399	-0.54	-0.7191	-0.9976	1923178	CBDivE_016267	CC1(C)CC(=O)C(=CNCC2CCCO2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N08	compound treatment	1.257	-0.0321	-0.43	1.149	-0.0739	-1.01	-1.0184	-0.9288	1923179	CBDivE_016268	Oc1ccc2ccccc2c1/C=N/c3ccc(Cl)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N09	compound treatment	1.277	-0.0121	-0.16	1.144	-0.0789	-1.08	-0.8758	-0.8051	1923180	CBDivE_016269	CC1(C)CC(=O)C(=CNCCN2CCNCC2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N10	compound treatment	1.255	-0.0341	-0.46	1.202	-0.0209	-0.28	-0.5264	-0.9734	1923181	CBDivE_016270	CC1(C)Cc2ccccc2C(=N1)/C=N\O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N11	compound treatment	1.249	-0.0401	-0.54	1.174	-0.0489	-0.67	-0.8536	-0.9946	1923182	CBDivE_016271	Clc1ccc(CNC=C2C(=O)NC(=O)NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N12	compound treatment	1.269	-0.0201	-0.27	1.211	-0.0119	-0.16	-0.3061	-0.9697	1713567	CBDivE_016272	Cc1cccc(C)c1NC(=O)c2ccc(cc2)N3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N13	compound treatment	1.319	0.0299	0.4	1.235	0.0121	0.17	0.4023	0.9224	1923183	CBDivE_016273	OCCO/C(=C\C(=O)O)/C1(O)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N14	compound treatment	1.267	-0.0221	-0.3	1.198	-0.0249	-0.34	-0.4505	-0.9979	1648352	CBDivE_016274	CC1CC(=O)C(C)CN1C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N15	compound treatment	1.279	-0.0101	-0.14	1.18	-0.0429	-0.58	-0.5096	-0.8489	1923184	CBDivE_016275	CCOC(=O)C1=C(C(=O)c2ccccc2C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N16	compound treatment	1.244	-0.0451	-0.61	1.199	-0.0239	-0.33	-0.6603	-0.9571	1923185	CBDivE_016276	CC(C)(C)NCCC(=O)C1=CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N17	compound treatment	1.238	-0.0511	-0.69	1.186	-0.0369	-0.5	-0.8428	-0.988	1104152	CBDivE_016277	CCOC(=O)C(=C(N)C(Cl)(Cl)Cl)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N18	compound treatment	1.259	-0.0301	-0.41	1.201	-0.0219	-0.3	-0.4979	-0.9885	1923186	CBDivE_016278	C/C=C(\C)/C(=O)CCNC(C)(C)C#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N19	compound treatment	1.283	-0.00608	-0.08	1.236	0.0131	0.18	0.0685	0.3481	1923187	CBDivE_016279	FC(F)(F)c1cc(NC=C2C(=O)c3ccccc3C2=O)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	N20	compound treatment	1.264	-0.0251	-0.34	1.204	-0.0189	-0.26	-0.4213	-0.9909	1694405	CBDivE_016280	O=C1CNC(=O)C2N1CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O01	compound treatment	1.304	0.0149	0.2	1.24	0.0171	0.23	0.3074	0.9973	1004958	CBDivE_016281	Cc1cccc(OP(=O)(Oc2cccc(C)c2)Oc3cccc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O02	compound treatment	1.335	0.0459	0.62	1.281	0.0581	0.79	0.9985	0.9926	1923188	CBDivE_016282	COc1ccc(/C=N/Cc2ccccc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O03	compound treatment	1.344	0.0549	0.74	1.265	0.0421	0.57	0.9301	0.9921	1923189	CBDivE_016283	CC(N)CNc1ccc(Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O04	compound treatment	1.329	0.0399	0.54	1.264	0.0411	0.56	0.7773	0.9998	1342853	CBDivE_016284	OC(=O)C1CCCCC1C(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O05	compound treatment	1.312	0.0229	0.31	1.247	0.0241	0.33	0.4513	0.9995	1923190	CBDivE_016285	NCCCNc1ccc(Cl)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O06	compound treatment	1.277	-0.0121	-0.16	1.196	-0.0269	-0.37	-0.3744	-0.9334	1049311	CBDivE_016286	OC(=O)c1ccc(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O07	compound treatment	1.309	0.0199	0.27	1.21	-0.0129	-0.18	0.0659	0.2052	1336037	CBDivE_016287	CC(C)(C)OC(=O)NCC1(OC2C=C1)C3C2C(=O)N(Cc4ccccc4)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O08	compound treatment	1.261	-0.0281	-0.38	1.207	-0.0159	-0.22	-0.4209	-0.9648	1101777	CBDivE_016288	Cc1c(C)c(O)c2C(=O)c3ccccc3C(=O)c2c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O09	compound treatment	1.334	0.0449	0.61	1.275	0.0521	0.71	0.9311	0.9968	1923191	CBDivE_016289	COC(=O)c1c(F)c(F)c(F)c(F)c1C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O10	compound treatment	1.328	0.0389	0.53	1.276	0.0531	0.72	0.8835	0.9875	1923192	CBDivE_016290	BrCC1CN=C(Nc2ccccc2)S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O11	compound treatment	1.31	0.0209	0.28	1.219	-0.00387	-0.05	0.1622	0.5649	1923193	CBDivE_016291	c1ccc(cc1)c2nc3ccccc3c4nnnn24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O12	compound treatment	1.391	0.102	1.37	1.265	0.0421	0.57	1.3784	0.925	1703238	CBDivE_016292	Cc1cc(C)n(n1)c2nc3n(C)c(=O)n(C)c(=O)c3n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O13	compound treatment	1.321	0.0319	0.43	1.224	0.00113	0.02	0.3153	0.7318	1923194	CBDivE_016293	CCCCCc1ccc(cc1)c2ccc(cc2)c3ncc(/N=C/N(C)C)cn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O14	compound treatment	1.345	0.0559	0.75	1.276	0.0531	0.72	1.0457	0.9998	1923195	CBDivE_016294	[O-][N+]1(CC[N+]2([O-])CC1)c3ccccc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O15	compound treatment	1.301	0.0119	0.16	1.262	0.0391	0.53	0.491	0.8811	1923196	CBDivE_016295	FC(F)(F)c1cc(Cl)nc(n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O16	compound treatment	1.303	0.0139	0.19	1.239	0.0161	0.22	0.2883	0.9969	1923197	CBDivE_016296	C/C=C/C(=N\NC(=O)N)/C1C(=CCCC1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O17	compound treatment	1.315	0.0259	0.35	1.231	0.00813	0.11	0.3256	0.8877	1923198	CBDivE_016297	FC(F)(F)c1cc(=O)[nH]c(n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O18	compound treatment	1.284	-0.00508	-0.07	1.226	0.00313	0.04	-0.0183	-0.2272	1923199	CBDivE_016298	CC1(C)CC(=O)C(=C(N)NC(=O)c2ccccc2)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O19	compound treatment	1.298	0.00892	0.12	1.197	-0.0259	-0.35	-0.1644	-0.441	1923200	CBDivE_016299	CC(C)(C)c1cc(CCC(c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	O20	compound treatment	1.378	0.0889	1.2	1.301	0.0781	1.07	1.6015	0.9982	1777360	CBDivE_016300	Cn1c(=O)[nH]c(=O)c2c1nc3oc(cn32)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P01	compound treatment	1.32	0.0309	0.42	1.23	0.00713	0.1	0.3636	0.8491	1274798	CBDivE_016301	CCCCC1=C(O)C(=O)c2ccccc2C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P02	compound treatment	1.266	-0.0231	-0.31	1.187	-0.0359	-0.49	-0.5661	-0.9762	1923201	CBDivE_016302	Fc1ccc(cc1)c2sc(N/N=C/c3ccc(Cl)cc3)nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P03	compound treatment	1.307	0.0179	0.24	1.215	-0.00787	-0.11	0.095	0.3592	1923202	CBDivE_016303	Cc1ccc(C)c(NC(=O)c2c(F)cccc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P04	compound treatment	1.21	-0.0791	-1.07	1.122	-0.101	-1.38	-1.7271	-0.9921	1923203	CBDivE_016304	Fc1ccc(cc1)c2sc(N/N=C/c3ccc(Br)cc3)nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P05	compound treatment	1.285	-0.00408	-0.06	1.273	0.0501	0.68	0.4444	0.648	1923204	CBDivE_016305	COc1cccc(c1)C(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P06	compound treatment	1.265	-0.0241	-0.32	1.207	-0.0159	-0.22	-0.3828	-0.9805	1627121	CBDivE_016306	Cc1ccccc1Nc2nc3CCCCc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P07	compound treatment	1.246	-0.0431	-0.58	1.174	-0.0489	-0.67	-0.8822	-0.9977	1923205	CBDivE_016307	CC(=O)CC(=O)Nc1c(C)cccc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P08	compound treatment	1.213	-0.0761	-1.03	1.107	-0.116	-1.58	-1.8431	-0.9782	1433180	CBDivE_016308	Brc1ccc(Nc2nc3CCCCc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P09	compound treatment	1.216	-0.0731	-0.99	1.15	-0.0729	-0.99	-1.3998	-1.0	1923206	CBDivE_016309	Cc1cc(cc(C)c1N)C(c2ccco2)c3cc(C)c(N)c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P10	compound treatment	0.733	-0.556	-7.5	0.779	-0.444	-6.05	-9.5847	-0.9943	1184255	CBDivE_016310	Cc1ccc(NS(=O)(=O)c2ccc(Br)cc2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P11	compound treatment	1.245	-0.0441	-0.59	1.171	-0.0519	-0.71	-0.9207	-0.9963	1077461	CBDivE_016311	Cc1c(F)c(F)c(C(=O)O)c(F)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P12	compound treatment	1.279	-0.0101	-0.14	1.215	-0.00787	-0.11	-0.1721	-0.9932	1923207	CBDivE_016312	CC(=O)c1cccc(NC(=O)CSCc2cccc(Br)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P13	compound treatment	1.22	-0.0691	-0.93	1.115	-0.108	-1.47	-1.6992	-0.9757	1923208	CBDivE_016313	Fc1cccc(F)c1C(=O)Nc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P14	compound treatment	1.271	-0.0181	-0.24	1.203	-0.0199	-0.27	-0.3641	-0.9986	1672131	CBDivE_016314	CC(C)CN1CC(C)C(O)(CC1C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P15	compound treatment	1.213	-0.0761	-1.03	1.153	-0.0699	-0.95	-1.3995	-0.9993	1923209	CBDivE_016315	Oc1ccc(cc1O)C(=O)CNC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P16	compound treatment	1.253	-0.0361	-0.49	1.209	-0.0139	-0.19	-0.478	-0.9152	1923210	CBDivE_016316	CCOc1ccc(cc1)C2=CC(=O)C(CC2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P17	compound treatment	1.283	-0.00608	-0.08	1.209	-0.0139	-0.19	-0.1918	-0.9301	1923211	CBDivE_016317	FC(F)(F)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P18	compound treatment	1.268	-0.0211	-0.28	1.198	-0.0249	-0.34	-0.441	-0.9962	1923212	CBDivE_016318	CCC(=O)OC1(CCN(C)C(C)C1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P19	compound treatment	1.275	-0.0141	-0.19	1.197	-0.0259	-0.35	-0.3838	-0.9578	1923213	CBDivE_016319	OCCN1CCN(CC#CCn2c3ccccc3c4ccccc24)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.51	P20	compound treatment	1.32	0.0309	0.42	1.254	0.0311	0.42	0.5951	1.0	1923214	CBDivE_016320	Cc1cc(cc(c1NC(=O)/C=C/C(=O)O)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A03	compound treatment	0.797	-0.00124	-0.02	0.703	0.00781	0.11	0.0635	0.5892	1965364	Cerep_000001	COc1ccc2[nH]cc(CCNC(=O)OCCCCCCN(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A04	compound treatment	0.814	0.0158	0.21	0.723	0.0278	0.38	0.4185	0.9626	1965365	Cerep_000002	COc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A05	compound treatment	0.815	0.0168	0.23	0.716	0.0208	0.28	0.3605	0.9937	1965366	Cerep_000003	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCc3cc4OCOc4cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A06	compound treatment	0.797	-0.00124	-0.02	0.682	-0.0132	-0.18	-0.139	-0.7693	1965367	Cerep_000004	O=C(N/N=C/c1ccc(\C=C\c2ccccc2)cc1)c3ccccc3Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A07	compound treatment	0.808	0.00976	0.13	0.697	0.00181	0.02	0.1106	0.825	1965368	Cerep_000005	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCC3(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A08	compound treatment	0.792	-0.00624	-0.08	0.706	0.0108	0.15	0.0447	0.2635	1965369	Cerep_000006	Clc1ccc(Oc2cccc(/C=N/NC(=O)C3CC3c4ccccc4)c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A09	compound treatment	0.786	-0.0122	-0.17	0.679	-0.0162	-0.22	-0.2729	-0.9897	1965370	Cerep_000007	CC(=CC1C(CNC(=O)OCCc2ccc(Br)cc2)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A10	compound treatment	0.765	-0.0332	-0.45	0.69	-0.00519	-0.07	-0.3671	-0.8088	1965371	Cerep_000008	Clc1ccccc1OCC(=O)N/N=C/c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A11	compound treatment	0.814	0.0158	0.21	0.682	-0.0132	-0.18	0.0232	0.0831	1965372	Cerep_000009	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A12	compound treatment	0.809	0.0108	0.15	0.702	0.00681	0.09	0.1683	0.9766	1965373	Cerep_000010	COc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A13	compound treatment	0.778	-0.0202	-0.27	0.695	-1.94E-4	0.0	-0.1949	-0.7139	1965374	Cerep_000011	COc1cc(CCNC(=O)OCCc2cccc(C)c2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A14	compound treatment	0.799	7.65E-4	0.01	0.673	-0.0222	-0.3	-0.2067	-0.6826	1965375	Cerep_000012	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccc(\C=C\c4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A15	compound treatment	0.782	-0.0162	-0.22	0.701	0.00581	0.08	-0.0989	-0.4246	1965376	Cerep_000013	Fc1ccc(/C=C/C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A16	compound treatment	0.783	-0.0152	-0.21	0.701	0.00581	0.08	-0.0894	-0.4057	1965377	Cerep_000014	CC(=O)n1cc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A17	compound treatment	0.782	-0.0162	-0.22	0.707	0.0118	0.16	-0.041	-0.151	1965378	Cerep_000015	CN(C)c1ccc(cc1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A18	compound treatment	0.806	0.00776	0.1	0.707	0.0118	0.16	0.1879	0.9783	1965379	Cerep_000016	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A19	compound treatment	0.774	-0.0242	-0.33	0.713	0.0178	0.24	-0.0595	-0.1461	1965380	Cerep_000017	CCCCCOC(=O)N1CCC(O)(Cc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A20	compound treatment	0.8	0.00176	0.02	0.707	0.0118	0.16	0.1307	0.803	1965381	Cerep_000018	COc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A21	compound treatment	0.793	-0.00524	-0.07	0.719	0.0238	0.32	0.1796	0.5406	1965382	Cerep_000019	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	A22	compound treatment	0.804	0.00576	0.08	0.708	0.0128	0.17	0.1785	0.9336	1965383	Cerep_000020	COc1ccc(cc1)C(=O)N/N=C/c2ccc(C)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B03	compound treatment	0.837	0.0388	0.52	0.708	0.0128	0.17	0.4933	0.8947	1965384	Cerep_000021	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)c3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B04	compound treatment	0.78	-0.0182	-0.25	0.656	-0.0392	-0.53	-0.5519	-0.938	1965385	Cerep_000022	CC(C(=O)NNC(=O)c1ccc2nsnc2c1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B05	compound treatment	0.829	0.0308	0.42	0.71	0.0148	0.2	0.4362	0.9452	1965386	Cerep_000023	CCc1ccc(cc1)c2ccc(cc2)C(=O)NCCCOC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B06	compound treatment	0.786	-0.0122	-0.17	0.675	-0.0202	-0.28	-0.3114	-0.97	1965387	Cerep_000024	Cc1oc(nc1CC(=O)N2CCC(CC2)C(O)(c3ccccc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B07	compound treatment	0.779	-0.0192	-0.26	0.685	-0.0102	-0.14	-0.2818	-0.9572	1965388	Cerep_000025	O=C(NCc1ccccc1)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B08	compound treatment	0.741	-0.0572	-0.77	0.66	-0.0352	-0.48	-0.8853	-0.9738	1965389	Cerep_000026	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)NNC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B09	compound treatment	0.832	0.0338	0.46	0.692	-0.00319	-0.04	0.2913	0.6366	1965390	Cerep_000027	CC(C)(C)OC(=O)NC1CCN(C1)C(=O)c2csc(n2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B10	compound treatment	0.779	-0.0192	-0.26	0.685	-0.0102	-0.14	-0.2818	-0.9572	1965391	Cerep_000028	Cc1cc(C(=O)NCCNC(=O)OC(C)(C)C)c(C)n1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B11	compound treatment	0.812	0.0138	0.19	0.707	0.0118	0.16	0.2451	0.9975	1965392	Cerep_000029	COc1cc(ccc1CN2CCC(C2)NC(=O)c3ccc(C)cc3)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B12	compound treatment	0.751	-0.0472	-0.64	0.678	-0.0172	-0.23	-0.6164	-0.9078	1965393	Cerep_000030	Cc1onc(C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3C(C)(C)C)C(C)(C)C)c1c4csc(n4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B13	compound treatment	0.814	0.0158	0.21	0.682	-0.0132	-0.18	0.0232	0.0831	1965394	Cerep_000031	[O-][N+](=O)c1ccc(OCC(=O)NNC(=O)c2ccc3[nH]nnc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B14	compound treatment	0.759	-0.0392	-0.53	0.673	-0.0222	-0.3	-0.5883	-0.9648	1965395	Cerep_000032	CC(C)(C)OC(=O)NCCCCCNC(=O)CCCCCNC(=O)OCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B15	compound treatment	0.832	0.0338	0.46	0.726	0.0308	0.42	0.6191	0.9992	1965396	Cerep_000033	CN(C)c1ccc(CN2CCC(C2)NC(=O)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6)c7ccccc17
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B16	compound treatment	0.784	-0.0142	-0.19	0.699	0.00381	0.05	-0.0991	-0.4982	1965397	Cerep_000034	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccccc3COC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B17	compound treatment	0.832	0.0338	0.46	0.696	8.06E-4	0.01	0.3299	0.724	1965398	Cerep_000035	Fc1ccc(/C=C/C(=O)NNC(=O)CC2Cc3ccccc3C2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B18	compound treatment	0.773	-0.0252	-0.34	0.659	-0.0362	-0.49	-0.5897	-0.9836	1965399	Cerep_000036	Fc1ccc(cc1)C(=O)CCC(=O)NCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B19	compound treatment	0.804	0.00576	0.08	0.695	-1.94E-4	0.0	0.0531	0.6826	1965400	Cerep_000037	CN1CCN(CCCNC(=O)c2ccc(s2)c3ccccn3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B20	compound treatment	0.794	-0.00424	-0.06	0.676	-0.0192	-0.26	-0.2255	-0.8416	1965401	Cerep_000038	CSc1sc(C(=O)NNC(=O)Cc2c(Cl)cccc2Cl)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B21	compound treatment	0.8	0.00176	0.02	0.698	0.00281	0.04	0.0439	0.974	1965402	Cerep_000039	Cc1cc(/C=N/NC(=O)c2ccccc2OC(F)(F)F)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	B22	compound treatment	0.736	-0.0622	-0.84	0.643	-0.0522	-0.71	-1.097	-0.9966	1965403	Cerep_000040	CN(C)CCCN(C)C(=O)c1ccc2[nH]nnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C03	compound treatment	0.829	0.0308	0.42	0.724	0.0288	0.39	0.5712	0.9996	1965404	Cerep_000041	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccnc(Cl)c3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C04	compound treatment	0.804	0.00576	0.08	0.705	0.00981	0.13	0.1495	0.9668	1965405	Cerep_000042	COc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C05	compound treatment	0.807	0.00876	0.12	0.737	0.0418	0.57	0.4867	0.836	1965406	Cerep_000043	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCCc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C06	compound treatment	0.806	0.00776	0.1	0.729	0.0338	0.46	0.4	0.8462	1965407	Cerep_000044	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(Br)cc(OC)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C07	compound treatment	0.81	0.0118	0.16	0.701	0.00581	0.08	0.1682	0.9484	1965408	Cerep_000045	CCOc1ccsc1C(=O)NNC(=O)OCCN2CCNC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C08	compound treatment	0.794	-0.00424	-0.06	0.699	0.00381	0.05	-0.0037	-0.048	1965409	Cerep_000046	Clc1cc(Cl)c(Cl)c(/C=N/NC(=O)c2ccccc2Oc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C09	compound treatment	0.774	-0.0242	-0.33	0.695	-1.94E-4	0.0	-0.2331	-0.7128	1965410	Cerep_000047	CN1CCN(CCCNC(=O)OCCc2ccc(Cl)cc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C10	compound treatment	0.769	-0.0292	-0.39	0.706	0.0108	0.15	-0.1747	-0.4149	1965411	Cerep_000048	CCOc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C11	compound treatment	0.789	-0.00924	-0.12	0.698	0.00281	0.04	-0.061	-0.4684	1965412	Cerep_000049	CC(C)(C)c1ccc(COC(=O)NC(Cc2ccccc2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C12	compound treatment	0.799	7.65E-4	0.01	0.709	0.0138	0.19	0.1404	0.7447	1965413	Cerep_000050	COc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C13	compound treatment	0.796	-0.00224	-0.03	0.702	0.00681	0.09	0.0443	0.454	1965414	Cerep_000051	Clc1ccc(CCOC(=O)NNC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C14	compound treatment	0.829	0.0308	0.42	0.716	0.0208	0.28	0.4941	0.9828	1965415	Cerep_000052	COc1cc(Br)cc(/C=N\NC(=O)Cc2c[nH]c3ccccc23)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C15	compound treatment	0.759	-0.0392	-0.53	0.686	-0.00919	-0.13	-0.4629	-0.8511	1965416	Cerep_000053	Brc1ccccc1CCOC(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C16	compound treatment	0.786	-0.0122	-0.17	0.718	0.0228	0.31	0.1032	0.2931	1965417	Cerep_000054	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2cc(Cl)cc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C17	compound treatment	0.789	-0.00924	-0.12	0.71	0.0148	0.2	0.0547	0.2304	1965418	Cerep_000055	Cc1csc2c(SCC(=O)NNC(=O)OCCc3ccccc3C)ncnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C18	compound treatment	0.809	0.0108	0.15	0.711	0.0158	0.22	0.2551	0.9815	1965419	Cerep_000056	CCOc1ccc(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C19	compound treatment	0.805	0.00676	0.09	0.667	-0.0282	-0.38	-0.2073	-0.5247	1965420	Cerep_000057	O=C(NCCCn1ccnc1)OCc2cccc(Oc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C20	compound treatment	0.798	-2.35E-4	0.0	0.716	0.0208	0.28	0.1984	0.6992	1965421	Cerep_000058	COc1ccc(cc1)C(=O)N/N=C/c2cc(F)ccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C21	compound treatment	0.845	0.0468	0.63	0.707	0.0118	0.16	0.5599	0.86	1965422	Cerep_000059	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cc5OCOc5cc4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	C22	compound treatment	0.81	0.0118	0.16	0.692	-0.00319	-0.04	0.0814	0.4947	1965423	Cerep_000060	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc(OC)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D03	compound treatment	0.81	0.0118	0.16	0.709	0.0138	0.19	0.2453	0.9964	1965424	Cerep_000061	CC(C)(C)OC(=O)NCCCCCNC(=O)c1ccc(cc1)n2nc(cc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D04	compound treatment	0.775	-0.0232	-0.31	0.689	-0.00619	-0.08	-0.2814	-0.8667	1965425	Cerep_000062	COc1cccc(c1)C(=O)NNC(=O)c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D05	compound treatment	0.853	0.0548	0.74	0.701	0.00581	0.08	0.5784	0.7784	1965426	Cerep_000063	Cc1csc(C(=O)NNC(=O)CCCCCNC(=O)OCc2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D06	compound treatment	0.79	-0.00824	-0.11	0.688	-0.00719	-0.1	-0.1479	-0.9981	1526898	Cerep_000064	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)c5ccccc5OC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D07	compound treatment	0.82	0.0218	0.29	0.677	-0.0182	-0.25	0.0322	0.0837	1965427	Cerep_000065	COc1ccc(CNC(=O)CCc2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D08	compound treatment	0.747	-0.0512	-0.69	0.67	-0.0252	-0.34	-0.7317	-0.9479	1965428	Cerep_000066	Cc1nc(sc1C(=O)NNC(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4)c5cccc(c5)n6cccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D09	compound treatment	0.832	0.0338	0.46	0.662	-0.0332	-0.45	0.002	0.0031	1965429	Cerep_000067	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2cc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D10	compound treatment	0.775	-0.0232	-0.31	0.697	0.00181	0.02	-0.2042	-0.6496	1965430	Cerep_000068	Fc1ccc(cc1)C(=O)CCC(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D11	compound treatment	0.842	0.0438	0.59	0.702	0.00681	0.09	0.4831	0.8083	1965431	Cerep_000069	COc1ccc(Br)cc1CCNC(=O)CC2Cc3ccccc3C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D12	compound treatment	0.786	-0.0122	-0.17	0.664	-0.0312	-0.43	-0.4175	-0.915	1965432	Cerep_000070	CC/1=C(CC(=O)N2CCCN(CC2)C(=O)OC(C)(C)C)c3cc(F)ccc3\C1=C/c4ccc(cc4)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D13	compound treatment	0.83	0.0318	0.43	0.688	-0.00719	-0.1	0.2336	0.5315	1965433	Cerep_000071	Cc1nn(Cc2nnn(CC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D14	compound treatment	0.764	-0.0342	-0.46	0.677	-0.0182	-0.25	-0.502	-0.9575	1965434	Cerep_000072	O=C(NCCc1c[nH]cn1)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D15	compound treatment	0.843	0.0448	0.6	0.7	0.00481	0.07	0.4734	0.7793	1965435	Cerep_000073	CCCCC(C)C(=O)NNC(=O)c1sc(SC)c2c1CCCC32SCCS3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D16	compound treatment	0.777	-0.0212	-0.29	0.686	-0.00919	-0.13	-0.2912	-0.9313	1965436	Cerep_000074	Fc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D17	compound treatment	0.856	0.0578	0.78	0.68	-0.0152	-0.21	0.4045	0.5017	1965437	Cerep_000075	CC1CC(C2CCCC12)C(=O)NNC(=O)c3ccc4nsnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D18	compound treatment	0.757	-0.0412	-0.56	0.65	-0.0452	-0.62	-0.8291	-0.9987	1965438	Cerep_000076	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)c2ccc(Br)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D19	compound treatment	0.851	0.0528	0.71	0.683	-0.0122	-0.17	0.3858	0.5277	1965439	Cerep_000077	O=C(N1CCN(C/C=C/c2ccccc2)CC1)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D20	compound treatment	0.774	-0.0242	-0.33	0.694	-0.00119	-0.02	-0.2427	-0.7414	1965440	Cerep_000078	O=C(N1CCC2(CC1)N(CNC2=O)c3ccccc3)c4ccc(CSc5ccccn5)o4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D21	compound treatment	0.836	0.0378	0.51	0.714	0.0188	0.26	0.5416	0.9495	1965441	Cerep_000079	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(C)n(c2C)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	D22	compound treatment	0.776	-0.0222	-0.3	0.676	-0.0192	-0.26	-0.3972	-0.9977	1965442	Cerep_000080	O=C(CCc1ccc2OCOc2c1)NNC(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E03	compound treatment	0.783	-0.0152	-0.21	0.705	0.00981	0.13	-0.0508	-0.2071	1965443	Cerep_000081	C=CCCCOC(=O)NNC(=O)CC1Sc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E04	compound treatment	0.801	0.00276	0.04	0.692	-0.00319	-0.04	-0.0044	-0.0772	1965444	Cerep_000082	CN(C)c1ccc(/C=N/NC(=O)c2ccc3nonc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E05	compound treatment	0.801	0.00276	0.04	0.7	0.00481	0.07	0.0727	0.9643	1965445	Cerep_000083	O=C(NCCCn1ccnc1)OCc2ccc(/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E06	compound treatment	0.787	-0.0112	-0.15	0.681	-0.0142	-0.19	-0.244	-0.9927	1965446	Cerep_000084	COc1ccc(Cl)cc1C(=O)N/N=C/C2=CCC(CC2)C(=C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E07	compound treatment	0.789	-0.00924	-0.12	0.706	0.0108	0.15	0.0161	0.0834	1965447	Cerep_000085	CC(COC(=O)NNC(=O)c1csc(Cn2cnc(Cl)c2Cl)n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E08	compound treatment	0.808	0.00976	0.13	0.704	0.00881	0.12	0.1781	0.9989	1965448	Cerep_000086	Cc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E09	compound treatment	0.807	0.00876	0.12	0.722	0.0268	0.37	0.3421	0.8904	1965449	Cerep_000087	CN(C)c1ccc(CCOC(=O)NC2CCN(Cc3c(F)cccc3Cl)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E10	compound treatment	0.801	0.00276	0.04	0.733	0.0378	0.52	0.3909	0.7563	1965450	Cerep_000088	CCN(CC)c1ccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E11	compound treatment	0.775	-0.0232	-0.31	0.709	0.0138	0.19	-0.0885	-0.2421	1965451	Cerep_000089	CN(C)CCN1CCN(CC1)C(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E12	compound treatment	0.755	-0.0432	-0.58	0.693	-0.00219	-0.03	-0.4336	-0.7424	1965452	Cerep_000090	CN(C)c1ccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E13	compound treatment	0.768	-0.0302	-0.41	0.684	-0.0112	-0.15	-0.3964	-0.9101	1965453	Cerep_000091	Cc1ccc(CCOC(=O)N2CCC(O)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E14	compound treatment	0.767	-0.0312	-0.42	0.691	-0.00419	-0.06	-0.3384	-0.7958	1965454	Cerep_000092	CC(=C)C1CCC(=CC1)/C=N/NC(=O)Cc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E15	compound treatment	0.803	0.00476	0.06	0.702	0.00681	0.09	0.1111	0.9839	1965455	Cerep_000093	CC(COC(=O)NNC(=O)CSc1ncnc2c(C)csc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E16	compound treatment	0.76	-0.0382	-0.52	0.687	-0.00819	-0.11	-0.4438	-0.8408	1965456	Cerep_000094	Cc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E17	compound treatment	0.811	0.0128	0.17	0.699	0.00381	0.05	0.1585	0.8811	1965457	Cerep_000095	COc1cc(CCNC(=O)OCC(C)C2CCC(=CC2)C)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E18	compound treatment	0.781	-0.0172	-0.23	0.707	0.0118	0.16	-0.0506	-0.1788	1965458	Cerep_000096	CCN(CC)c1ccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E19	compound treatment	0.814	0.0158	0.21	0.708	0.0128	0.17	0.2739	0.9952	1965459	Cerep_000097	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)OCc3cc4OCOc4cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E20	compound treatment	0.809	0.0108	0.15	0.708	0.0128	0.17	0.2262	0.9958	1965460	Cerep_000098	CC(C)(C)OC(=O)Oc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E21	compound treatment	0.82	0.0218	0.29	0.702	0.00681	0.09	0.2732	0.8873	1965461	Cerep_000099	COc1cc(OC)c(CN2CCCCC2COC(=O)NCc3ccc(cc3)c4csnn4)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	E22	compound treatment	0.785	-0.0132	-0.18	0.718	0.0228	0.31	0.0936	0.2611	1965462	Cerep_000100	COc1ccc(cc1)C(=O)N/N=C/c2ccc(CO)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F03	compound treatment	0.831	0.0328	0.44	0.71	0.0148	0.2	0.4553	0.937	1965463	Cerep_000101	FC(F)(F)Oc1ccccc1C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F04	compound treatment	0.785	-0.0132	-0.18	0.653	-0.0422	-0.58	-0.5331	-0.8849	1965464	Cerep_000102	CC(CCC=C(C)C)CC(=O)NNC(=O)c1ccc2nsnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F05	compound treatment	0.816	0.0178	0.24	0.703	0.00781	0.11	0.2447	0.9333	1965465	Cerep_000103	Cc1ccc(cc1)C(=O)NCC2CCCCC2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F06	compound treatment	0.776	-0.0222	-0.3	0.672	-0.0232	-0.32	-0.4358	-0.9996	1965466	Cerep_000104	COCCC(=O)N1CCC(Cc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F07	compound treatment	0.818	0.0198	0.27	0.692	-0.00319	-0.04	0.1577	0.5839	1965467	Cerep_000105	O=C(NNC(=O)c1ccc2[nH]nnc2c1)c3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F08	compound treatment	0.753	-0.0452	-0.61	0.664	-0.0312	-0.43	-0.7323	-0.9844	1965468	Cerep_000106	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)c2ccc(CSc3ccccn3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F09	compound treatment	0.824	0.0258	0.35	0.686	-0.00919	-0.13	0.1571	0.4252	1965469	Cerep_000107	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c3scc(C)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F10	compound treatment	0.774	-0.0242	-0.33	0.679	-0.0162	-0.22	-0.3873	-0.9817	1965470	Cerep_000108	Brc1ccc(o1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F11	compound treatment	0.806	0.00776	0.1	0.678	-0.0172	-0.23	-0.0917	-0.3572	1965471	Cerep_000109	CC(NC(=O)c1ccc(NC(=O)C)cc1)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F12	compound treatment	0.758	-0.0402	-0.54	0.648	-0.0472	-0.64	-0.8389	-0.9964	1965472	Cerep_000110	COc1cc(OC)cc(c1)C(=O)NC2CCN(Cc3cccc(OC)c3[N+](=O)[O-])C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F13	compound treatment	0.843	0.0448	0.6	0.694	-0.00119	-0.02	0.4155	0.6878	1965473	Cerep_000111	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c3c(C)noc3c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F14	compound treatment	0.776	-0.0222	-0.3	0.685	-0.0102	-0.14	-0.3104	-0.9389	1965474	Cerep_000112	CC(=O)Nc1ccc(cc1NC(=O)C)C(=O)NCc2ccc(C)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F15	compound treatment	0.824	0.0258	0.35	0.722	0.0268	0.37	0.5043	0.9997	1965475	Cerep_000113	CC(C)(C)OC(=O)NCCNC(=O)c1ccccc1c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F16	compound treatment	0.743	-0.0552	-0.75	0.706	0.0108	0.15	-0.4227	-0.5565	1965476	Cerep_000114	CC(C)CC(NC(=O)c1ccc(cc1)N2N=C(C)CC2=O)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F17	compound treatment	0.799	7.65E-4	0.01	0.696	8.06E-4	0.01	0.0151	0.9995	1965477	Cerep_000115	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)c5ccccc5COC(=O)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F18	compound treatment	0.778	-0.0202	-0.27	0.69	-0.00519	-0.07	-0.2431	-0.862	1965478	Cerep_000116	COc1cc(nc2ccccc12)C(=O)NNC(=O)CNC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F19	compound treatment	0.79	-0.00824	-0.11	0.694	-0.00119	-0.02	-0.0901	-0.8022	1965479	Cerep_000117	Brc1ccc(NC(=O)CCC(=O)NCC(=O)NNC(=O)OCc2ccccc2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F20	compound treatment	0.749	-0.0492	-0.66	0.66	-0.0352	-0.48	-0.809	-0.9873	1965480	Cerep_000118	Cc1nn(nc1C(=O)NNC(=O)CCc2nc3ccccc3n2C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F21	compound treatment	0.808	0.00976	0.13	0.742	0.0468	0.64	0.5445	0.8354	1965481	Cerep_000119	CCOc1cccc(c1)C(=O)N/N=C/c2ccc(OC(=O)OC(C)(C)C)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	F22	compound treatment	0.742	-0.0562	-0.76	0.678	-0.0172	-0.23	-0.7022	-0.8844	1965482	Cerep_000120	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G03	compound treatment	0.801	0.00276	0.04	0.708	0.0128	0.17	0.1499	0.8392	1965483	Cerep_000121	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCc3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G04	compound treatment	0.808	0.00976	0.13	0.716	0.0208	0.28	0.2938	0.9391	1965484	Cerep_000122	COc1cccc(OC)c1/C=N/NC(=O)c2cc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G05	compound treatment	0.794	-0.00424	-0.06	0.685	-0.0102	-0.14	-0.1387	-0.9228	1965485	Cerep_000123	Fc1cccc(F)c1C(=O)Nc2ccccc2C(=O)NNC(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G06	compound treatment	0.789	-0.00924	-0.12	0.698	0.00281	0.04	-0.061	-0.4684	1965486	Cerep_000124	COc1ccc(Cl)cc1C(=O)N/N=C/c2ccc(O)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G07	compound treatment	0.779	-0.0192	-0.26	0.694	-0.00119	-0.02	-0.195	-0.75	1965487	Cerep_000125	Cc1ccc2nc(cc(N3CCN(CC3)C(=O)OCCSCc4ccc5nonc5c4)c2c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G08	compound treatment	0.78	-0.0182	-0.25	0.705	0.00981	0.13	-0.0794	-0.2836	1965488	Cerep_000126	O=C(N/N=C/c1ccc2ccccc2n1)c3ccccc3Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G09	compound treatment	0.827	0.0288	0.39	0.711	0.0158	0.22	0.4268	0.9615	1965489	Cerep_000127	COc1ccccc1C2CCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G10	compound treatment	0.812	0.0138	0.19	0.702	0.00681	0.09	0.1969	0.9486	1965490	Cerep_000128	O=C(Cc1c[nH]c2ccccc12)N/N=C/c3ccc(OCc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G11	compound treatment	0.764	-0.0342	-0.46	0.704	0.00881	0.12	-0.2417	-0.5064	1965491	Cerep_000129	CSc1nnc(SC)n1CCNC(=O)OCCc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G12	compound treatment	0.795	-0.00324	-0.04	0.692	-0.00319	-0.04	-0.0617	-1.0	1965492	Cerep_000130	COc1cccc(OC)c1/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G13	compound treatment	0.789	-0.00924	-0.12	0.696	8.06E-4	0.01	-0.0803	-0.6423	1965493	Cerep_000131	CC(CCOC(=O)N1CCC(CC1)C(=O)c2ccc(F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G14	compound treatment	0.796	-0.00224	-0.03	0.706	0.0108	0.15	0.0829	0.551	1918688	Cerep_000132	COc1cc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G15	compound treatment	0.783	-0.0152	-0.21	0.697	0.00181	0.02	-0.1279	-0.618	1965494	Cerep_000133	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCCCCCN(C)C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G16	compound treatment	0.79	-0.00824	-0.11	0.688	-0.00719	-0.1	-0.1479	-0.9981	1965495	Cerep_000134	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G17	compound treatment	0.812	0.0138	0.19	0.737	0.0418	0.57	0.5344	0.8913	1965496	Cerep_000135	Clc1ccc(cc1)C2(COC(=O)NC(Cc3c[nH]c4ccccc34)C(=O)OCc5ccccc5)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G18	compound treatment	0.791	-0.00724	-0.1	0.669	-0.0262	-0.36	-0.3216	-0.8685	1965497	Cerep_000136	FC(F)(F)c1ccc(nc1)S(=O)(=O)CC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G19	compound treatment	0.811	0.0128	0.17	0.683	-0.0122	-0.17	0.0042	0.0175	1965498	Cerep_000137	CCN(CCOC(=O)NNC(=O)c1ccccc1NC(=O)c2cccs2)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G20	compound treatment	0.798	-2.35E-4	0.0	0.692	-0.00319	-0.04	-0.033	-0.7566	1965499	Cerep_000138	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2cc(F)cc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G21	compound treatment	0.821	0.0228	0.31	0.716	0.0208	0.28	0.4178	0.9992	1965500	Cerep_000139	COc1cc(CN2CCN(CCOC(=O)NNC(=O)Cn3nnc(n3)c4cccc(c4)[N+](=O)[O-])CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	G22	compound treatment	0.814	0.0158	0.21	0.709	0.0138	0.19	0.2835	0.9982	1965501	Cerep_000140	CC(=O)OCc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H03	compound treatment	0.828	0.0298	0.4	0.696	8.06E-4	0.01	0.2917	0.7262	1965502	Cerep_000141	COc1cc(OC)cc(c1)C(=O)NCC2C(C=C(C)C)C2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H04	compound treatment	0.802	0.00376	0.05	0.676	-0.0192	-0.26	-0.1492	-0.5595	1965503	Cerep_000142	O=C(NNC(=O)c1ccc2nsnc2c1)c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H05	compound treatment	0.844	0.0458	0.62	0.7	0.00481	0.07	0.4829	0.7778	1965504	Cerep_000143	CC(C)(C)OC(=O)C(Cc1ccc(OC(C)(C)C)cc1)NC(=O)CC2Cc3ccccc3C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H06	compound treatment	0.767	-0.0312	-0.42	0.685	-0.0102	-0.14	-0.3963	-0.893	1965505	Cerep_000144	OCCN(Cc1ccccc1)C(=O)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H07	compound treatment	0.861	0.0628	0.85	0.722	0.0268	0.37	0.8572	0.9295	1965506	Cerep_000145	O=C(NCc1cccnc1)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H08	compound treatment	0.774	-0.0242	-0.33	0.686	-0.00919	-0.13	-0.3198	-0.9134	1965507	Cerep_000146	Cc1onc(c1C(=O)NNC(=O)CCc2nc3ccccc3n2C)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H09	compound treatment	0.84	0.0418	0.56	0.686	-0.00919	-0.13	0.3098	0.5366	1965508	Cerep_000147	Cc1nn(Cc2nnn(CC(=O)NNC(=O)c3ccsc3)n2)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H10	compound treatment	0.775	-0.0232	-0.31	0.713	0.0178	0.24	-0.05	-0.126	1965509	Cerep_000148	CC(C(=O)N1CCN(Cc2ccc(OCC=C)cc2)CC1)c3cccc(c3)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H11	compound treatment	0.822	0.0238	0.32	0.695	-1.94E-4	0.0	0.2248	0.7012	1965510	Cerep_000149	O=C(CCCNC(=O)OCc1ccccc1)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H12	compound treatment	0.781	-0.0172	-0.23	0.672	-0.0232	-0.32	-0.3881	-0.9885	1965511	Cerep_000150	COc1ccccc1C2CCN(CC2)C(=O)CC(CC(=O)C3CC3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H13	compound treatment	0.816	0.0178	0.24	0.695	-1.94E-4	0.0	0.1676	0.6992	1965512	Cerep_000151	CCN1CC(CN1CC)NC(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H14	compound treatment	0.775	-0.0232	-0.31	0.697	0.00181	0.02	-0.2042	-0.6496	1965513	Cerep_000152	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)c3cn[nH]c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H15	compound treatment	0.843	0.0448	0.6	0.673	-0.0222	-0.3	0.213	0.3154	1965514	Cerep_000153	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)Cc4nc(oc4C)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H16	compound treatment	0.789	-0.00924	-0.12	0.685	-0.0102	-0.14	-0.1864	-0.9985	1965515	Cerep_000154	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)NNC(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H17	compound treatment	0.846	0.0478	0.64	0.721	0.0258	0.35	0.7045	0.9595	1965516	Cerep_000155	O=C(Cc1ccc2ccccc2c1)NNC(=O)c3ccc4nsnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H18	compound treatment	0.754	-0.0442	-0.6	0.661	-0.0342	-0.47	-0.7517	-0.9926	1965517	Cerep_000156	CCC(C)(O)CC(=O)NNC(=O)c1c(C)noc1c2cc(C)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H19	compound treatment	0.783	-0.0152	-0.21	0.713	0.0178	0.24	0.0264	0.0829	1019710	Cerep_000157	COc1ccc(cc1)C(=O)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H20	compound treatment	0.735	-0.0632	-0.85	0.68	-0.0152	-0.21	-0.7497	-0.854	1965518	Cerep_000158	O=C(NC1CCCC1OCc2ccccc2)c3cn[nH]c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H21	compound treatment	0.822	0.0238	0.32	0.687	-0.00819	-0.11	0.1477	0.435	1965519	Cerep_000159	Cc1cc(/C=N/NC(=O)Cc2ccsc2)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	H22	compound treatment	0.779	-0.0192	-0.26	0.672	-0.0232	-0.32	-0.4071	-0.9952	1965520	Cerep_000160	Cc1nn(nc1C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3C(C)(C)C)C(C)(C)C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I03	compound treatment	0.797	-0.00124	-0.02	0.72	0.0248	0.34	0.2274	0.6715	1965521	Cerep_000161	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCCN3CCN(Cc4ccc(N(C)C)c5ccccc45)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I04	compound treatment	0.825	0.0268	0.36	0.7	0.00481	0.07	0.3017	0.822	1965522	Cerep_000162	COc1cc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc3OCOc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I05	compound treatment	0.798	-2.35E-4	0.0	0.699	0.00381	0.05	0.0345	0.6627	1965523	Cerep_000163	CC1(C)C2CC1C(COC(=O)N3CCC(CC3)C(O)(c4ccccc4)c5ccccc5)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I06	compound treatment	0.802	0.00376	0.05	0.682	-0.0132	-0.18	-0.0913	-0.4884	1965524	Cerep_000164	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(ccc2F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I07	compound treatment	0.804	0.00576	0.08	0.693	-0.00219	-0.03	0.0338	0.406	1965525	Cerep_000165	COc1ccccc1CCOC(=O)N2CCC(CC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I08	compound treatment	0.797	-0.00124	-0.02	0.693	-0.00219	-0.03	-0.0329	-0.9618	1965526	Cerep_000166	[O-][N+](=O)c1ccc(Cl)cc1/C=N/NC(=O)c2ccccc2CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I09	compound treatment	0.779	-0.0192	-0.26	0.698	0.00281	0.04	-0.1564	-0.5964	1965527	Cerep_000167	O=C(OCc1ccccc1Cc2ccccc2)N3CCN(Cc4ccsc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I10	compound treatment	0.801	0.00276	0.04	0.692	-0.00319	-0.04	-0.0044	-0.0772	1965528	Cerep_000168	Cc1cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)cc(C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I11	compound treatment	0.787	-0.0112	-0.15	0.681	-0.0142	-0.19	-0.244	-0.9927	1965529	Cerep_000169	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCCCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I12	compound treatment	0.772	-0.0262	-0.35	0.684	-0.0112	-0.15	-0.3582	-0.9293	1965530	Cerep_000170	COc1cc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])cc3OCOc31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I13	compound treatment	0.776	-0.0222	-0.3	0.686	-0.00919	-0.13	-0.3008	-0.9251	1965531	Cerep_000171	Clc1ccc(Cl)c(c1)C(=O)NNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I14	compound treatment	0.795	-0.00324	-0.04	0.694	-0.00119	-0.02	-0.0424	-0.9097	1965532	Cerep_000172	[O-][N+](=O)c1ccc(F)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I15	compound treatment	0.817	0.0188	0.25	0.685	-0.0102	-0.14	0.0807	0.2794	1965533	Cerep_000173	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I16	compound treatment	0.79	-0.00824	-0.11	0.706	0.0108	0.15	0.0256	0.1389	1965534	Cerep_000174	COc1cccc(c1)C(=O)N/N=C/c2cc(Cl)ccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I17	compound treatment	0.855	0.0568	0.77	0.718	0.0228	0.31	0.7614	0.9212	1965535	Cerep_000175	Fc1cccc(F)c1C(=O)Nc2ccccc2C(=O)NNC(=O)OCCc3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I18	compound treatment	0.753	-0.0452	-0.61	0.699	0.00381	0.05	-0.3948	-0.6446	1965536	Cerep_000176	Cc1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cc(C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I19	compound treatment	0.819	0.0208	0.28	0.701	0.00581	0.08	0.2541	0.8728	1965537	Cerep_000177	O=C(NNC(=O)c1cc(nc2ccccc12)c3ccccc3)OCc4ccc(/C=C/c5ccccc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I20	compound treatment	0.815	0.0168	0.23	0.703	0.00781	0.11	0.2352	0.9409	1965538	Cerep_000178	Fc1cc(F)c(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I21	compound treatment	0.83	0.0318	0.43	0.681	-0.0142	-0.19	0.1661	0.3533	1965539	Cerep_000179	CC(C)(C)Sc1ccccc1CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	I22	compound treatment	0.834	0.0358	0.48	0.704	0.00881	0.12	0.4261	0.8569	1965540	Cerep_000180	CCCCCc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J03	compound treatment	0.8	0.00176	0.02	0.67	-0.0252	-0.34	-0.2261	-0.6565	1965541	Cerep_000181	O=C(CCCCC1CCCCC1)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J04	compound treatment	0.816	0.0178	0.24	0.679	-0.0162	-0.22	0.0133	0.0408	1965542	Cerep_000182	Cc1cc(nn1C)C(=O)NNC(=O)c2nccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J05	compound treatment	0.828	0.0298	0.4	0.703	0.00781	0.11	0.3592	0.8647	1965543	Cerep_000183	CC(=O)Nc1ccc(cc1)C(=O)NC(CCCCNC(=O)OCc2ccccc2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J06	compound treatment	0.772	-0.0262	-0.35	0.668	-0.0272	-0.37	-0.5125	-0.9997	1965544	Cerep_000184	COc1ccc(cc1)C(=O)NNC(=O)Cc2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J07	compound treatment	0.822	0.0238	0.32	0.704	0.00881	0.12	0.3116	0.9102	1965545	Cerep_000185	COC(=O)C(Cc1cn(Cc2ccccc2)cn1)NC(=O)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J08	compound treatment	0.765	-0.0332	-0.45	0.677	-0.0182	-0.25	-0.4925	-0.9611	1965546	Cerep_000186	COC(=O)c1sccc1NC(=O)c2ccccc2C(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J09	compound treatment	0.81	0.0118	0.16	0.712	0.0168	0.23	0.2743	0.9839	1965547	Cerep_000187	O=C(NC1CCN(Cc2ccc(cc2)N3CCCC3)C1)c4ccc(cc4)n5nc(cc5c6ccccc6)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J10	compound treatment	0.752	-0.0462	-0.62	0.692	-0.00319	-0.04	-0.4719	-0.7547	1965548	Cerep_000188	Cc1cc(nn1C)C(=O)NC(Cc2ccccc2)C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J11	compound treatment	0.834	0.0358	0.48	0.717	0.0218	0.3	0.5514	0.973	1965549	Cerep_000189	CC(C)CC(NC(=O)c1cc(=O)n([nH]1)c2ccccc2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J12	compound treatment	0.77	-0.0282	-0.38	0.684	-0.0112	-0.15	-0.3773	-0.9194	1965550	Cerep_000190	Cc1sc(nc1CC(=O)N2CCN(CC2)c3nccnc3C#N)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J13	compound treatment	0.837	0.0388	0.52	0.705	0.00981	0.13	0.4643	0.8602	1965551	Cerep_000191	CC(C)(C)OCC(NC(=O)C1CCN(CC1)c2ccc(cn2)C(F)(F)F)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J14	compound treatment	0.784	-0.0142	-0.19	0.687	-0.00819	-0.11	-0.2148	-0.9668	1965552	Cerep_000192	Clc1ccc(cc1)N2CCN(CC2)C(=O)CCC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J15	compound treatment	0.833	0.0348	0.47	0.706	0.0108	0.15	0.4358	0.8865	1965553	Cerep_000193	CC1(C)C2CCC1(C)C(O)C2CC(=O)NCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J16	compound treatment	0.787	-0.0112	-0.15	0.657	-0.0382	-0.52	-0.4755	-0.8765	1965554	Cerep_000194	CSc1sc(C(=O)NNC(=O)c2ccc(cc2)C(F)(F)F)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J17	compound treatment	0.821	0.0228	0.31	0.677	-0.0182	-0.25	0.0417	0.1057	1965555	Cerep_000195	CC(C)(C)OC(=O)N1CCCC1C(=O)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J18	compound treatment	0.724	-0.0742	-1.0	0.646	-0.0492	-0.67	-1.1825	-0.981	1965556	Cerep_000196	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J19	compound treatment	0.823	0.0248	0.33	0.701	0.00581	0.08	0.2922	0.8511	1965557	Cerep_000197	COc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J20	compound treatment	0.798	-2.35E-4	0.0	0.652	-0.0432	-0.59	-0.4187	-0.7109	1939639	Cerep_000198	COc1ccc(cc1OC)C(=O)NNC(=O)c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J21	compound treatment	0.858	0.0598	0.81	0.701	0.00581	0.08	0.6261	0.7728	1965558	Cerep_000199	Cc1cc(/C=N/NC(=O)c2cncc(Br)c2)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	J22	compound treatment	0.802	0.00376	0.05	0.702	0.00681	0.09	0.1015	0.9598	1965559	Cerep_000200	CCOC(=O)CNC(=O)CCC(=O)c1ccc(F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K03	compound treatment	0.82	0.0218	0.29	0.697	0.00181	0.02	0.225	0.7637	1965560	Cerep_000201	Clc1cc2OCOc2cc1CN3CCCC(COC(=O)N4CCC(=CC4)n5c(=O)[nH]c6ccccc56)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K04	compound treatment	0.796	-0.00224	-0.03	0.724	0.0288	0.39	0.2564	0.6509	1965561	Cerep_000202	Clc1ccccc1OCC(=O)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K05	compound treatment	0.79	-0.00824	-0.11	0.687	-0.00819	-0.11	-0.1576	-1.0	1965562	Cerep_000203	Cc1ccccc1CCOC(=O)NNC(=O)Cn2nnc(n2)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K06	compound treatment	0.783	-0.0152	-0.21	0.691	-0.00419	-0.06	-0.1858	-0.8708	1965563	Cerep_000204	COc1cscc1C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K07	compound treatment	0.802	0.00376	0.05	0.718	0.0228	0.31	0.2558	0.8118	1965564	Cerep_000205	CN(CCc1ccccn1)C(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K08	compound treatment	0.79	-0.00824	-0.11	0.721	0.0258	0.35	0.1703	0.4614	1965565	Cerep_000206	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K09	compound treatment	0.789	-0.00924	-0.12	0.724	0.0288	0.39	0.1897	0.4602	1965566	Cerep_000207	Clc1cc(ccn1)C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K10	compound treatment	0.799	7.65E-4	0.01	0.72	0.0248	0.34	0.2465	0.7283	1965567	Cerep_000208	COc1cc(OC)cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K11	compound treatment	0.779	-0.0192	-0.26	0.702	0.00681	0.09	-0.1179	-0.4277	1965568	Cerep_000209	COc1cscc1C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K12	compound treatment	0.782	-0.0162	-0.22	0.703	0.00781	0.11	-0.0796	-0.3269	1965569	Cerep_000210	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K13	compound treatment	0.797	-0.00124	-0.02	0.7	0.00481	0.07	0.0346	0.5111	1965570	Cerep_000211	COc1ccc(CCCOC(=O)NCCCN2CCN(C)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K14	compound treatment	0.802	0.00376	0.05	0.703	0.00781	0.11	0.1112	0.9427	1965571	Cerep_000212	Oc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K15	compound treatment	0.793	-0.00524	-0.07	0.734	0.0388	0.53	0.3242	0.6073	1965572	Cerep_000213	Cc1ccccc1COC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K16	compound treatment	0.815	0.0168	0.23	0.718	0.0228	0.31	0.3798	0.9878	1965573	Cerep_000214	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K17	compound treatment	0.818	0.0198	0.27	0.679	-0.0162	-0.22	0.0324	0.0936	1965574	Cerep_000215	CC(COC(=O)N(C)CCCN1c2ccccc2CCc3ccccc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K18	compound treatment	0.788	-0.0102	-0.14	0.668	-0.0272	-0.37	-0.3599	-0.9094	1965575	Cerep_000216	COc1cc(OC)cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K19	compound treatment	0.804	0.00576	0.08	0.715	0.0198	0.27	0.246	0.8752	1965576	Cerep_000217	CC1(C)C2CC1C(COC(=O)NNC(=O)c3ccccc3n4cccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K20	compound treatment	0.827	0.0288	0.39	0.702	0.00681	0.09	0.34	0.8522	1965577	Cerep_000218	COc1ccc(cc1)C(=O)N/N=C/c2sc3ccccc3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K21	compound treatment	0.786	-0.0122	-0.17	0.698	0.00281	0.04	-0.0897	-0.5292	1965578	Cerep_000219	COc1cc(ccc1O)C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	K22	compound treatment	0.805	0.00676	0.09	0.69	-0.00519	-0.07	0.0144	0.125	1965579	Cerep_000220	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L03	compound treatment	0.841	0.0428	0.58	0.686	-0.00919	-0.13	0.3193	0.5408	1965580	Cerep_000221	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NNC(=O)C3=C(CC=C3)n4c(C)ccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L04	compound treatment	0.767	-0.0312	-0.42	0.668	-0.0272	-0.37	-0.5602	-0.998	1965581	Cerep_000222	CCCCC(NC(=O)C)C(=O)N1CCC(Cc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L05	compound treatment	0.829	0.0308	0.42	0.678	-0.0172	-0.23	0.1277	0.2678	1965582	Cerep_000223	CSc1sc(C(=O)NNC(=O)CCCNC(=O)OCc2ccccc2)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L06	compound treatment	0.765	-0.0332	-0.45	0.666	-0.0292	-0.4	-0.5985	-0.9982	1965583	Cerep_000224	COc1ccc(CNC(=O)c2ccc3[nH]nnc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L07	compound treatment	0.81	0.0118	0.16	0.676	-0.0192	-0.26	-0.0729	-0.238	1965584	Cerep_000225	Brc1ccc(NC(=O)CCC(=O)NNC(=O)c2nccc3ccccc23)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L08	compound treatment	0.752	-0.0462	-0.62	0.663	-0.0322	-0.44	-0.7515	-0.9852	1965585	Cerep_000226	O=C(CCCCCNC(=O)OCc1ccccc1)NC2CCN(Cc3ccc(cc3)N4CCCC4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L09	compound treatment	0.827	0.0288	0.39	0.684	-0.0112	-0.15	0.1665	0.3992	1965586	Cerep_000227	COc1ccc(cc1)C(=O)NNC(=O)C2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L10	compound treatment	0.77	-0.0282	-0.38	0.678	-0.0172	-0.23	-0.4351	-0.9728	1965587	Cerep_000228	CCCCC(NC(=O)C)C(=O)NNC(=O)c1c(C)noc1c2cc(C)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L11	compound treatment	0.804	0.00576	0.08	0.7	0.00481	0.07	0.1013	0.9964	1965588	Cerep_000229	Brc1ccc(NC(=O)CCC(=O)NC(Cc2ccccc2)C(=O)NNC(=O)OCc3ccccc3)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L12	compound treatment	0.792	-0.00624	-0.08	0.7	0.00481	0.07	-0.0131	-0.1232	1965589	Cerep_000230	Clc1ccccc1C(=O)Nc2ccsc2C(=O)NNC(=O)c3ccc(CSc4ccccn4)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L13	compound treatment	0.861	0.0628	0.85	0.714	0.0188	0.26	0.7801	0.8817	1965590	Cerep_000231	Fc1ccc(cc1)C(N2CCN(CC2)C(=O)c3csc(n3)c4cnccn4)c5ccc(F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L14	compound treatment	0.757	-0.0412	-0.56	0.679	-0.0162	-0.22	-0.5495	-0.9181	1965591	Cerep_000232	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)CCOC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L15	compound treatment	0.816	0.0178	0.24	0.693	-0.00219	-0.03	0.1483	0.6141	1965592	Cerep_000233	OC1(CCN(CC1)C(=O)c2ccc(cc2)n3cccc3)c4ccc(Cl)c(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L16	compound treatment	0.73	-0.0682	-0.92	0.673	-0.0222	-0.3	-0.8649	-0.8926	1965593	Cerep_000234	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)CC(CC(=O)C5CC5)c6ccc(Br)cc6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L17	compound treatment	0.82	0.0218	0.29	0.703	0.00781	0.11	0.2829	0.9058	1965594	Cerep_000235	Cc1cc([nH]n1)C(=O)NNC(=O)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L18	compound treatment	0.768	-0.0302	-0.41	0.684	-0.0112	-0.15	-0.3964	-0.9101	1965595	Cerep_000236	O=C(N1CCC2(CC1)OCCCO2)c3ccc4[nH]nnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L19	compound treatment	0.847	0.0488	0.66	0.66	-0.0352	-0.48	0.1258	0.1545	1965596	Cerep_000237	Cc1sc(nc1CC(=O)NCCOc2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L20	compound treatment	0.771	-0.0272	-0.37	0.688	-0.00719	-0.1	-0.3292	-0.8656	1965597	Cerep_000238	CC(CCC=C(C)C)CC(=O)NNC(=O)c1cc(C)n[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L21	compound treatment	0.842	0.0438	0.59	0.698	0.00281	0.04	0.4445	0.7514	1965598	Cerep_000239	COc1cccc(c1)C(=O)N/N=C/c2ccc(OC(=O)OC(C)(C)C)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	L22	compound treatment	0.789	-0.00924	-0.12	0.681	-0.0142	-0.19	-0.225	-0.9773	1965599	Cerep_000240	CSc1sc(C(=O)NNC(=O)CCC(C)C)c2CCCC3(SCCS3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M03	compound treatment	0.804	0.00576	0.08	0.72	0.0248	0.34	0.2942	0.8476	1965600	Cerep_000241	Cc1ccc(cc1)N2CCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M04	compound treatment	0.828	0.0298	0.4	0.68	-0.0152	-0.21	0.1374	0.3041	1965601	Cerep_000242	O=C(N/N=C/c1cc2ccccc2c3ccccc13)c4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M05	compound treatment	0.8	0.00176	0.02	0.691	-0.00419	-0.06	-0.0236	-0.3811	1965602	Cerep_000243	CC(C)(C)OC(=O)NC(COC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3)CC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M06	compound treatment	0.794	-0.00424	-0.06	0.687	-0.00819	-0.11	-0.1194	-0.9515	1965603	Cerep_000244	O=C(Nc1ccccc1C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23)c5cccs5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M07	compound treatment	0.81	0.0118	0.16	0.721	0.0258	0.35	0.3611	0.9353	1965604	Cerep_000245	COc1cccc(CCOC(=O)NNC(=O)c2cccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M08	compound treatment	0.789	-0.00924	-0.12	0.731	0.0358	0.49	0.2572	0.5103	1965605	Cerep_000246	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M09	compound treatment	0.78	-0.0182	-0.25	0.697	0.00181	0.02	-0.1565	-0.6332	1965606	Cerep_000247	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M10	compound treatment	0.794	-0.00424	-0.06	0.698	0.00281	0.04	-0.0133	-0.1941	1965607	Cerep_000248	COc1ccc(OC)c(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M11	compound treatment	0.803	0.00476	0.06	0.709	0.0138	0.19	0.1786	0.8977	1965608	Cerep_000249	Cc1nc(cs1)C(=O)NNC(=O)OCCc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M12	compound treatment	0.792	-0.00624	-0.08	0.703	0.00781	0.11	0.0158	0.1164	1965609	Cerep_000250	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2cc3ccccc3c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M13	compound treatment	0.823	0.0248	0.33	0.714	0.0188	0.26	0.4176	0.9915	1965610	Cerep_000251	Clc1cccc(CCNC(=O)OCCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M14	compound treatment	0.804	0.00576	0.08	0.734	0.0388	0.53	0.4292	0.8024	1965611	Cerep_000252	Clc1ccc(Oc2cccc(/C=N/NC(=O)Cc3c[nH]c4ccccc34)c2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M15	compound treatment	0.81	0.0118	0.16	0.707	0.0118	0.16	0.2261	1.0	1965612	Cerep_000253	[O-][N+](=O)c1cc2OCOc2cc1COC(=O)NNC(=O)C3c4ccccc4Oc5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M16	compound treatment	0.791	-0.00724	-0.1	0.674	-0.0212	-0.29	-0.2734	-0.8962	1965613	Cerep_000254	Fc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M17	compound treatment	0.83	0.0318	0.43	0.714	0.0188	0.26	0.4843	0.9699	1965614	Cerep_000255	Oc1ccc(cc1)C(=O)NNC(=O)OCc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M18	compound treatment	0.808	0.00976	0.13	0.705	0.00981	0.13	0.1877	1.0	1965615	Cerep_000256	COc1ccc(OC)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M19	compound treatment	0.776	-0.0222	-0.3	0.693	-0.00219	-0.03	-0.2333	-0.7738	1965616	Cerep_000257	CC(C)(C)OC(=O)NC(COC(=O)NNC(=O)c1ccccc1n2cccc2)CC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M20	compound treatment	0.81	0.0118	0.16	0.694	-0.00119	-0.02	0.1007	0.6312	1965617	Cerep_000258	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc(c2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M21	compound treatment	0.806	0.00776	0.1	0.715	0.0198	0.27	0.265	0.915	1965618	Cerep_000259	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccccc4SC(C)(C)C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	M22	compound treatment	0.81	0.0118	0.16	0.707	0.0118	0.16	0.2261	1.0	1965619	Cerep_000260	Fc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N03	compound treatment	0.831	0.0328	0.44	0.699	0.00381	0.05	0.3493	0.7847	1965620	Cerep_000261	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)Cc5nc(oc5C)c6ccccc6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N04	compound treatment	0.799	7.65E-4	0.01	0.685	-0.0102	-0.14	-0.091	-0.6528	1965621	Cerep_000262	CC(OCc1ccccc1)C(NC(=O)c2cc(=O)n([nH]2)c3ccccc3)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N05	compound treatment	0.825	0.0268	0.36	0.695	-1.94E-4	0.0	0.2534	0.7019	1965622	Cerep_000263	CCOc1ccccc1C(=O)NNC(=O)CCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N06	compound treatment	0.786	-0.0122	-0.17	0.687	-0.00819	-0.11	-0.1957	-0.9819	1965623	Cerep_000264	O=C(CCc1ccc2OCOc2c1)NNC(=O)c3ccc4nsnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N07	compound treatment	0.841	0.0428	0.58	0.75	0.0548	0.75	0.9364	0.9918	1965624	Cerep_000265	Cc1onc(C(=O)NNC(=O)Cc2nc(sc2C)c3ccccc3)c1c4csc(n4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N08	compound treatment	0.786	-0.0122	-0.17	0.709	0.0138	0.19	0.0164	0.0655	1965625	Cerep_000266	Fc1ccc(cc1)C(CCCN2CCN(CC2)C(=O)c3cn[nH]c3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N09	compound treatment	0.83	0.0318	0.43	0.708	0.0128	0.17	0.4265	0.9217	1965626	Cerep_000267	COc1cccc(CN2CCC(C2)NC(=O)Cc3ccc4ccccc4c3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N10	compound treatment	0.829	0.0308	0.42	0.683	-0.0122	-0.17	0.1759	0.3934	1965627	Cerep_000268	Clc1ccccc1C(=O)Nc2ccsc2C(=O)NNC(=O)CCCCCNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N11	compound treatment	0.837	0.0388	0.52	0.715	0.0198	0.27	0.5608	0.9527	1965628	Cerep_000269	COc1cccc(CN2CCC(C2)NC(=O)c3ccoc3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N12	compound treatment	0.785	-0.0132	-0.18	0.696	8.06E-4	0.01	-0.1185	-0.6623	1965629	Cerep_000270	Cn1c(CCC(=O)NNC(=O)Cn2cnc(Cl)c2Cl)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N13	compound treatment	0.845	0.0468	0.63	0.68	-0.0152	-0.21	0.2996	0.4512	1965630	Cerep_000271	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2nn(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N14	compound treatment	0.784	-0.0142	-0.19	0.713	0.0178	0.24	0.0359	0.116	1965631	Cerep_000272	O=C(NNC(=O)c1cccs1)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N15	compound treatment	0.788	-0.0102	-0.14	0.69	-0.00519	-0.07	-0.1477	-0.9519	1965632	Cerep_000273	O=C(NCc1cccs1)C2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N16	compound treatment	0.754	-0.0442	-0.6	0.686	-0.00919	-0.13	-0.5106	-0.8374	1965633	Cerep_000274	Cc1sc(nc1CC(=O)N2CCC(CC2)C(O)(c3ccccc3)c4ccccc4)c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N17	compound treatment	0.78	-0.0182	-0.25	0.681	-0.0142	-0.19	-0.3108	-0.993	1965634	Cerep_000275	CCOC(=O)NNC(=O)CCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N18	compound treatment	0.736	-0.0622	-0.84	0.682	-0.0132	-0.18	-0.7209	-0.8396	1965635	Cerep_000276	CC(C)(C)OCC(NC(=O)OC(C)(C)C)C(=O)N1CCN(C/C=C/c2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N19	compound treatment	0.868	0.0698	0.94	0.666	-0.0292	-0.4	0.384	0.3758	1965636	Cerep_000277	COc1cc(ccc1CN2CCC(C2)NC(=O)c3cnc4n(C)nc(C)c4c3OC)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N20	compound treatment	0.766	-0.0322	-0.43	0.693	-0.00219	-0.03	-0.3287	-0.754	1965637	Cerep_000278	COc1ccc(CCN(C)C(=O)c2ccoc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N21	compound treatment	0.806	0.00776	0.1	0.703	0.00781	0.11	0.1493	1.0	1965638	Cerep_000279	COc1cc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	N22	compound treatment	0.748	-0.0502	-0.68	0.689	-0.00619	-0.08	-0.5389	-0.7891	1965639	Cerep_000280	CSc1sc(C(=O)NNC(=O)C(C)c2ccc(Cl)cc2)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O03	compound treatment	0.777	-0.0212	-0.29	0.717	0.0218	0.3	0.0077	0.0186	1965640	Cerep_000281	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCC5CCCN(Cc6ccc(OC)c(OCc7ccccc7)c6)C5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O04	compound treatment	0.778	-0.0202	-0.27	0.715	0.0198	0.27	-0.0021	-0.0054	1965641	Cerep_000282	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O05	compound treatment	0.817	0.0188	0.25	0.707	0.0118	0.16	0.2928	0.9761	1965642	Cerep_000283	COc1ccc2[nH]cc(CCNC(=O)OCC(C)C3CCCCC3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O06	compound treatment	0.804	0.00576	0.08	0.695	-1.94E-4	0.0	0.0531	0.6826	1965643	Cerep_000284	COc1ccc(Cl)cc1C(=O)N/N=C/c2ccc(O)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O07	compound treatment	0.793	-0.00524	-0.07	0.724	0.0288	0.39	0.2278	0.5708	1965644	Cerep_000285	Cc1cccc(CCOC(=O)NNC(=O)c2ccco2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O08	compound treatment	0.825	0.0268	0.36	0.704	0.00881	0.12	0.3402	0.8941	1965645	Cerep_000286	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O09	compound treatment	0.844	0.0458	0.62	0.741	0.0458	0.62	0.8782	1.0	1965646	Cerep_000287	COc1cc(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC(C)(C)C)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O10	compound treatment	0.762	-0.0362	-0.49	0.669	-0.0262	-0.36	-0.5982	-0.9881	1965647	Cerep_000288	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(cc2)N(CCC#N)CCC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O11	compound treatment	0.815	0.0168	0.23	0.709	0.0138	0.19	0.293	0.9958	1965648	Cerep_000289	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCC(C)C3CCCCC3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O12	compound treatment	0.789	-0.00924	-0.12	0.709	0.0138	0.19	0.045	0.1994	1965649	Cerep_000290	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O13	compound treatment	0.814	0.0158	0.21	0.692	-0.00319	-0.04	0.1196	0.5508	1965650	Cerep_000291	Cc1cc([nH]n1)C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O14	compound treatment	0.805	0.00676	0.09	0.693	-0.00219	-0.03	0.0434	0.4516	1965651	Cerep_000292	CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O15	compound treatment	0.8	0.00176	0.02	0.693	-0.00219	-0.03	-0.0043	-0.1131	1965652	Cerep_000293	CSc1ncc(C(=O)NNC(=O)OCC#Cc2ccccc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O16	compound treatment	0.809	0.0108	0.15	0.705	0.00981	0.13	0.1972	0.9991	1965653	Cerep_000294	COc1cccc(c1)C(=O)N/N=C/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O17	compound treatment	0.814	0.0158	0.21	0.72	0.0248	0.34	0.3896	0.975	1965654	Cerep_000295	CCN(CC)CCCCCCOC(=O)Nc1cc(ccc1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O18	compound treatment	0.791	-0.00724	-0.1	0.688	-0.00719	-0.1	-0.1384	-1.0	1965655	Cerep_000296	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc(cc2)N(CCC#N)CCC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O19	compound treatment	0.828	0.0298	0.4	0.699	0.00381	0.05	0.3206	0.7919	1965656	Cerep_000297	Cc1cc(no1)c2onc(C)c2COC(=O)NNC(=O)c3ccc(C)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O20	compound treatment	0.808	0.00976	0.13	0.68	-0.0152	-0.21	-0.0534	-0.2173	1965657	Cerep_000298	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O21	compound treatment	0.793	-0.00524	-0.07	0.731	0.0358	0.49	0.2953	0.5986	1965658	Cerep_000299	CC(C(=O)NNC(=O)OCc1cccc(OCc2ccccc2)c1)n3nnc(n3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	O22	compound treatment	0.793	-0.00524	-0.07	0.704	0.00881	0.12	0.035	0.251	1965659	Cerep_000300	CCCCc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P03	compound treatment	0.826	0.0278	0.37	0.725	0.0298	0.41	0.5523	0.9992	1965660	Cerep_000301	CC1(C)C2CCC1(C)C(O)C2CC(=O)NNC(=O)c3cnn(c3C(F)(F)F)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P04	compound treatment	0.805	0.00676	0.09	0.717	0.0218	0.3	0.2748	0.8835	1965661	Cerep_000302	CC(Cc1ccc(Cl)cc1)NC(=O)c2ccc(cc2)N3N=C(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P05	compound treatment	0.803	0.00476	0.06	0.677	-0.0182	-0.25	-0.13	-0.5072	1965662	Cerep_000303	COc1cccc(CN2CCC(C2)NC(=O)C3CCCN3C(=O)OC(C)(C)C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P06	compound treatment	0.754	-0.0442	-0.6	0.656	-0.0392	-0.53	-0.7999	-0.9985	1965663	Cerep_000304	Cn1cccc1C(=O)NNC(=O)C2Cc3ccccc3CN2C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P07	compound treatment	0.835	0.0368	0.5	0.694	-0.00119	-0.02	0.3392	0.6835	1965664	Cerep_000305	CC1(C)CCCN(C1)C(=O)CNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P08	compound treatment	0.788	-0.0102	-0.14	0.681	-0.0142	-0.19	-0.2345	-0.9863	1965665	Cerep_000306	Cc1sc(nc1CC(=O)N2CCN(CC2)C(=O)OC(C)(C)C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P09	compound treatment	0.694	-0.104	-1.41	0.627	-0.0682	-0.93	-1.6519	-0.9798	1965666	Cerep_000307	Cc1cc([nH]n1)C(=O)NNC(=O)C2CCCN2C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P10	compound treatment	0.107	-0.691	-9.33	0.074	-0.621	-8.47	-12.5837	-0.9988	1965667	Cerep_000308	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)C2Cc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P11	compound treatment	0.802	0.00376	0.05	0.689	-0.00619	-0.08	-0.0238	-0.2416	1965668	Cerep_000309	O=C(CCc1c[nH]c2ccccc12)N3CCC4(CC3)OCCCO4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P12	compound treatment	0.766	-0.0322	-0.43	0.694	-0.00119	-0.02	-0.319	-0.7331	1965669	Cerep_000310	CCCCCCc1ccc(cc1)C(=O)NCc2cccc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P13	compound treatment	0.845	0.0468	0.63	0.707	0.0118	0.16	0.5599	0.86	1965670	Cerep_000311	FC(F)(F)c1ccc(c2nc(cs2)C(=O)NNC(=O)c3ccsc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P14	compound treatment	0.759	-0.0392	-0.53	0.676	-0.0192	-0.26	-0.5594	-0.9473	1965671	Cerep_000312	Cc1cc(nn1C)C(=O)NC2CCN(Cc3ccc4cc(F)ccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P15	compound treatment	0.833	0.0348	0.47	0.694	-0.00119	-0.02	0.3201	0.6821	1965672	Cerep_000313	COc1ccc(CC(=O)NNC(=O)c2ccc(C)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P16	compound treatment	0.756	-0.0422	-0.57	0.692	-0.00319	-0.04	-0.4337	-0.759	1965673	Cerep_000314	Cc1ccc(Oc2ncccc2C(=O)NNC(=O)c3ccco3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P17	compound treatment	0.802	0.00376	0.05	0.685	-0.0102	-0.14	-0.0624	-0.4215	1965674	Cerep_000315	Fc1cccc(c1)C(=O)NNC(=O)c2ccc3[nH]nnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P18	compound treatment	0.79	-0.00824	-0.11	0.671	-0.0242	-0.33	-0.3118	-0.8958	1965675	Cerep_000316	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P19	compound treatment	0.843	0.0448	0.6	0.697	0.00181	0.02	0.4444	0.7353	1965676	Cerep_000317	COc1c(cnc2n(C)nc(C)c12)C(=O)NCC3CCCCC3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P20	compound treatment	0.774	-0.0242	-0.33	0.672	-0.0232	-0.32	-0.4548	-0.9999	1965677	Cerep_000318	COc1ccc(cc1)C(=O)N2CCC(O)(CC2)c3ccc(Cl)c(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P21	compound treatment	0.815	0.0168	0.23	0.707	0.0118	0.16	0.2738	0.9861	1965678	Cerep_000319	COc1cc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.526	P22	compound treatment	0.736	-0.0622	-0.84	0.707	0.0118	0.16	-0.4798	-0.5613	1965679	Cerep_000320	CSc1sc(C(=O)NNC(=O)c2ccc3OCOc3c2)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A03	compound treatment	0.814	0.0202	0.27	0.742	0.0285	0.39	0.468	0.9851	1965680	Cerep_000321	COc1ccc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A04	compound treatment	0.851	0.0572	0.77	0.715	0.0015	0.02	0.5606	0.7256	1965681	Cerep_000322	Brc1ccc(cc1)S(=O)(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A05	compound treatment	0.814	0.0202	0.27	0.734	0.0205	0.28	0.3908	0.9999	1965682	Cerep_000323	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(O)c(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A06	compound treatment	0.833	0.0392	0.53	0.698	-0.0155	-0.21	0.225	0.3946	1965683	Cerep_000324	Brc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A07	compound treatment	0.821	0.0272	0.37	0.733	0.0195	0.27	0.448	0.9874	1965684	Cerep_000325	Clc1cc2OCOc2cc1/C=N/NC(=O)c3cc(nc4ccccc34)C5CC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A08	compound treatment	0.831	0.0372	0.5	0.711	-0.0025	-0.03	0.3312	0.6577	1965685	Cerep_000326	NC(=O)C(Cc1ccccc1)NS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A09	compound treatment	0.811	0.0172	0.23	0.713	-4.95E-4	-0.01	0.1597	0.6863	1965686	Cerep_000327	Oc1ccc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A10	compound treatment	0.802	0.00824	0.11	0.712	-0.0015	-0.02	0.0642	0.568	1965687	Cerep_000328	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A11	compound treatment	0.808	0.0142	0.19	0.713	-4.95E-4	-0.01	0.1311	0.6818	1965688	Cerep_000329	Fc1ccccc1S(=O)(=O)N2CCN(CC2)C(=O)C3COc4ccccc4O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A12	compound treatment	0.825	0.0312	0.42	0.721	0.0075	0.1	0.3704	0.854	1965689	Cerep_000330	CN1CCCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A13	compound treatment	0.786	-0.00776	-0.1	0.721	0.0075	0.1	-0.0016	-0.0111	1965690	Cerep_000331	OC1CCN(CC1)S(=O)(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A14	compound treatment	0.779	-0.0148	-0.2	0.688	-0.0255	-0.35	-0.3866	-0.965	1965691	Cerep_000332	FC(F)(F)Oc1ccc(CNS(=O)(=O)c2cccc3nonc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A15	compound treatment	0.802	0.00824	0.11	0.701	-0.0125	-0.17	-0.0418	-0.2056	1965692	Cerep_000333	CN(CCCNS(=O)(=O)c1ccc(C#N)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A16	compound treatment	0.832	0.0382	0.52	0.73	0.0165	0.23	0.524	0.9309	1965693	Cerep_000334	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCCCn3ccnc3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A17	compound treatment	0.823	0.0292	0.39	0.719	0.0055	0.08	0.3321	0.8268	1965694	Cerep_000335	Fc1cccc(F)c1S(=O)(=O)N2CCC3(CC2)OCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A18	compound treatment	0.809	0.0152	0.21	0.724	0.0105	0.14	0.2467	0.9844	1965695	Cerep_000336	CC(NS(=O)(=O)c1ccc(Oc2cccc(Cl)c2C#N)cc1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A19	compound treatment	0.819	0.0252	0.34	0.738	0.0245	0.33	0.4771	1.0	1965696	Cerep_000337	COc1cc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A20	compound treatment	0.813	0.0192	0.26	0.741	0.0275	0.38	0.4488	0.9839	1965697	Cerep_000338	CCOC(=O)N1CCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A21	compound treatment	0.801	0.00724	0.1	0.725	0.0115	0.16	0.18	0.9741	1965698	Cerep_000339	O=C(N/N=C/c1cn(Cc2ccccc2)c3ccccc13)c4ccc5nonc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	A22	compound treatment	0.811	0.0172	0.23	0.728	0.0145	0.2	0.3044	0.9967	1965699	Cerep_000340	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCC3COc4ccccc4O3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B03	compound treatment	0.826	0.0322	0.43	0.736	0.0225	0.31	0.5246	0.9854	1965700	Cerep_000341	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(C(=O)OC(C)(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B04	compound treatment	0.768	-0.0258	-0.35	0.688	-0.0255	-0.35	-0.4915	-1.0	1965701	Cerep_000342	CCCCCCC#CCCOC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B05	compound treatment	0.805	0.0112	0.15	0.743	0.0295	0.4	0.3918	0.9111	1965702	Cerep_000343	OC(C1CCN(CC1)S(=O)(=O)c2ccc(Br)cc2OC(F)(F)F)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B06	compound treatment	0.781	-0.0128	-0.17	0.688	-0.0255	-0.35	-0.3675	-0.9474	1965703	Cerep_000344	Clc1ccccc1N2CCN(CC2)C(=O)OCCn3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B07	compound treatment	0.799	0.00524	0.07	0.703	-0.0105	-0.14	-0.0512	-0.3205	1965704	Cerep_000345	CCCc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B08	compound treatment	0.75	-0.0438	-0.59	0.784	0.0705	0.96	0.2624	0.2326	1965705	Cerep_000346	COc1ccc(CCCOC(=O)NC2CCN(Cc3c(C)nn(c3C)c4ccccc4)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B09	compound treatment	0.785	-0.00876	-0.12	0.715	0.0015	0.02	-0.069	-0.5757	1965706	Cerep_000347	CCCc1ccc(cc1)S(=O)(=O)NCc2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B10	compound treatment	0.808	0.0142	0.19	0.688	-0.0255	-0.35	-0.11	-0.2768	1965707	Cerep_000348	COc1ccccc1N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B11	compound treatment	0.758	-0.0358	-0.48	0.725	0.0115	0.16	-0.2302	-0.4537	1201765	Cerep_000349	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B12	compound treatment	0.786	-0.00776	-0.1	0.681	-0.0325	-0.44	-0.3873	-0.8507	1965708	Cerep_000350	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc(Cl)c4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B13	compound treatment	0.772	-0.0218	-0.29	0.708	-0.0055	-0.07	-0.2605	-0.8601	1965709	Cerep_000351	FC(F)(F)c1ccc(nc1)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B14	compound treatment	0.764	-0.0298	-0.4	0.676	-0.0375	-0.51	-0.6454	-0.9928	1965710	Cerep_000352	COC(=O)c1ccc(COC(=O)NNC(=O)c2sc(nc2C)c3ccc(cc3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B15	compound treatment	0.773	-0.0208	-0.28	0.73	0.0165	0.23	-0.0388	-0.1081	1965711	Cerep_000353	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B16	compound treatment	0.78	-0.0138	-0.19	0.713	-4.95E-4	-0.01	-0.136	-0.7324	1965712	Cerep_000354	OC1(CCN(CC1)C(=O)OCCN(Cc2ccccc2)Cc3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B17	compound treatment	0.805	0.0112	0.15	0.731	0.0175	0.24	0.2761	0.9761	1965713	Cerep_000355	COCCCNS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B18	compound treatment	0.758	-0.0358	-0.48	0.67	-0.0435	-0.59	-0.7605	-0.9947	1965714	Cerep_000356	Fc1ccccc1N2CCN(CC2)C(=O)OCCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B19	compound treatment	0.801	0.00724	0.1	0.721	0.0075	0.1	0.1415	0.9997	1965715	Cerep_000357	CC(C)CC(NS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F)C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B20	compound treatment	0.784	-0.00976	-0.13	0.712	-0.0015	-0.02	-0.1075	-0.807	1965716	Cerep_000358	CCCC#CCCOC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B21	compound treatment	0.777	-0.0168	-0.23	0.712	-0.0015	-0.02	-0.1743	-0.7678	1965717	Cerep_000359	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3sc(cc3[N+](=O)[O-])S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	B22	compound treatment	0.732	-0.0618	-0.83	0.668	-0.0455	-0.62	-1.0278	-0.9895	1965718	Cerep_000360	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C03	compound treatment	0.793	-7.55E-4	-0.01	0.75	0.0365	0.5	0.3448	0.6925	1965719	Cerep_000361	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(OC)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C04	compound treatment	0.865	0.0712	0.96	0.73	0.0165	0.23	0.8388	0.8497	1965720	Cerep_000362	COC(=O)C1CC(CN1S(=O)(=O)c2ccc(Br)cc2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C05	compound treatment	0.828	0.0342	0.46	0.739	0.0255	0.35	0.5726	0.9902	1965721	Cerep_000363	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(OC(=O)C)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C06	compound treatment	0.822	0.0282	0.38	0.731	0.0175	0.24	0.4382	0.9746	1965722	Cerep_000364	Fc1ccc(cc1)C(CCCN2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C07	compound treatment	0.769	-0.0248	-0.33	0.735	0.0215	0.29	-0.0288	-0.0648	1965723	Cerep_000365	COc1cc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C08	compound treatment	0.807	0.0132	0.18	0.741	0.0275	0.38	0.3916	0.9425	1965724	Cerep_000366	NC(=O)C1CCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C09	compound treatment	0.795	0.00124	0.02	0.716	0.0025	0.03	0.036	0.9465	1965725	Cerep_000367	COc1ccc(O)c(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C10	compound treatment	0.814	0.0202	0.27	0.725	0.0115	0.16	0.3041	0.9654	1965726	Cerep_000368	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCC(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C11	compound treatment	0.79	-0.00376	-0.05	0.752	0.0385	0.53	0.3355	0.6359	1965727	Cerep_000369	CCn1c2ccccc2c3cc(CN4CCC(C4)NS(=O)(=O)c5ccccc5F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C12	compound treatment	0.829	0.0352	0.48	0.739	0.0255	0.35	0.5821	0.9882	1965728	Cerep_000370	O=C(OCc1ccccc1)C2CCCN2S(=O)(=O)c3cccc4nonc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C13	compound treatment	0.788	-0.00576	-0.08	0.707	-0.0065	-0.09	-0.1175	-0.9978	1965729	Cerep_000371	O=S(=O)(NCCCN1CCOCC1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C14	compound treatment	0.784	-0.00976	-0.13	0.731	0.0175	0.24	0.0757	0.2778	1965730	Cerep_000372	CC1CCCN(C1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C15	compound treatment	0.783	-0.0108	-0.15	0.711	-0.0025	-0.03	-0.1267	-0.8499	1965731	Cerep_000373	OC1CCCCC1NS(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C16	compound treatment	0.793	-7.55E-4	-0.01	0.746	0.0325	0.44	0.3062	0.6907	1965732	Cerep_000374	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)N3CCN(CCc4ccccc4)CC3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C17	compound treatment	0.796	0.00224	0.03	0.73	0.0165	0.23	0.1806	0.7951	1965733	Cerep_000375	Fc1cccc(F)c1S(=O)(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C18	compound treatment	0.827	0.0332	0.45	0.757	0.0435	0.59	0.7366	0.9905	1965734	Cerep_000376	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)N3CCC4(CC3)OCCCO4)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C19	compound treatment	0.809	0.0152	0.21	0.711	-0.0025	-0.03	0.1214	0.5822	1965735	Cerep_000377	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C20	compound treatment	0.806	0.0122	0.17	0.731	0.0175	0.24	0.2856	0.9838	1596903	Cerep_000378	CCOC(=O)C1CCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C21	compound treatment	0.81	0.0162	0.22	0.71	-0.0035	-0.05	0.1213	0.5407	1965736	Cerep_000379	CCCOc1ccc(/C=N/NC(=O)c2ccc3nonc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	C22	compound treatment	0.79	-0.00376	-0.05	0.713	-4.95E-4	-0.01	-0.0406	-0.7943	1965737	Cerep_000380	CCN(Cc1ccncc1)S(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D03	compound treatment	0.805	0.0112	0.15	0.725	0.0115	0.16	0.2182	0.9999	1965738	Cerep_000381	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(COC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D04	compound treatment	0.789	-0.00476	-0.06	0.725	0.0115	0.16	0.0656	0.3869	1965739	Cerep_000382	COc1ccc2[nH]cc(CCNC(=O)OC/C=C/COCc3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D05	compound treatment	0.782	-0.0118	-0.16	0.714	5.05E-4	0.01	-0.1073	-0.6758	1965740	Cerep_000383	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NCCCn2ccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D06	compound treatment	0.768	-0.0258	-0.35	0.7	-0.0135	-0.18	-0.3758	-0.9558	1965741	Cerep_000384	COc1cccc(CCOC(=O)NNC(=O)c2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D07	compound treatment	0.797	0.00324	0.04	0.717	0.0035	0.05	0.0647	0.999	1965742	Cerep_000385	CCCc1ccc(cc1)S(=O)(=O)NCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D08	compound treatment	0.786	-0.00776	-0.1	0.705	-0.0085	-0.12	-0.1559	-0.9987	1965743	Cerep_000386	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cc(F)ccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D09	compound treatment	0.784	-0.00976	-0.13	0.694	-0.0195	-0.27	-0.281	-0.9474	1965744	Cerep_000387	CCCc1ccc(cc1)S(=O)(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D10	compound treatment	0.779	-0.0148	-0.2	0.691	-0.0225	-0.31	-0.3577	-0.9781	1965745	Cerep_000388	Clc1cc2OCOc2cc1CN3CCC(C3)NC(=O)OCc4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D11	compound treatment	0.795	0.00124	0.02	0.7	-0.0135	-0.18	-0.1183	-0.6399	1965746	Cerep_000389	COc1ccc2ccccc2c1CN3CCN(CC3)S(=O)(=O)c4c(C)c(C)cc(C)c4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D12	compound treatment	0.798	0.00424	0.06	0.671	-0.0425	-0.58	-0.3693	-0.6341	1965747	Cerep_000390	Brc1ccccc1CNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D13	compound treatment	0.806	0.0122	0.17	0.712	-0.0015	-0.02	0.1024	0.6152	1965748	Cerep_000391	CC1CN(CCN1c2ccc(C)cc2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D14	compound treatment	0.764	-0.0298	-0.4	0.66	-0.0535	-0.73	-0.7997	-0.9604	1965749	Cerep_000392	CC(COC(=O)N1CCC2(CC1)N(CNC2=O)c3ccccc3)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D15	compound treatment	0.795	0.00124	0.02	0.711	-0.0025	-0.03	-0.0122	-0.3212	1965750	Cerep_000393	Clc1ccc(cc1Cl)S(=O)(=O)NCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D16	compound treatment	0.782	-0.0118	-0.16	0.699	-0.0145	-0.2	-0.2519	-0.994	1965751	Cerep_000394	Cc1cccc(CCCOCCOC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D17	compound treatment	0.809	0.0152	0.21	0.712	-0.0015	-0.02	0.131	0.6339	1965752	Cerep_000395	CC1CCCCN1CCCNS(=O)(=O)c2c(C)c(C)cc(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D18	compound treatment	0.777	-0.0168	-0.23	0.684	-0.0295	-0.4	-0.4442	-0.9629	1965753	Cerep_000396	Oc1cccc(c1)C(=O)NNC(=O)OCCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D19	compound treatment	0.785	-0.00876	-0.12	0.71	-0.0035	-0.05	-0.1172	-0.9203	1965754	Cerep_000397	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)NC(Cc3ccccc3)C(=O)NNC(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D20	compound treatment	0.774	-0.0198	-0.27	0.715	0.0015	0.02	-0.1739	-0.6507	1965755	Cerep_000398	Fc1ccccc1N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D21	compound treatment	0.795	0.00124	0.02	0.707	-0.0065	-0.09	-0.0508	-0.563	1965756	Cerep_000399	CN(C)CCCNS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	D22	compound treatment	0.754	-0.0398	-0.54	0.704	-0.0095	-0.13	-0.4708	-0.8533	1965757	Cerep_000400	CCCCc1ccc(COC(=O)N2CCN(Cc3c(OC)ccc4ccccc34)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E03	compound treatment	0.811	0.0172	0.23	0.728	0.0145	0.2	0.3044	0.9967	1965758	Cerep_000401	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(O)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E04	compound treatment	0.798	0.00424	0.06	0.718	0.0045	0.06	0.0839	0.9994	1965759	Cerep_000402	Brc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E05	compound treatment	0.815	0.0212	0.29	0.738	0.0245	0.33	0.4389	0.9971	1965760	Cerep_000403	COc1ccc(Oc2cccc(/C=N/NC(=O)c3cc(nc4ccccc34)C5CC5)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E06	compound treatment	0.815	0.0212	0.29	0.722	0.0085	0.12	0.2847	0.9207	1965761	Cerep_000404	COc1cc(OC)c(CN2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E07	compound treatment	0.805	0.0112	0.15	0.723	0.0095	0.13	0.1989	0.9969	1965762	Cerep_000405	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(Br)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E08	compound treatment	0.84	0.0462	0.62	0.713	-4.95E-4	-0.01	0.4364	0.6994	1965763	Cerep_000406	OCC(O)CNS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E09	compound treatment	0.812	0.0182	0.25	0.737	0.0235	0.32	0.4007	0.9915	1965764	Cerep_000407	Oc1ccc(Br)cc1/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E10	compound treatment	0.785	-0.00876	-0.12	0.739	0.0255	0.35	0.1624	0.4422	1965765	Cerep_000408	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NC2CCCCC2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E11	compound treatment	0.77	-0.0238	-0.32	0.702	-0.0115	-0.16	-0.3375	-0.9459	1965766	Cerep_000409	Fc1ccccc1S(=O)(=O)NCc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E12	compound treatment	0.802	0.00824	0.11	0.724	0.0105	0.14	0.1799	0.9922	1965767	Cerep_000410	CCN(CC)CCNS(=O)(=O)c1cccc2nonc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E13	compound treatment	0.812	0.0182	0.25	0.667	-0.0465	-0.63	-0.2743	-0.4033	1965768	Cerep_000411	CN1CCN(CCCNS(=O)(=O)c2cccs2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E14	compound treatment	0.782	-0.0118	-0.16	0.694	-0.0195	-0.27	-0.3001	-0.9695	1965769	Cerep_000412	CC(=O)N1CCCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E15	compound treatment	0.814	0.0202	0.27	0.731	0.0175	0.24	0.3619	0.9977	1965770	Cerep_000413	OCCOCCNS(=O)(=O)c1ccc(C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E16	compound treatment	0.789	-0.00476	-0.06	0.695	-0.0185	-0.25	-0.2237	-0.8596	1965771	Cerep_000414	CCC(C)c1ccc(NS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E17	compound treatment	0.795	0.00124	0.02	0.701	-0.0125	-0.17	-0.1086	-0.6344	1169127	Cerep_000415	CCOC(=O)C1CCCN(C1)S(=O)(=O)c2c(F)cccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E18	compound treatment	0.794	2.45E-4	0.0	0.725	0.0115	0.16	0.1133	0.7218	1965772	Cerep_000416	Clc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Oc4cccc(Cl)c4C#N)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E19	compound treatment	0.814	0.0202	0.27	0.728	0.0145	0.2	0.333	0.9874	1965773	Cerep_000417	Oc1ccc2ccccc2c1/C=N/NC(=O)COc3ncn(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E20	compound treatment	0.796	0.00224	0.03	0.719	0.0055	0.08	0.0745	0.9203	1965774	Cerep_000418	NC(=O)C1CCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E21	compound treatment	0.816	0.0222	0.3	0.722	0.0085	0.12	0.2942	0.9145	1965775	Cerep_000419	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(Br)c(OC)cc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	E22	compound treatment	0.808	0.0142	0.19	0.744	0.0305	0.42	0.43	0.9385	1146379	Cerep_000420	CC(C)(C)CCNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F03	compound treatment	0.802	0.00824	0.11	0.72	0.0065	0.09	0.1414	0.9937	1965776	Cerep_000421	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCC(O)c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F04	compound treatment	0.75	-0.0438	-0.59	0.687	-0.0265	-0.36	-0.6729	-0.9722	1965777	Cerep_000422	COc1cc(CCNC(=O)OCCc2cccc(F)c2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F05	compound treatment	0.789	-0.00476	-0.06	0.728	0.0145	0.2	0.0945	0.4544	1965778	Cerep_000423	Clc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(Oc4cccc(Cl)c4C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F06	compound treatment	0.768	-0.0258	-0.35	0.699	-0.0145	-0.2	-0.3855	-0.9643	1965779	Cerep_000424	Cc1cccc(CCOC(=O)NNC(=O)Cn2cnc(Cl)c2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F07	compound treatment	0.77	-0.0238	-0.32	0.716	0.0025	0.03	-0.2025	-0.6282	1965780	Cerep_000425	CCCc1ccc(cc1)S(=O)(=O)NCc2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F08	compound treatment	0.773	-0.0208	-0.28	0.679	-0.0345	-0.47	-0.5306	-0.9693	1965781	Cerep_000426	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCCc4scnc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F09	compound treatment	0.786	-0.00776	-0.1	0.706	-0.0075	-0.1	-0.1463	-0.9999	1965782	Cerep_000427	CCCc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F10	compound treatment	0.791	-0.00276	-0.04	0.693	-0.0205	-0.28	-0.2239	-0.7942	1965783	Cerep_000428	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4ccccc4CCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F11	compound treatment	0.795	0.00124	0.02	0.698	-0.0155	-0.21	-0.1375	-0.6489	1965784	Cerep_000429	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F12	compound treatment	0.794	2.45E-4	0.0	0.695	-0.0185	-0.25	-0.176	-0.6978	1965785	Cerep_000430	Cc1ccc2[nH]cc(CCNC(=O)OCCN3CCN(Cc4ccc(Oc5ccccc5)cc4)CC3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F13	compound treatment	0.805	0.0112	0.15	0.705	-0.0085	-0.12	0.0253	0.1328	1965786	Cerep_000431	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F14	compound treatment	0.762	-0.0318	-0.43	0.686	-0.0275	-0.37	-0.568	-0.9978	1965787	Cerep_000432	Cc1nc(sc1C(=O)NNC(=O)OCC2CCOC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F15	compound treatment	0.795	0.00124	0.02	0.724	0.0105	0.14	0.1132	0.7846	1308655	Cerep_000433	CC1CN(CC(C)O1)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F16	compound treatment	0.78	-0.0138	-0.19	0.718	0.0045	0.06	-0.0878	-0.4491	1965788	Cerep_000434	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cc5OCOc5cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F17	compound treatment	0.778	-0.0158	-0.21	0.716	0.0025	0.03	-0.1261	-0.586	1722314	Cerep_000435	CCCN(CC1CC1)S(=O)(=O)c2c(C)c(C)cc(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F18	compound treatment	0.77	-0.0238	-0.32	0.705	-0.0085	-0.12	-0.3085	-0.9054	1965789	Cerep_000436	COc1ccc2[nH]cc(CCNC(=O)OCCn3cccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F19	compound treatment	0.812	0.0182	0.25	0.713	-4.95E-4	-0.01	0.1693	0.6874	1965790	Cerep_000437	CC(C)(C)OC(=O)NCCCCCNS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F20	compound treatment	0.775	-0.0188	-0.25	0.692	-0.0215	-0.29	-0.3862	-0.9973	1965791	Cerep_000438	CCCCCCC#CCCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F21	compound treatment	0.784	-0.00976	-0.13	0.754	0.0405	0.55	0.2975	0.524	1965792	Cerep_000439	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	F22	compound treatment	0.764	-0.0298	-0.4	0.699	-0.0145	-0.2	-0.4236	-0.9467	1965793	Cerep_000440	Fc1cc(ccc1COC(=O)N2CCN(Cc3ccc(Oc4ccccc4)cc3)CC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G03	compound treatment	0.795	0.00124	0.02	0.703	-0.0105	-0.14	-0.0893	-0.6199	1965794	Cerep_000441	Fc1cccc(Cl)c1/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G04	compound treatment	0.828	0.0342	0.46	0.739	0.0255	0.35	0.5726	0.9902	1965795	Cerep_000442	OCC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G05	compound treatment	0.799	0.00524	0.07	0.718	0.0045	0.06	0.0935	0.9975	1965796	Cerep_000443	COc1ccccc1/C=N/NC(=O)c2cc(Br)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G06	compound treatment	0.805	0.0112	0.15	0.701	-0.0125	-0.17	-0.0132	-0.0579	1965797	Cerep_000444	CC(C)(C)Sc1ccccc1CN2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G07	compound treatment	0.798	0.00424	0.06	0.732	0.0185	0.25	0.2189	0.8461	1965798	Cerep_000445	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(OC(C)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G08	compound treatment	0.796	0.00224	0.03	0.724	0.0105	0.14	0.1227	0.8381	1965799	Cerep_000446	NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G09	compound treatment	0.805	0.0112	0.15	0.723	0.0095	0.13	0.1989	0.9969	1965800	Cerep_000447	Cc1ccc(Oc2cccc(/C=N/NC(=O)c3cc(nc4ccccc34)C5CC5)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G10	compound treatment	0.771	-0.0228	-0.31	0.73	0.0165	0.23	-0.0579	-0.1522	1965801	Cerep_000448	CC(=O)NCCNS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G11	compound treatment	0.807	0.0132	0.18	0.717	0.0035	0.05	0.1601	0.8658	1965802	Cerep_000449	Fc1ccccc1S(=O)(=O)N2CCSCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G12	compound treatment	0.803	0.00924	0.12	0.714	5.05E-4	0.01	0.0931	0.745	1348926	Cerep_000450	O=S(=O)(NCc1ccco1)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G13	compound treatment	0.798	0.00424	0.06	0.709	-0.0045	-0.06	-0.0029	-0.034	1215007	Cerep_000451	O=S(=O)(NCc1cccnc1)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G14	compound treatment	0.805	0.0112	0.15	0.719	0.0055	0.08	0.1603	0.9474	1965803	Cerep_000452	COc1ccc(CNS(=O)(=O)c2cccc3nonc23)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G15	compound treatment	0.8	0.00624	0.08	0.701	-0.0125	-0.17	-0.0609	-0.3205	1965804	Cerep_000453	OCC1CCCN(C1)S(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G16	compound treatment	0.801	0.00724	0.1	0.718	0.0045	0.06	0.1125	0.975	1542603	Cerep_000454	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCCc3c[nH]c4ccccc34)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G17	compound treatment	0.812	0.0182	0.25	0.725	0.0115	0.16	0.285	0.9763	1965805	Cerep_000455	OC(C(NS(=O)(=O)c1c(F)cccc1F)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G18	compound treatment	0.815	0.0212	0.29	0.692	-0.0215	-0.29	-0.0046	-0.0112	1965806	Cerep_000456	CC(OCc1ccccc1)C(NS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G19	compound treatment	0.822	0.0282	0.38	0.715	0.0015	0.02	0.2839	0.7441	1965807	Cerep_000457	C=CCOc1ccccc1/C=N/NC(=O)\C=C\c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G20	compound treatment	0.801	0.00724	0.1	0.707	-0.0065	-0.09	0.0065	0.0491	1965808	Cerep_000458	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc4nonc34)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G21	compound treatment	0.81	0.0162	0.22	0.739	0.0255	0.35	0.4009	0.9752	1965809	Cerep_000459	CC(C)(C)c1ccc(Oc2cccc(/C=N/NC(=O)\C=C\c3ccc4OCOc4c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	G22	compound treatment	0.792	-0.00176	-0.02	0.724	0.0105	0.14	0.0845	0.5823	1965810	Cerep_000460	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)N3CCN(CC3)c4ccncc4)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H03	compound treatment	0.803	0.00924	0.12	0.712	-0.0015	-0.02	0.0738	0.5837	1965811	Cerep_000461	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H04	compound treatment	0.759	-0.0348	-0.47	0.709	-0.0045	-0.06	-0.3749	-0.7928	1965812	Cerep_000462	Clc1ccc(cc1)C2(COC(=O)NCc3ccccc3Br)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H05	compound treatment	0.804	0.0102	0.14	0.728	0.0145	0.2	0.2376	0.9846	1965813	Cerep_000463	CC1CN(CCN1c2ccc(Cl)cc2)S(=O)(=O)c3ccc(Oc4cccc(Cl)c4C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H06	compound treatment	0.782	-0.0118	-0.16	0.719	0.0055	0.08	-0.0591	-0.3366	1965814	Cerep_000464	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H07	compound treatment	0.812	0.0182	0.25	0.739	0.0255	0.35	0.42	0.9857	1965815	Cerep_000465	CCCc1ccc(cc1)S(=O)(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H08	compound treatment	0.778	-0.0158	-0.21	0.674	-0.0395	-0.54	-0.5311	-0.9173	1965816	Cerep_000466	Clc1cccc(Cl)c1CN2CCCC(COC(=O)NCc3ccc(cc3)c4csnn4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H09	compound treatment	0.79	-0.00376	-0.05	0.711	-0.0025	-0.03	-0.0599	-0.9812	1965817	Cerep_000467	CCCc1ccc(cc1)S(=O)(=O)NCCN2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H10	compound treatment	0.777	-0.0168	-0.23	0.712	-0.0015	-0.02	-0.1743	-0.7678	1965818	Cerep_000468	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5cc(C)cc(C)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H11	compound treatment	0.779	-0.0148	-0.2	0.721	0.0075	0.1	-0.0684	-0.3056	1965819	Cerep_000469	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H12	compound treatment	0.778	-0.0158	-0.21	0.677	-0.0365	-0.5	-0.5022	-0.928	1965820	Cerep_000470	COC(=O)C1CC(CN1C(=O)OCC2CCCN(Cc3ccc4ccccc4c3)C2)OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H13	compound treatment	0.793	-7.55E-4	-0.01	0.716	0.0025	0.03	0.0169	0.4754	1965821	Cerep_000471	Clc1ccc(cc1Cl)S(=O)(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H14	compound treatment	0.773	-0.0208	-0.28	0.703	-0.0105	-0.14	-0.2992	-0.9514	1965822	Cerep_000472	O=C(OCC(Cc1ccccc1)N(Cc2ccccc2)Cc3ccccc3)N4CCC(CC4)n5c(=O)[nH]c6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H15	compound treatment	0.78	-0.0138	-0.19	0.665	-0.0485	-0.66	-0.5988	-0.8719	1719176	Cerep_000473	Clc1ccc(cc1Cl)S(=O)(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H16	compound treatment	0.773	-0.0208	-0.28	0.684	-0.0295	-0.4	-0.4824	-0.9843	1965823	Cerep_000474	O=C(OCC1CCCCN1Cc2ccco2)N3CCN(CC3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H17	compound treatment	0.786	-0.00776	-0.1	0.734	0.0205	0.28	0.1237	0.4145	1965824	Cerep_000475	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3cc(nc4ccccc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H18	compound treatment	0.747	-0.0468	-0.63	0.69	-0.0235	-0.32	-0.6726	-0.9507	1965825	Cerep_000476	Fc1cccc(Cl)c1CN2CCC(C2)NC(=O)OCC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H19	compound treatment	0.805	0.0112	0.15	0.725	0.0115	0.16	0.2182	0.9999	1965826	Cerep_000477	CC(C)(C)OC(=O)N1CCCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H20	compound treatment	0.79	-0.00376	-0.05	0.694	-0.0195	-0.27	-0.2238	-0.827	1965827	Cerep_000478	NS(=O)(=O)c1ccc(CNC(=O)OC/C=C/COCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H21	compound treatment	0.793	-7.55E-4	-0.01	0.71	-0.0035	-0.05	-0.0409	-0.8393	1144090	Cerep_000479	Cc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3c(C)c(C)cc(C)c3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	H22	compound treatment	0.779	-0.0148	-0.2	0.701	-0.0125	-0.17	-0.2612	-0.997	1965828	Cerep_000480	Fc1ccc(c(COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I03	compound treatment	0.822	0.0282	0.38	0.736	0.0225	0.31	0.4864	0.9942	1965829	Cerep_000481	COc1cc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)cc(Br)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I04	compound treatment	0.763	-0.0308	-0.41	0.716	0.0025	0.03	-0.2692	-0.6467	1965830	Cerep_000482	Clc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I05	compound treatment	0.789	-0.00476	-0.06	0.711	-0.0025	-0.03	-0.0694	-0.956	1965831	Cerep_000483	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc(Oc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I06	compound treatment	0.782	-0.0118	-0.16	0.7	-0.0135	-0.18	-0.2423	-0.9973	1468925	Cerep_000484	CC(C)N1CCN(CC1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I07	compound treatment	0.779	-0.0148	-0.2	0.702	-0.0115	-0.16	-0.2516	-0.993	1965832	Cerep_000485	COc1cc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)ccc1OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I08	compound treatment	0.805	0.0112	0.15	0.686	-0.0275	-0.37	-0.1579	-0.3903	1965833	Cerep_000486	OCCNS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I09	compound treatment	0.785	-0.00876	-0.12	0.733	0.0195	0.27	0.1046	0.3593	1965834	Cerep_000487	O=C(Cc1csc(n1)c2ccccc2)N/N=C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I10	compound treatment	0.797	0.00324	0.04	0.714	5.05E-4	0.01	0.0358	0.8084	1965835	Cerep_000488	CN(C)CCNS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I11	compound treatment	0.802	0.00824	0.11	0.697	-0.0165	-0.22	-0.0804	-0.3204	1965836	Cerep_000489	Fc1ccccc1S(=O)(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I12	compound treatment	0.81	0.0162	0.22	0.739	0.0255	0.35	0.4009	0.9752	1965837	Cerep_000490	CC(C)(C)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I13	compound treatment	0.788	-0.00576	-0.08	0.722	0.0085	0.12	0.0271	0.1942	1965838	Cerep_000491	O=S(=O)(Nc1ccc2OCCOc2c1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I14	compound treatment	0.814	0.0202	0.27	0.704	-0.0095	-0.13	0.1016	0.336	1965839	Cerep_000492	O=S(=O)(NCC1CCCO1)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I15	compound treatment	0.794	2.45E-4	0.0	0.699	-0.0145	-0.2	-0.1374	-0.6952	1965840	Cerep_000493	CC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I16	compound treatment	0.774	-0.0198	-0.27	0.712	-0.0015	-0.02	-0.2029	-0.759	1965841	Cerep_000494	Clc1cc(Cl)cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I17	compound treatment	0.82	0.0262	0.35	0.736	0.0225	0.31	0.4674	0.9975	1965842	Cerep_000495	Fc1cccc(F)c1S(=O)(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I18	compound treatment	0.811	0.0172	0.23	0.732	0.0185	0.25	0.3429	0.9992	1965843	Cerep_000496	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NC3CCN(Cc4ccccc4)C3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I19	compound treatment	0.793	-7.55E-4	-0.01	0.722	0.0085	0.12	0.0748	0.6425	1965844	Cerep_000497	Oc1c(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc(Br)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I20	compound treatment	0.789	-0.00476	-0.06	0.719	0.0055	0.08	0.0077	0.0781	1965845	Cerep_000498	CCOC(=O)N1CCC(CC1)NS(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I21	compound treatment	0.816	0.0222	0.3	0.734	0.0205	0.28	0.4099	0.9994	1965846	Cerep_000499	COc1ccc(Cl)cc1C(=O)N/N=C/c2cccc(Oc3cccc(c3)C(F)(F)F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	I22	compound treatment	0.821	0.0272	0.37	0.72	0.0065	0.09	0.3226	0.8533	1965847	Cerep_000500	COC(=O)C1CC(CN1S(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J03	compound treatment	0.811	0.0172	0.23	0.715	0.0015	0.02	0.179	0.7665	1965848	Cerep_000501	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(C)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J04	compound treatment	0.78	-0.0138	-0.19	0.707	-0.0065	-0.09	-0.1938	-0.9427	1965849	Cerep_000502	CCOC(=O)CCCCCOC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J05	compound treatment	0.769	-0.0248	-0.33	0.733	0.0195	0.27	-0.0481	-0.1126	1965850	Cerep_000503	CC1CN(CCN1c2ccc(Cl)cc2)S(=O)(=O)c3ccc(Br)cc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J06	compound treatment	0.779	-0.0148	-0.2	0.701	-0.0125	-0.17	-0.2612	-0.997	1965851	Cerep_000504	Clc1ccc(CCOC(=O)NNC(=O)c2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J07	compound treatment	0.797	0.00324	0.04	0.735	0.0215	0.29	0.2383	0.8037	1965852	Cerep_000505	CCCCCCNS(=O)(=O)c1ccc(CCC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J08	compound treatment	0.808	0.0142	0.19	0.7	-0.0135	-0.18	0.0058	0.0216	1965853	Cerep_000506	COc1cc(Cl)c(COC(=O)N2CCN(CC2)C(=O)c3ccc(C)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J09	compound treatment	0.779	-0.0148	-0.2	0.728	0.0145	0.2	-9.0E-4	-0.0032	1965854	Cerep_000507	CCCc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cc(nc4ccc(C)cc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J10	compound treatment	0.756	-0.0378	-0.51	0.695	-0.0185	-0.25	-0.5385	-0.9475	1965855	Cerep_000508	Clc1ccc2[nH]cc(CCNC(=O)OCc3cccnc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J11	compound treatment	0.801	0.00724	0.1	0.724	0.0105	0.14	0.1704	0.9826	1965856	Cerep_000509	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J12	compound treatment	0.784	-0.00976	-0.13	0.712	-0.0015	-0.02	-0.1075	-0.807	1965857	Cerep_000510	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)C(C)Sc3ccc(Cl)cc3)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J13	compound treatment	0.784	-0.00976	-0.13	0.705	-0.0085	-0.12	-0.175	-0.998	1965858	Cerep_000511	CC1(C)CCCN(C1)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J14	compound treatment	0.777	-0.0168	-0.23	0.703	-0.0105	-0.14	-0.261	-0.9757	1965859	Cerep_000512	O=C(CC1Sc2ccccc2NC1=O)NNC(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J15	compound treatment	0.787	-0.00676	-0.09	0.712	-0.0015	-0.02	-0.0789	-0.8444	1965860	Cerep_000513	COc1cccc(c1)C2N(CCc3c2[nH]c4ccccc34)S(=O)(=O)c5ccc(Cl)c(Cl)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J16	compound treatment	0.773	-0.0208	-0.28	0.701	-0.0125	-0.17	-0.3185	-0.9716	1965861	Cerep_000514	Fc1cccc(CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J17	compound treatment	0.8	0.00624	0.08	0.705	-0.0085	-0.12	-0.0223	-0.156	1965862	Cerep_000515	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J18	compound treatment	0.772	-0.0218	-0.29	0.677	-0.0365	-0.5	-0.5594	-0.9683	1965863	Cerep_000516	CC(C)(C)c1ccc(NC(=O)OCCCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J19	compound treatment	0.827	0.0332	0.45	0.735	0.0215	0.29	0.5245	0.9788	1965864	Cerep_000517	CCOC(=O)N1CCC(CC1)NS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J20	compound treatment	0.796	0.00224	0.03	0.667	-0.0465	-0.63	-0.4269	-0.6726	1965865	Cerep_000518	Clc1ccc(Sc2ccccc2CN3CCC(C3)NC(=O)OCc4ccc(cc4)c5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J21	compound treatment	0.827	0.0332	0.45	0.738	0.0245	0.33	0.5534	0.9895	1965866	Cerep_000519	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	J22	compound treatment	0.753	-0.0408	-0.55	0.713	-4.95E-4	-0.01	-0.3936	-0.7157	1965867	Cerep_000520	CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(Cc2ccc(OCC=C)cc2)CC1)C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K03	compound treatment	0.82	0.0262	0.35	0.748	0.0345	0.47	0.5831	0.9902	1965868	Cerep_000521	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OC)c(O)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K04	compound treatment	0.801	0.00724	0.1	0.721	0.0075	0.1	0.1415	0.9997	1965869	Cerep_000522	OCC1CCCCC1NS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K05	compound treatment	0.781	-0.0128	-0.17	0.708	-0.0055	-0.07	-0.1747	-0.9306	1965870	Cerep_000523	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(\C=C\C(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K06	compound treatment	0.809	0.0152	0.21	0.715	0.0015	0.02	0.1599	0.7738	1965871	Cerep_000524	CCc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K07	compound treatment	0.777	-0.0168	-0.23	0.73	0.0165	0.23	-7.0E-4	-0.0022	1965872	Cerep_000525	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OC)c(OC(=O)C)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K08	compound treatment	0.792	-0.00176	-0.02	0.725	0.0115	0.16	0.0942	0.5936	1965873	Cerep_000526	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)NCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K09	compound treatment	0.797	0.00324	0.04	0.729	0.0155	0.21	0.1805	0.8358	1965874	Cerep_000527	OC(=O)c1cc(/C=N/NC(=O)c2cc3ccccc3s2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K10	compound treatment	0.804	0.0102	0.14	0.726	0.0125	0.17	0.2183	0.9946	1965875	Cerep_000528	CSCCC(CO)NS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K11	compound treatment	0.786	-0.00776	-0.1	0.72	0.0065	0.09	-0.0113	-0.0821	1749552	Cerep_000529	Fc1ccccc1S(=O)(=O)NCc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K12	compound treatment	0.801	0.00724	0.1	0.723	0.0095	0.13	0.1608	0.9903	1965876	Cerep_000530	CCOC(=O)C1CCCN(C1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K13	compound treatment	0.78	-0.0138	-0.19	0.683	-0.0305	-0.42	-0.4253	-0.9339	1965877	Cerep_000531	O=S(=O)(N1CCN(C/C=C/c2ccccc2)CC1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K14	compound treatment	0.804	0.0102	0.14	0.717	0.0035	0.05	0.1315	0.8994	1965878	Cerep_000532	COc1cc2CCN(C(CC#N)c2cc1OC)S(=O)(=O)c3cccc4nonc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K15	compound treatment	0.802	0.00824	0.11	0.743	0.0295	0.4	0.3631	0.87	1965879	Cerep_000533	Oc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K16	compound treatment	0.782	-0.0118	-0.16	0.73	0.0165	0.23	0.047	0.1707	1965880	Cerep_000534	Clc1cc(Cl)cc(/C=N/NC(=O)CC2OC(=O)c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K17	compound treatment	0.816	0.0222	0.3	0.7	-0.0135	-0.18	0.0821	0.2331	1965881	Cerep_000535	CN1CCCN(CC1)S(=O)(=O)c2c(F)cccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K18	compound treatment	0.811	0.0172	0.23	0.713	-4.95E-4	-0.01	0.1597	0.6863	1965882	Cerep_000536	Clc1ccc(CCNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K19	compound treatment	0.823	0.0292	0.39	0.733	0.0195	0.27	0.467	0.9816	1965883	Cerep_000537	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3cc(OCc4ccccc4)cc(OCc5ccccc5)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K20	compound treatment	0.796	0.00224	0.03	0.726	0.0125	0.17	0.142	0.8198	1287841	Cerep_000538	CC(=O)Nc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K21	compound treatment	0.8	0.00624	0.08	0.723	0.0095	0.13	0.1512	0.9782	1965884	Cerep_000539	Clc1ccc(Oc2cccc(/C=N/NC(=O)\C=C\c3ccc4OCOc4c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	K22	compound treatment	0.801	0.00724	0.1	0.731	0.0175	0.24	0.2379	0.9223	1965885	Cerep_000540	Cc1cccc(CNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L03	compound treatment	0.811	0.0172	0.23	0.707	-0.0065	-0.09	0.1019	0.4092	1512901	Cerep_000541	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCC2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L04	compound treatment	0.787	-0.00676	-0.09	0.686	-0.0275	-0.37	-0.3296	-0.8541	1965886	Cerep_000542	CC(COC(=O)NC(C)c1cccc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L05	compound treatment	0.805	0.0112	0.15	0.711	-0.0025	-0.03	0.0832	0.5352	1965887	Cerep_000543	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)Nc2ccc3[nH]ncc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L06	compound treatment	0.77	-0.0238	-0.32	0.706	-0.0075	-0.1	-0.2989	-0.8885	1965888	Cerep_000544	Cc1ccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L07	compound treatment	0.79	-0.00376	-0.05	0.709	-0.0045	-0.06	-0.0792	-0.9955	1965889	Cerep_000545	CCCc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L08	compound treatment	0.752	-0.0418	-0.56	0.686	-0.0275	-0.37	-0.6634	-0.9804	1965890	Cerep_000546	NC(=O)C1CCN(CC1)C(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L09	compound treatment	0.783	-0.0108	-0.15	0.71	-0.0035	-0.05	-0.1363	-0.8925	1965891	Cerep_000547	CCCc1ccc(cc1)S(=O)(=O)NCCOc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L10	compound treatment	0.785	-0.00876	-0.12	0.709	-0.0045	-0.06	-0.1269	-0.9533	1965892	Cerep_000548	CCCCc1ccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L11	compound treatment	0.784	-0.00976	-0.13	0.703	-0.0105	-0.14	-0.1943	-0.9991	1331864	Cerep_000549	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(Cc3ccc(cc3)C(C)(C)C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L12	compound treatment	0.785	-0.00876	-0.12	0.706	-0.0075	-0.1	-0.1558	-0.9974	1965893	Cerep_000550	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCCc3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L13	compound treatment	0.805	0.0112	0.15	0.721	0.0075	0.1	0.1796	0.9816	1965894	Cerep_000551	Cc1cccc(C)c1N2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L14	compound treatment	0.786	-0.00776	-0.1	0.694	-0.0195	-0.27	-0.262	-0.9169	1965895	Cerep_000552	COc1cc(OC)c(CN2CCC(C2)NC(=O)OCc3ccc(C#Cc4ccccc4)s3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L15	compound treatment	0.801	0.00724	0.1	0.731	0.0175	0.24	0.2379	0.9223	1965896	Cerep_000553	COc1ccc2[nH]cc(CCNS(=O)(=O)c3ccc(Cl)c(Cl)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L16	compound treatment	0.753	-0.0408	-0.55	0.695	-0.0185	-0.25	-0.5671	-0.9375	1965897	Cerep_000554	Clc1ccc(cc1)C2(COC(=O)NC3CCCCNC3=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L17	compound treatment	0.813	0.0192	0.26	0.737	0.0235	0.32	0.4102	0.9945	1965898	Cerep_000555	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L18	compound treatment	0.765	-0.0288	-0.39	0.704	-0.0095	-0.13	-0.3659	-0.8946	1965899	Cerep_000556	NS(=O)(=O)c1ccc(CNC(=O)OCCCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L19	compound treatment	0.803	0.00924	0.12	0.714	5.05E-4	0.01	0.0931	0.745	1965900	Cerep_000557	CC(=O)Nc1ccc(NS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L20	compound treatment	0.764	-0.0298	-0.4	0.717	0.0035	0.05	-0.2501	-0.6186	1965901	Cerep_000558	CC(C(=O)NNC(=O)OCc1c(F)cccc1Cl)n2nnc(n2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L21	compound treatment	0.807	0.0132	0.18	0.725	0.0115	0.16	0.2373	0.9979	1965902	Cerep_000559	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCOc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	L22	compound treatment	0.794	2.45E-4	0.0	0.719	0.0055	0.08	0.0554	0.7375	1965903	Cerep_000560	CC(NC(=O)OCCc1ccccc1F)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M03	compound treatment	0.796	0.00224	0.03	0.725	0.0115	0.16	0.1323	0.8283	1965904	Cerep_000561	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M04	compound treatment	0.815	0.0212	0.29	0.699	-0.0145	-0.2	0.0629	0.1806	1965905	Cerep_000562	Brc1ccc(cc1)S(=O)(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M05	compound treatment	0.796	0.00224	0.03	0.701	-0.0125	-0.17	-0.0991	-0.5725	1965906	Cerep_000563	CCOc1cccc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M06	compound treatment	0.798	0.00424	0.06	0.715	0.0015	0.02	0.055	0.9042	1565952	Cerep_000564	Clc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M07	compound treatment	0.815	0.0212	0.29	0.719	0.0055	0.08	0.2557	0.8632	1965907	Cerep_000565	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(SC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M08	compound treatment	0.793	-7.55E-4	-0.01	0.753	0.0395	0.54	0.3737	0.6936	1965908	Cerep_000566	OCCOCCN1CCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M09	compound treatment	0.804	0.0102	0.14	0.711	-0.0025	-0.03	0.0737	0.5176	1965909	Cerep_000567	O=C(N/N=C/c1ccc(OCc2ccccc2)c(OCc3ccccc3)c1)C4CC4c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M10	compound treatment	0.813	0.0192	0.26	0.713	-4.95E-4	-0.01	0.1788	0.6885	1129811	Cerep_000568	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M11	compound treatment	0.794	2.45E-4	0.0	0.717	0.0035	0.05	0.0361	0.7541	1965910	Cerep_000569	OC1CCN(C1)S(=O)(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M12	compound treatment	0.803	0.00924	0.12	0.704	-0.0095	-0.13	-0.0034	-0.0188	1265040	Cerep_000570	O=S(=O)(N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4cccc5nonc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M13	compound treatment	0.784	-0.00976	-0.13	0.718	0.0045	0.06	-0.0496	-0.3417	1965911	Cerep_000571	CN(C(=O)CN1CCN(CC1)S(=O)(=O)c2cccs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M14	compound treatment	0.821	0.0272	0.37	0.72	0.0065	0.09	0.3226	0.8533	1965912	Cerep_000572	CC(C)(C)OC(=O)NCCCCCNS(=O)(=O)c1cccc2nonc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M15	compound treatment	0.777	-0.0168	-0.23	0.703	-0.0105	-0.14	-0.261	-0.9757	1965913	Cerep_000573	CC(=O)NCCNS(=O)(=O)c1ccc(C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M16	compound treatment	0.811	0.0172	0.23	0.693	-0.0205	-0.28	-0.0331	-0.0911	1965914	Cerep_000574	Clc1cc(Cl)cc(/C=N/NC(=O)c2ccc3nonc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M17	compound treatment	0.803	0.00924	0.12	0.707	-0.0065	-0.09	0.0256	0.1671	1965915	Cerep_000575	CCN1CCCC1CNS(=O)(=O)c2c(F)cccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M18	compound treatment	0.803	0.00924	0.12	0.716	0.0025	0.03	0.1123	0.8688	1437573	Cerep_000576	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCc3cccs3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M19	compound treatment	0.811	0.0172	0.23	0.735	0.0215	0.29	0.3719	0.9934	1965916	Cerep_000577	COc1cc(/C=N/NC(=O)c2ccc3nonc3c2)ccc1OCc4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M20	compound treatment	0.803	0.00924	0.12	0.717	0.0035	0.05	0.122	0.9133	1965917	Cerep_000578	CC(C)CC(NS(=O)(=O)c1cccc2nonc12)C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M21	compound treatment	0.813	0.0192	0.26	0.721	0.0075	0.1	0.2559	0.9172	1965918	Cerep_000579	Oc1cc(/C=N/NC(=O)c2ccc3nonc3c2)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	M22	compound treatment	0.824	0.0302	0.41	0.733	0.0195	0.27	0.4766	0.9785	1965919	Cerep_000580	OCC1CCCCC1NS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N03	compound treatment	0.818	0.0242	0.33	0.719	0.0055	0.08	0.2844	0.8474	1965920	Cerep_000581	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCCOC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N04	compound treatment	0.784	-0.00976	-0.13	0.683	-0.0305	-0.42	-0.3871	-0.8875	1965921	Cerep_000582	Cc1ccc(N2CCN(CC2)C(=O)OCCc3ccc(Cl)cc3Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N05	compound treatment	0.812	0.0182	0.25	0.719	0.0055	0.08	0.2271	0.8826	1965922	Cerep_000583	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)Nc3ccc4[nH]ncc4c3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N06	compound treatment	0.804	0.0102	0.14	0.697	-0.0165	-0.22	-0.0613	-0.2323	1965923	Cerep_000584	CC(CCOC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N07	compound treatment	0.77	-0.0238	-0.32	0.76	0.0465	0.63	0.2218	0.3122	1199332	Cerep_000585	CCCc1ccc(cc1)S(=O)(=O)N2CCCC2COC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N08	compound treatment	0.741	-0.0528	-0.71	0.707	-0.0065	-0.09	-0.5659	-0.789	1965924	Cerep_000586	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N09	compound treatment	0.763	-0.0308	-0.41	0.684	-0.0295	-0.4	-0.5778	-0.9999	1965925	Cerep_000587	CCCc1ccc(cc1)S(=O)(=O)N2CCCC(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N10	compound treatment	0.781	-0.0128	-0.17	0.657	-0.0565	-0.77	-0.6664	-0.8442	1965926	Cerep_000588	Fc1cc(ccc1COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N11	compound treatment	0.792	-0.00176	-0.02	0.719	0.0055	0.08	0.0363	0.4616	1965927	Cerep_000589	CC(=O)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3c(C)c(C)cc(C)c3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N12	compound treatment	0.793	-7.55E-4	-0.01	0.713	-4.95E-4	-0.01	-0.012	-0.98	1965928	Cerep_000590	OC(C1CCN(CC1)C(=O)OCc2ccccc2Br)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N13	compound treatment	0.821	0.0272	0.37	0.686	-0.0275	-0.37	-0.0052	-0.01	1965929	Cerep_000591	COc1ccc(F)c(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N14	compound treatment	0.804	0.0102	0.14	0.719	0.0055	0.08	0.1508	0.9589	1965930	Cerep_000592	CC(N1CCN(CC1)C(=O)OCc2ccc(C#CC(C)(C)O)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N15	compound treatment	0.752	-0.0418	-0.56	0.695	-0.0185	-0.25	-0.5767	-0.9343	1965931	Cerep_000593	FC(F)(F)c1cccnc1N2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N16	compound treatment	0.804	0.0102	0.14	0.709	-0.0045	-0.06	0.0544	0.3597	1965932	Cerep_000594	CCOC(=O)CCCCCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N17	compound treatment	0.817	0.0232	0.31	0.681	-0.0325	-0.44	-0.0916	-0.1687	1965933	Cerep_000595	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3cc(ccn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N18	compound treatment	0.781	-0.0128	-0.17	0.695	-0.0185	-0.25	-0.3	-0.9826	1965934	Cerep_000596	Fc1ccc(/C=C/C(=O)NNC(=O)OCCCc2cccnc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N19	compound treatment	0.788	-0.00576	-0.08	0.689	-0.0245	-0.33	-0.2911	-0.8488	1965935	Cerep_000597	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)NCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N20	compound treatment	0.772	-0.0218	-0.29	0.707	-0.0065	-0.09	-0.2702	-0.8812	1965936	Cerep_000598	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3cccc(Br)c3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N21	compound treatment	0.814	0.0202	0.27	0.739	0.0255	0.35	0.439	0.9928	1965937	Cerep_000599	COc1cc(CCNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	N22	compound treatment	0.765	-0.0288	-0.39	0.682	-0.0315	-0.43	-0.578	-0.9987	1965938	Cerep_000600	Clc1ncn(CC(=O)NNC(=O)OCCc2ccccc2Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O03	compound treatment	0.812	0.0182	0.25	0.727	0.0135	0.18	0.3043	0.9898	1965939	Cerep_000601	COc1ccccc1/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O04	compound treatment	0.788	-0.00576	-0.08	0.737	0.0235	0.32	0.1717	0.5207	1965940	Cerep_000602	COc1ccc2ccccc2c1CN3CCC(C3)NS(=O)(=O)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O05	compound treatment	0.81	0.0162	0.22	0.722	0.0085	0.12	0.237	0.9557	1965941	Cerep_000603	COc1cc(C)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O06	compound treatment	0.812	0.0182	0.25	0.723	0.0095	0.13	0.2657	0.9551	1965942	Cerep_000604	CN(C)CCN1CCN(CC1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O07	compound treatment	0.794	2.45E-4	0.0	0.728	0.0145	0.2	0.1422	0.7188	1965943	Cerep_000605	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O08	compound treatment	0.825	0.0312	0.42	0.726	0.0125	0.17	0.4186	0.9207	1965944	Cerep_000606	CC(=O)NC1CCN(C1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O09	compound treatment	0.848	0.0542	0.73	0.749	0.0355	0.48	0.8598	0.9799	1965945	Cerep_000607	COc1ccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O10	compound treatment	0.77	-0.0238	-0.32	0.683	-0.0305	-0.42	-0.5207	-0.9917	1965946	Cerep_000608	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O11	compound treatment	0.806	0.0122	0.17	0.731	0.0175	0.24	0.2856	0.9838	1965947	Cerep_000609	OC1(Cc2ccccc2)CCN(CC1)S(=O)(=O)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O12	compound treatment	0.82	0.0262	0.35	0.732	0.0185	0.25	0.4288	0.9862	1965948	Cerep_000610	Cc1ccccc1N2CCN(CC2)S(=O)(=O)c3cccc4nonc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O13	compound treatment	0.784	-0.00976	-0.13	0.697	-0.0165	-0.22	-0.2521	-0.9674	1290214	Cerep_000611	O=S(=O)(N1CCN(CC1)c2ccccc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O14	compound treatment	0.788	-0.00576	-0.08	0.718	0.0045	0.06	-0.0115	-0.1158	1965949	Cerep_000612	CC(C)(C)OC(=O)N1CCCN(CC1)S(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O15	compound treatment	0.82	0.0262	0.35	0.737	0.0235	0.32	0.477	0.9988	1965950	Cerep_000613	O=S(=O)(N1CCCCC1)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O16	compound treatment	0.802	0.00824	0.11	0.719	0.0055	0.08	0.1317	0.9817	1965951	Cerep_000614	COc1cc(OC)c(/C=N/NC(=O)c2ccc3nonc3c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O17	compound treatment	0.796	0.00224	0.03	0.715	0.0015	0.02	0.0359	0.982	1965952	Cerep_000615	[O-][N+](=O)c1ccc(NCCNS(=O)(=O)c2c(F)cccc2F)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O18	compound treatment	0.793	-7.55E-4	-0.01	0.723	0.0095	0.13	0.0844	0.6495	1965953	Cerep_000616	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCCN3CCOCC3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O19	compound treatment	0.799	0.00524	0.07	0.717	0.0035	0.05	0.0838	0.9818	1965954	Cerep_000617	CN(C)c1ccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O20	compound treatment	0.783	-0.0108	-0.15	0.712	-0.0015	-0.02	-0.117	-0.7986	1965955	Cerep_000618	O=C(NNC(=O)C(Cc1ccccc1)NS(=O)(=O)c2cccc3nonc23)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O21	compound treatment	0.812	0.0182	0.25	0.762	0.0485	0.66	0.6417	0.9093	1965956	Cerep_000619	COc1ccc(/C=N/NC(=O)c2ccc3nonc3c2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	O22	compound treatment	0.841	0.0472	0.64	0.744	0.0305	0.42	0.7448	0.9786	1965957	Cerep_000620	OCC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3ccc(Oc4cccc(Cl)c4C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P03	compound treatment	0.784	-0.00976	-0.13	0.714	5.05E-4	0.01	-0.0882	-0.6692	1965958	Cerep_000621	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P04	compound treatment	0.78	-0.0138	-0.19	0.691	-0.0225	-0.31	-0.3481	-0.971	1965959	Cerep_000622	Oc1ccccc1C(=O)NNC(=O)OCCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P05	compound treatment	0.798	0.00424	0.06	0.712	-0.0015	-0.02	0.0261	0.4289	1965960	Cerep_000623	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NC3CCCCCC3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P06	compound treatment	0.769	-0.0248	-0.33	0.704	-0.0095	-0.13	-0.3277	-0.9149	1965961	Cerep_000624	O=C(NCCOc1ccccc1)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P07	compound treatment	0.775	-0.0188	-0.25	0.686	-0.0275	-0.37	-0.444	-0.9817	1965962	Cerep_000625	CCCc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P08	compound treatment	0.758	-0.0358	-0.48	0.687	-0.0265	-0.36	-0.5966	-0.9899	1965963	Cerep_000626	COc1ccccc1CCOC(=O)NNC(=O)Cn2cnc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P09	compound treatment	0.698	-0.0958	-1.29	0.65	-0.0635	-0.87	-1.5257	-0.9811	1965964	Cerep_000627	CCCc1ccc(cc1)S(=O)(=O)N2CCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P10	compound treatment	0.25	-0.544	-7.34	0.125	-0.588	-8.02	-10.8616	-0.999	1965965	Cerep_000628	Cc1nn(c(C)c1CN2CCCCC2COC(=O)NCc3csc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P11	compound treatment	0.759	-0.0348	-0.47	0.711	-0.0025	-0.03	-0.3556	-0.7564	1965966	Cerep_000629	Cc1cc(C)c(C)c(c1C)S(=O)(=O)NC2COC(C)(C)OC2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P12	compound treatment	0.754	-0.0398	-0.54	0.693	-0.0205	-0.28	-0.5769	-0.9538	1965967	Cerep_000630	CCOc1ccsc1C(=O)NNC(=O)OCC2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P13	compound treatment	0.803	0.00924	0.12	0.723	0.0095	0.13	0.1798	0.9998	1965968	Cerep_000631	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P14	compound treatment	0.782	-0.0118	-0.16	0.712	-0.0015	-0.02	-0.1266	-0.7915	1965969	Cerep_000632	Clc1ccc(cc1)c2csc(COC(=O)NCc3ccc4OCCc4c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P15	compound treatment	0.795	0.00124	0.02	0.712	-0.0015	-0.02	-0.0025	-0.0964	1965970	Cerep_000633	COc1ccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P16	compound treatment	0.778	-0.0158	-0.21	0.709	-0.0045	-0.06	-0.1936	-0.8754	1965971	Cerep_000634	CC(COC(=O)N1CCN(CC1)c2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P17	compound treatment	0.783	-0.0108	-0.15	0.709	-0.0045	-0.06	-0.1459	-0.9265	1965972	Cerep_000635	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P18	compound treatment	0.757	-0.0368	-0.5	0.663	-0.0505	-0.69	-0.8375	-0.987	1965973	Cerep_000636	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCc4ccsc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P19	compound treatment	0.774	-0.0198	-0.27	0.726	0.0125	0.17	-0.0679	-0.2145	1965974	Cerep_000637	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P20	compound treatment	0.758	-0.0358	-0.48	0.671	-0.0425	-0.58	-0.7508	-0.9958	1965975	Cerep_000638	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5cc(C)cc(C)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P21	compound treatment	0.776	-0.0178	-0.24	0.715	0.0015	0.02	-0.1549	-0.6442	1965976	Cerep_000639	Cc1cc(C)c(C)c(c1C)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.527	P22	compound treatment	0.752	-0.0418	-0.56	0.724	0.0105	0.14	-0.297	-0.511	1965977	Cerep_000640	COc1ccccc1CCOC(=O)NNC(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A03	compound treatment	0.83	0.0409	0.55	0.72	0.012	0.16	0.5063	0.879	1965978	Cerep_000641	CC(NC(=O)OCCc1ccccc1C)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A04	compound treatment	0.84	0.0509	0.69	0.711	0.00302	0.04	0.5149	0.7481	1965979	Cerep_000642	COc1cccc(CCOC(=O)Nc2cc(ccc2O)C(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A05	compound treatment	0.799	0.00993	0.13	0.694	-0.014	-0.19	-0.0401	-0.1721	1965980	Cerep_000643	CC(C)(C)Sc1ccccc1CN2CCCCC2COC(=O)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A06	compound treatment	0.841	0.0519	0.7	0.692	-0.016	-0.22	0.3413	0.4651	1965981	Cerep_000644	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCCc3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A07	compound treatment	0.834	0.0449	0.61	0.702	-0.00598	-0.08	0.3709	0.6064	1965982	Cerep_000645	CCOc1ccccc1N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A08	compound treatment	0.815	0.0259	0.35	0.713	0.00502	0.07	0.2957	0.8296	1965983	Cerep_000646	Clc1ccc(Oc2cccc(COC(=O)N3CCCC3C(=O)OCc4ccccc4)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A09	compound treatment	0.791	0.00193	0.03	0.696	-0.012	-0.16	-0.0971	-0.587	1965984	Cerep_000647	CCN(CCOC(=O)NCCc1c[nH]c2ccccc12)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A10	compound treatment	0.802	0.0129	0.17	0.688	-0.02	-0.27	-0.0693	-0.2143	1965985	Cerep_000648	CCOC(=O)c1cncc(C#CCOC(=O)N2CCC(O)(Cc3ccccc3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A11	compound treatment	0.81	0.0209	0.28	0.694	-0.014	-0.19	0.0648	0.1903	1965986	Cerep_000649	Fc1ccccc1N2CCN(CC2)C(=O)OCC3(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A12	compound treatment	0.818	0.0289	0.39	0.726	0.018	0.25	0.4497	0.9751	1965987	Cerep_000650	Cc1nnsc1C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A13	compound treatment	0.776	-0.0131	-0.18	0.702	-0.00598	-0.08	-0.1824	-0.9387	1965988	Cerep_000651	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A14	compound treatment	0.783	-0.00607	-0.08	0.698	-0.00998	-0.14	-0.1542	-0.9704	1965989	Cerep_000652	Cn1cccc1C(=O)NNC(=O)OCc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A15	compound treatment	0.807	0.0179	0.24	0.723	0.015	0.2	0.3158	0.9966	1965990	Cerep_000653	[O-][N+](=O)c1ccc(CCOC(=O)NNC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A16	compound treatment	0.801	0.0119	0.16	0.699	-0.00898	-0.12	0.0272	0.1344	1965991	Cerep_000654	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC3(C)COC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A17	compound treatment	0.802	0.0129	0.17	0.704	-0.00398	-0.05	0.0849	0.4649	1965992	Cerep_000655	Cc1nn(c(C)c1CN2CCC(C2)NC(=O)OCCc3ccc(C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A18	compound treatment	0.787	-0.00207	-0.03	0.712	0.00402	0.05	0.019	0.3089	1965993	Cerep_000656	COc1cccc(CN2CCCC(COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)C2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A19	compound treatment	0.813	0.0239	0.32	0.715	0.00702	0.1	0.2959	0.8789	1965994	Cerep_000657	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCC3CCCN(Cc4cc5ccccc5o4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A20	compound treatment	0.795	0.00593	0.08	0.698	-0.00998	-0.14	-0.0397	-0.2514	1965995	Cerep_000658	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCCc3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A21	compound treatment	0.805	0.0159	0.21	0.732	0.024	0.33	0.3835	0.9791	1965996	Cerep_000659	O=C(NCCc1c[nH]c2ccccc12)OCc3ccccc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	A22	compound treatment	0.789	-6.9E-5	0.0	0.735	0.027	0.37	0.2598	0.7053	1965997	Cerep_000660	Cc1csc(C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl)c1n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B03	compound treatment	0.816	0.0269	0.36	0.716	0.00802	0.11	0.3342	0.8808	1965998	Cerep_000661	O=C(NCCNc1ccccc1)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B04	compound treatment	0.764	-0.0251	-0.34	0.688	-0.02	-0.27	-0.4318	-0.9943	1965999	Cerep_000662	Cn1c(cc2ccccc12)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B05	compound treatment	0.809	0.0199	0.27	0.721	0.013	0.18	0.3156	0.9797	1966000	Cerep_000663	Cc1ccccc1CCOC(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B06	compound treatment	0.78	-0.00907	-0.12	0.683	-0.025	-0.34	-0.3274	-0.9045	1966001	Cerep_000664	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B07	compound treatment	0.808	0.0189	0.26	0.703	-0.00498	-0.07	0.1325	0.5015	1966002	Cerep_000665	Fc1ccc(cc1)C(CCCN2CCN(CC2)C(=O)OCc3ccccc3c4ccccc4)c5ccc(F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B08	compound treatment	0.762	-0.0271	-0.37	0.681	-0.027	-0.37	-0.5184	-1.0	1966003	Cerep_000666	Cc1ccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)c(Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B09	compound treatment	0.809	0.0199	0.27	0.715	0.00702	0.1	0.2578	0.9032	1966004	Cerep_000667	FC(F)(F)Oc1ccccc1COC(=O)NNC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B10	compound treatment	0.82	0.0309	0.42	0.683	-0.025	-0.34	0.0542	0.1005	1639467	Cerep_000668	COc1ccc(CNC(=O)c2cc(nc3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B11	compound treatment	0.773	-0.0161	-0.22	0.732	0.024	0.33	0.0783	0.1993	1966005	Cerep_000669	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccccc3NC(=O)c4ccccc4Cl)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B12	compound treatment	0.773	-0.0161	-0.22	0.703	-0.00498	-0.07	-0.2013	-0.8863	1966006	Cerep_000670	Clc1ccc(CN2CCCN(CC2)C(=O)CNC(=O)c3cccnc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B13	compound treatment	0.775	-0.0141	-0.19	0.703	-0.00498	-0.07	-0.1823	-0.9041	1966007	Cerep_000671	COc1cccc(COC(=O)N2CCN(Cc3ccc(OC)c(OCc4ccccc4)c3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B14	compound treatment	0.769	-0.0201	-0.27	0.656	-0.052	-0.71	-0.6927	-0.9129	1966008	Cerep_000672	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B15	compound treatment	0.762	-0.0271	-0.37	0.729	0.021	0.29	-0.0556	-0.1197	1966009	Cerep_000673	Fc1ccc(/C=C/C(=O)NNC(=O)OCCCC2CCCCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B16	compound treatment	0.793	0.00393	0.05	0.701	-0.00698	-0.1	-0.0298	-0.2738	1966010	Cerep_000674	CC(OCc1ccccc1)C(NC(=O)c2ccc(cc2)N3N=C(C)CC3=O)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B17	compound treatment	0.804	0.0149	0.2	0.709	0.00102	0.01	0.1522	0.7539	1966011	Cerep_000675	CC(CCOC(=O)NNC(=O)c1cc(Cl)ccc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B18	compound treatment	0.767	-0.0221	-0.3	0.659	-0.049	-0.67	-0.6829	-0.9337	1966012	Cerep_000676	COc1cccc(CN(Cc2ccco2)C(=O)Cc3nc(sc3C)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B19	compound treatment	0.793	0.00393	0.05	0.709	0.00102	0.01	0.0473	0.8628	1966013	Cerep_000677	Brc1cncc(c1)C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B20	compound treatment	0.77	-0.0191	-0.26	0.685	-0.023	-0.31	-0.4035	-0.9952	1966014	Cerep_000678	Brc1ccc(cc1)C(CC(=O)C2CC2)CC(=O)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B21	compound treatment	0.77	-0.0191	-0.26	0.705	-0.00298	-0.04	-0.2107	-0.8089	1966015	Cerep_000679	CN(C)CCCCCCOC(=O)Nc1cc(ccc1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	B22	compound treatment	0.746	-0.0431	-0.58	0.663	-0.045	-0.61	-0.8446	-0.9996	1966016	Cerep_000680	CC(OCc1ccccc1)C(NC(=O)c2ccc(cc2)N3N=C(C)CC3=O)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C03	compound treatment	0.784	-0.00507	-0.07	0.717	0.00902	0.12	0.0386	0.2742	1966017	Cerep_000681	CC(NC(=O)OCCCc1ccncc1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C04	compound treatment	0.815	0.0259	0.35	0.712	0.00402	0.05	0.2861	0.808	1966018	Cerep_000682	Cc1cccc(CCOC(=O)NCCOc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C05	compound treatment	0.826	0.0369	0.5	0.732	0.024	0.33	0.5839	0.9793	1966019	Cerep_000683	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccc(Cl)cc3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C06	compound treatment	0.807	0.0179	0.24	0.727	0.019	0.26	0.3544	0.9994	1966020	Cerep_000684	CC(C)(C)OC(=O)N(CCOC(=O)N1CCCC1C(=O)OCc2ccccc2)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C07	compound treatment	0.801	0.0119	0.16	0.712	0.00402	0.05	0.1525	0.8972	1966021	Cerep_000685	COC(=O)C1CC(CN1C(=O)OCc2ccc(cc2)c3ccccc3)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C08	compound treatment	0.81	0.0209	0.28	0.728	0.02	0.27	0.3927	0.9999	1966022	Cerep_000686	COc1ccccc1COC(=O)N2CCN(CC2)c3cc(nc4cc(nn34)C(C)(C)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C09	compound treatment	0.804	0.0149	0.2	0.722	0.014	0.19	0.2776	0.9997	1966023	Cerep_000687	[O-][N+](=O)c1ccc(CCOC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C10	compound treatment	0.796	0.00693	0.09	0.72	0.012	0.16	0.182	0.9646	1966024	Cerep_000688	O=C(NCCc1c[nH]c2ccccc12)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C11	compound treatment	0.794	0.00493	0.07	0.712	0.00402	0.05	0.0858	0.9953	1966025	Cerep_000689	COc1ccc2[nH]cc(CCNC(=O)OC/C=C(/C)\Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C12	compound treatment	0.81	0.0209	0.28	0.707	-9.84E-4	-0.01	0.1902	0.6727	1966026	Cerep_000690	Oc1ccccc1C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C13	compound treatment	0.765	-0.0241	-0.32	0.725	0.017	0.23	-0.0655	-0.1642	1966027	Cerep_000691	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C14	compound treatment	0.776	-0.0131	-0.18	0.699	-0.00898	-0.12	-0.2113	-0.9842	1966028	Cerep_000692	OC1CCN(C1)C(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C15	compound treatment	0.778	-0.0111	-0.15	0.703	-0.00498	-0.07	-0.1537	-0.9365	1966029	Cerep_000693	CC(COC(=O)NNC(=O)c1sc(nc1C)c2ccc(cc2)C(F)(F)F)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C16	compound treatment	0.786	-0.00307	-0.04	0.722	0.014	0.19	0.1059	0.5414	1966030	Cerep_000694	Clc1ccc(cc1)C(N2CCN(CCOCCOC(=O)NNC(=O)CNS(=O)(=O)c3cccc4nsnc34)CC2)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C17	compound treatment	0.794	0.00493	0.07	0.718	0.01	0.14	0.1436	0.9453	1966031	Cerep_000695	CC(CCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C18	compound treatment	0.801	0.0119	0.16	0.722	0.014	0.19	0.249	0.9963	1966032	Cerep_000696	Cc1ccc(N2CCN(CC2)C(=O)OCCc3c(C)cc(C)cc3C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C19	compound treatment	0.814	0.0249	0.34	0.675	-0.033	-0.45	-0.0802	-0.1428	1966033	Cerep_000697	FC(F)(F)Sc1ccccc1COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C20	compound treatment	0.785	-0.00407	-0.05	0.717	0.00902	0.12	0.0481	0.3574	1966034	Cerep_000698	Clc1ccc(CCOC(=O)N2CCN(CC2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C21	compound treatment	0.781	-0.00807	-0.11	0.738	0.03	0.41	0.2125	0.5016	1966035	Cerep_000699	CCN(CCOC(=O)NC1CCN(CC1)c2ccccc2)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	C22	compound treatment	0.763	-0.0261	-0.35	0.713	0.00502	0.07	-0.2003	-0.5591	1966036	Cerep_000700	Fc1cccc(Cl)c1CCOC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D03	compound treatment	0.797	0.00793	0.11	0.716	0.00802	0.11	0.1529	0.9999	1966037	Cerep_000701	CC(=O)NCCNC(=O)OCc1ccc(cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D04	compound treatment	0.787	-0.00207	-0.03	0.684	-0.024	-0.33	-0.251	-0.7647	1966038	Cerep_000702	O=C(CCc1c[nH]c2ccccc12)NCCc3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D05	compound treatment	0.786	-0.00307	-0.04	0.719	0.011	0.15	0.0769	0.4938	1966039	Cerep_000703	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCCc3ccccn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D06	compound treatment	0.772	-0.0171	-0.23	0.703	-0.00498	-0.07	-0.2109	-0.8784	1966040	Cerep_000704	O=C(N1CCc2c(C1)[nH]c3ccccc23)c4ccsc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D07	compound treatment	0.808	0.0189	0.26	0.717	0.00902	0.12	0.2675	0.9438	1966041	Cerep_000705	[O-][N+](=O)c1cc2OCOc2cc1COC(=O)NNC(=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D08	compound treatment	0.787	-0.00207	-0.03	0.694	-0.014	-0.19	-0.1546	-0.8021	1966042	Cerep_000706	CCc1ccc(cc1)c2ccc(cc2)C(=O)NCc3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D09	compound treatment	0.796	0.00693	0.09	0.697	-0.011	-0.15	-0.0398	-0.2254	1966043	Cerep_000707	FC(F)(F)c1cc(Cl)cnc1N2CCN(CCOC(=O)NNC(=O)c3ccc(cc3)c4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D10	compound treatment	0.788	-0.00107	-0.01	0.698	-0.00998	-0.14	-0.1065	-0.7777	1966044	Cerep_000708	Cn1c(cc2ccccc12)C(=O)NCCCn3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D11	compound treatment	0.8	0.0109	0.15	0.695	-0.013	-0.18	-0.0209	-0.0908	1966045	Cerep_000709	CN(C)c1ccc(CN2CCN(CCOC(=O)N3CCCC3C(=O)OCc4ccccc4)CC2)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D12	compound treatment	0.793	0.00393	0.05	0.663	-0.045	-0.61	-0.3963	-0.6436	1966046	Cerep_000710	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)C(NC(=O)Cc3c[nH]c4ccccc34)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D13	compound treatment	0.808	0.0189	0.26	0.71	0.00202	0.03	0.2	0.7787	1966047	Cerep_000711	CCOc1ccc(COC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D14	compound treatment	0.756	-0.0331	-0.45	0.68	-0.028	-0.38	-0.5853	-0.997	1966048	Cerep_000712	COc1cc(CN2CCC(C2)NC(=O)Cc3nc(oc3C)c4ccccc4)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D15	compound treatment	0.792	0.00293	0.04	0.713	0.00502	0.07	0.0763	0.9661	1966049	Cerep_000713	CC(C)(C)c1ccc(O)c(NC(=O)OCCc2ccccc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D16	compound treatment	0.792	0.00293	0.04	0.694	-0.014	-0.19	-0.1069	-0.5488	1966050	Cerep_000714	COc1ccccc1C(=O)NNC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D17	compound treatment	0.8	0.0109	0.15	0.729	0.021	0.29	0.3069	0.9523	1966051	Cerep_000715	O=C(NCCCC(NC(=O)OCCCc1ccccc1)C(=O)OCc2ccccc2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D18	compound treatment	0.773	-0.0161	-0.22	0.683	-0.025	-0.34	-0.3942	-0.9762	1966052	Cerep_000716	O=C(CNC(=O)c1cccnc1)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D19	compound treatment	0.776	-0.0131	-0.18	0.704	-0.00398	-0.05	-0.1631	-0.884	1966053	Cerep_000717	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D20	compound treatment	0.756	-0.0331	-0.45	0.698	-0.00998	-0.14	-0.4117	-0.8827	1966054	Cerep_000718	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCN(CC3)C(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D21	compound treatment	0.784	-0.00507	-0.07	0.738	0.03	0.41	0.2411	0.5809	1966055	Cerep_000719	CCC/C=C/COC(=O)N1CCc2c(C1)[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	D22	compound treatment	0.752	-0.0371	-0.5	0.687	-0.021	-0.29	-0.556	-0.9649	1966056	Cerep_000720	COc1ccccc1C(=O)NNC(=O)c2cccn2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E03	compound treatment	0.814	0.0249	0.34	0.711	0.00302	0.04	0.2669	0.7877	1966057	Cerep_000721	Cc1ccc(N2CCN(CC2)C(=O)OCC3(CC3)c4ccc(Cl)cc4)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E04	compound treatment	0.802	0.0129	0.17	0.704	-0.00398	-0.05	0.0849	0.4649	1966058	Cerep_000722	COc1ccc(OCCNC(=O)OCCc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E05	compound treatment	0.798	0.00893	0.12	0.719	0.011	0.15	0.1914	0.994	1966059	Cerep_000723	Cc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)CC2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E06	compound treatment	0.802	0.0129	0.17	0.701	-0.00698	-0.1	0.056	0.2818	1966060	Cerep_000724	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCCC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E07	compound treatment	0.796	0.00693	0.09	0.708	1.57E-5	0.0	0.0663	0.7087	1966061	Cerep_000725	CCOc1cccc(c1)C(=O)NNC(=O)OCC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E08	compound treatment	0.827	0.0379	0.51	0.716	0.00802	0.11	0.4391	0.8392	1966062	Cerep_000726	COc1cccc(COC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E09	compound treatment	0.81	0.0209	0.28	0.725	0.017	0.23	0.3637	0.9952	1966063	Cerep_000727	COc1ccc2c(CCNC(=O)OCCc3c(C)cc(C)cc3C)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E10	compound treatment	0.785	-0.00407	-0.05	0.724	0.016	0.22	0.1156	0.5134	1966064	Cerep_000728	O=C(CNS(=O)(=O)c1cccc2nsnc12)NNC(=O)OCCN(CCC#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E11	compound treatment	0.773	-0.0161	-0.22	0.705	-0.00298	-0.04	-0.1821	-0.8254	1966065	Cerep_000729	Cc1nc(cs1)C(=O)NNC(=O)OCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E12	compound treatment	0.789	-6.9E-5	0.0	0.711	0.00302	0.04	0.0284	0.6909	1966066	Cerep_000730	CC(COC(=O)NNC(=O)c1ccccc1NC(=O)c2ccccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E13	compound treatment	0.797	0.00793	0.11	0.666	-0.042	-0.57	-0.3292	-0.5652	1966067	Cerep_000731	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E14	compound treatment	0.771	-0.0181	-0.24	0.727	0.019	0.26	0.011	0.0309	1966068	Cerep_000732	Cc1cccc(c1)N2CCN(CC2)C(=O)OCCc3c(C)cc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E15	compound treatment	0.782	-0.00707	-0.1	0.712	0.00402	0.05	-0.0287	-0.2611	1966069	Cerep_000733	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCC3COC4(CCCCC4)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E16	compound treatment	0.779	-0.0101	-0.14	0.696	-0.012	-0.16	-0.2116	-0.9958	1966070	Cerep_000734	CC1(C)COC(CCOC(=O)NNC(=O)CNS(=O)(=O)c2cccc3nsnc23)OC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E17	compound treatment	0.785	-0.00407	-0.05	0.73	0.022	0.3	0.1735	0.5684	1966071	Cerep_000735	Cc1ccccc1N2CCN(CC2)C(=O)OCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E18	compound treatment	0.793	0.00393	0.05	0.736	0.028	0.38	0.3076	0.7976	1966072	Cerep_000736	CCCCC#CCCOC(=O)NC(C)C(=O)OCc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E19	compound treatment	0.786	-0.00307	-0.04	0.719	0.011	0.15	0.0769	0.4938	1966073	Cerep_000737	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCCOc5ccc(cn5)[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E20	compound treatment	0.786	-0.00307	-0.04	0.72	0.012	0.16	0.0866	0.5123	1966074	Cerep_000738	CC(CCOC(=O)N1CCC(CC1)N2CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E21	compound treatment	0.784	-0.00507	-0.07	0.711	0.00302	0.04	-0.0193	-0.2416	1966075	Cerep_000739	Cc1nc(sc1C(=O)NNC(=O)OCCc2ccc(cc2)[N+](=O)[O-])c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	E22	compound treatment	0.798	0.00893	0.12	0.72	0.012	0.16	0.2011	0.9886	1966076	Cerep_000740	CCOc1ccsc1C(=O)NNC(=O)OCCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F03	compound treatment	0.801	0.0119	0.16	0.721	0.013	0.18	0.2393	0.9988	1966077	Cerep_000741	Cc1cc(C)c(CCOC(=O)NNC(=O)c2cccc(C)c2O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F04	compound treatment	0.762	-0.0271	-0.37	0.679	-0.029	-0.4	-0.5377	-0.9992	1966078	Cerep_000742	CC(NC(=O)OCCc1ccc(Cl)cc1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F05	compound treatment	0.787	-0.00207	-0.03	0.71	0.00202	0.03	-3.0E-4	-0.0077	1966079	Cerep_000743	CC(C)(C)c1cc([nH]n1)C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F06	compound treatment	0.782	-0.00707	-0.1	0.703	-0.00498	-0.07	-0.1155	-0.9862	1966080	Cerep_000744	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F07	compound treatment	0.787	-0.00207	-0.03	0.713	0.00502	0.07	0.0286	0.3875	1966081	Cerep_000745	CCN(CCOC(=O)NNC(=O)c1ccc(Cn2cnc(Cl)c2Cl)o1)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F08	compound treatment	0.769	-0.0201	-0.27	0.679	-0.029	-0.4	-0.4709	-0.983	1966082	Cerep_000746	CCC(C)C(=O)NC1CCN(Cc2c(C)nn(c2C)c3ccccc3)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F09	compound treatment	0.791	0.00193	0.03	0.71	0.00202	0.03	0.0379	0.9996	1966083	Cerep_000747	O=C(NC1CCN(Cc2ccccc2)C1)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F10	compound treatment	0.796	0.00693	0.09	0.68	-0.028	-0.38	-0.2037	-0.5185	1966084	Cerep_000748	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3nccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F11	compound treatment	0.799	0.00993	0.13	0.698	-0.00998	-0.14	-0.0015	-0.008	1966085	Cerep_000749	Clc1cc2OCOc2cc1CN3CCCC(COC(=O)NCc4ccc5OCCc5c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F12	compound treatment	0.778	-0.0111	-0.15	0.67	-0.038	-0.52	-0.4719	-0.8753	1966086	Cerep_000750	CCCCCCc1ccc(cc1)C(=O)NC2CCN(Cc3cccc(OC)c3[N+](=O)[O-])C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F13	compound treatment	0.801	0.0119	0.16	0.698	-0.00998	-0.14	0.0175	0.0832	1966087	Cerep_000751	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(C)c4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F14	compound treatment	0.757	-0.0321	-0.43	0.698	-0.00998	-0.14	-0.4022	-0.8868	1966088	Cerep_000752	COc1cccc(CN2CCC(C2)NC(=O)c3ccc(C)nc3Cl)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F15	compound treatment	0.801	0.0119	0.16	0.763	0.055	0.75	0.6443	0.8397	1966089	Cerep_000753	COc1ccc(OCCNC(=O)OCCc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F16	compound treatment	0.793	0.00393	0.05	0.704	-0.00398	-0.05	-9.0E-4	-0.0121	1966090	Cerep_000754	FC(F)(F)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(nc3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F17	compound treatment	0.764	-0.0251	-0.34	0.708	1.57E-5	0.0	-0.239	-0.7067	1966091	Cerep_000755	COc1ccc(CCCOC(=O)NNC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F18	compound treatment	0.769	-0.0201	-0.27	0.71	0.00202	0.03	-0.172	-0.6321	1966092	Cerep_000756	COc1cccc(CC(=O)N2CCC(CC2)C(O)(c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F19	compound treatment	0.803	0.0139	0.19	0.702	-0.00598	-0.08	0.0752	0.367	1966093	Cerep_000757	Cc1ccccc1CCOC(=O)NNC(=O)c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F20	compound treatment	0.757	-0.0321	-0.43	0.665	-0.043	-0.59	-0.7204	-0.9888	1966094	Cerep_000758	CC(C)CC(NC(=O)Cc1nc(oc1C)c2ccccc2)C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F21	compound treatment	0.772	-0.0171	-0.23	0.739	0.031	0.42	0.1362	0.2829	1966095	Cerep_000759	CC1CN(CCN1c2ccc(C)cc2)C(=O)OCc3cc4OCOc4cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	F22	compound treatment	0.761	-0.0281	-0.38	0.696	-0.012	-0.16	-0.3833	-0.9294	1966096	Cerep_000760	CCOC(=O)NNC(=O)c1cc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G03	compound treatment	0.796	0.00693	0.09	0.708	1.57E-5	0.0	0.0663	0.7087	1966097	Cerep_000761	CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)OCc3ccc(C#CC(C)(C)O)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G04	compound treatment	0.81	0.0209	0.28	0.723	0.015	0.2	0.3445	0.9875	1966098	Cerep_000762	CN(CCc1ccccn1)C(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G05	compound treatment	0.798	0.00893	0.12	0.698	-0.00998	-0.14	-0.0111	-0.0609	1966099	Cerep_000763	CN(C)CC(C)(C)CNC(=O)OCCN1CCN(Cc2cc3ccccc3o2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G06	compound treatment	0.79	9.31E-4	0.01	0.715	0.00702	0.1	0.0765	0.7931	1966100	Cerep_000764	Cc1nn(c(C)c1CN2CCC(C2)NC(=O)OCCc3ccccc3F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G07	compound treatment	0.784	-0.00507	-0.07	0.725	0.017	0.23	0.1157	0.4784	1966101	Cerep_000765	CSc1nnc(SC)n1CCNC(=O)OCCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G08	compound treatment	0.802	0.0129	0.17	0.695	-0.013	-0.18	-0.0018	-0.0074	1966102	Cerep_000766	Cc1cc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G09	compound treatment	0.79	9.31E-4	0.01	0.718	0.01	0.14	0.1055	0.7689	1966103	Cerep_000767	CCCC#CCCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G10	compound treatment	0.773	-0.0161	-0.22	0.71	0.00202	0.03	-0.1339	-0.6125	1966104	Cerep_000768	Cc1ccc2[nH]cc(CCNC(=O)OCC3CCCCN3Cc4ccccc4F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G11	compound treatment	0.79	9.31E-4	0.01	0.724	0.016	0.22	0.1633	0.7465	1966105	Cerep_000769	Oc1ccc2[nH]cc(CCNC(=O)OCc3cccc(Br)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G12	compound treatment	0.784	-0.00507	-0.07	0.696	-0.012	-0.16	-0.1639	-0.9253	1966106	Cerep_000770	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G13	compound treatment	0.791	0.00193	0.03	0.715	0.00702	0.1	0.0861	0.868	1966107	Cerep_000771	Oc1ccc2[nH]cc(CCNC(=O)OCc3cccc(F)c3F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G14	compound treatment	0.796	0.00693	0.09	0.705	-0.00298	-0.04	0.0373	0.3662	1966108	Cerep_000772	CCCCC#CCCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G15	compound treatment	0.792	0.00293	0.04	0.706	-0.00198	-0.03	0.0088	0.1842	1966109	Cerep_000773	O=C(NNC(=O)c1ccc2nsnc2c1)OCC(Cc3ccccc3)N(Cc4ccccc4)Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G16	compound treatment	0.769	-0.0201	-0.27	0.703	-0.00498	-0.07	-0.2395	-0.858	1966110	Cerep_000774	CCOc1ccc(Br)cc1NC2CCCCC2COC(=O)N3CCN(CC3)c4cc(OC)cc(OC)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G17	compound treatment	0.822	0.0329	0.44	0.743	0.035	0.48	0.6518	0.9994	1966111	Cerep_000775	COc1ccc(CCCOC(=O)Nc2cc(ccc2O)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G18	compound treatment	0.794	0.00493	0.07	0.682	-0.026	-0.35	-0.2035	-0.5645	1966112	Cerep_000776	Cc1nnsc1C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G19	compound treatment	0.815	0.0259	0.35	0.698	-0.00998	-0.14	0.1511	0.4025	1966113	Cerep_000777	CC(C)(C)OC(=O)N(CCOC(=O)N1CCCC1C(=O)OCc2ccccc2)C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G20	compound treatment	0.777	-0.0121	-0.16	0.698	-0.00998	-0.14	-0.2114	-0.996	1966114	Cerep_000778	CC(=CC1C(CNC(=O)OCCCc2ccccc2)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G21	compound treatment	0.803	0.0139	0.19	0.726	0.018	0.25	0.3066	0.9913	1966115	Cerep_000779	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCN3CCN(CCCN4c5ccccc5Sc6ccc(Cl)cc46)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	G22	compound treatment	0.783	-0.00607	-0.08	0.715	0.00702	0.1	0.0098	0.0775	1966116	Cerep_000780	O=C(OCCc1c[nH]c2ccccc12)N3CCN(CC3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H03	compound treatment	0.805	0.0159	0.21	0.709	0.00102	0.01	0.1618	0.7511	1966117	Cerep_000781	CCCCC#CCCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H04	compound treatment	0.761	-0.0281	-0.38	0.697	-0.011	-0.15	-0.3737	-0.9176	1966118	Cerep_000782	COc1cc(cc(OC)c1OC)C(=O)NNC(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H05	compound treatment	0.812	0.0229	0.31	0.712	0.00402	0.05	0.2575	0.8195	1966119	Cerep_000783	Oc1cccc(c1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H06	compound treatment	0.779	-0.0101	-0.14	0.699	-0.00898	-0.12	-0.1827	-0.9987	1966120	Cerep_000784	CC/1=C(CC(=O)N2CCC(CC2)C(=O)N)c3cc(F)ccc3\C1=C/c4ccc(cc4)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H07	compound treatment	0.808	0.0189	0.26	0.73	0.022	0.3	0.3929	0.9968	1966121	Cerep_000785	CCCCCCOCCOCCOC(=O)NNC(=O)c1noc(C)c1c2csc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H08	compound treatment	0.785	-0.00407	-0.05	0.688	-0.02	-0.27	-0.2315	-0.8328	1966122	Cerep_000786	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H09	compound treatment	0.799	0.00993	0.13	0.706	-0.00198	-0.03	0.0756	0.5531	1966123	Cerep_000787	CCOc1ccsc1C(=O)NNC(=O)OCCN(C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H10	compound treatment	0.778	-0.0111	-0.15	0.729	0.021	0.29	0.0971	0.3003	1966124	Cerep_000788	OCCCCN(Cc1ccccc1)C(=O)CCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H11	compound treatment	0.793	0.00393	0.05	0.726	0.018	0.25	0.2112	0.8404	1966125	Cerep_000789	Clc1c(sc2ccccc12)C(=O)NCCSCCOC(=O)N3CCC(CC3)C(=O)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H12	compound treatment	0.77	-0.0191	-0.26	0.659	-0.049	-0.67	-0.6542	-0.914	1966126	Cerep_000790	O=C(NNC(=O)c1ccccc1n2cccc2)c3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H13	compound treatment	0.794	0.00493	0.07	0.722	0.014	0.19	0.1822	0.9003	1966127	Cerep_000791	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cc4OCOc4cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H14	compound treatment	0.782	-0.00707	-0.1	0.708	1.57E-5	0.0	-0.0673	-0.7055	1966128	Cerep_000792	CCc1ccc(cc1)c2ccc(cc2)C(=O)NCc3csc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H15	compound treatment	0.783	-0.00607	-0.08	0.684	-0.024	-0.33	-0.2892	-0.8577	1966129	Cerep_000793	COc1ccccc1CCOC(=O)N(C)CCCN2c3ccccc3CCc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H16	compound treatment	0.761	-0.0281	-0.38	0.696	-0.012	-0.16	-0.3833	-0.9294	1966130	Cerep_000794	Cn1c(cc2ccccc12)C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H17	compound treatment	0.792	0.00293	0.04	0.74	0.032	0.44	0.3367	0.768	1966131	Cerep_000795	CCCCCC#CCCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H18	compound treatment	0.746	-0.0431	-0.58	0.7	-0.00798	-0.11	-0.4878	-0.8252	1966132	Cerep_000796	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H19	compound treatment	0.791	0.00193	0.03	0.729	0.021	0.29	0.2211	0.7682	1966133	Cerep_000797	NS(=O)(=O)c1ccc(CNC(=O)OCCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H20	compound treatment	0.794	0.00493	0.07	0.692	-0.016	-0.22	-0.1071	-0.4699	1966134	Cerep_000798	CSc1sc(C(=O)NNC(=O)c2ccc(C)nc2Cl)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H21	compound treatment	0.787	-0.00207	-0.03	0.707	-9.84E-4	-0.01	-0.0292	-0.9437	1966135	Cerep_000799	CCN(CCOC(=O)N1CCN(CC1)c2ccc(cc2)C(=O)C)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	H22	compound treatment	0.771	-0.0181	-0.24	0.691	-0.017	-0.23	-0.3361	-0.9997	1966136	Cerep_000800	Cn1c(cc2ccccc12)C(=O)NC3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I03	compound treatment	0.819	0.0299	0.4	0.726	0.018	0.25	0.4592	0.9716	1966137	Cerep_000801	Clc1ccc(cc1)c2csc(COC(=O)N3CCN(CC3)c4ccccn4)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I04	compound treatment	0.761	-0.0281	-0.38	0.732	0.024	0.33	-0.0362	-0.0723	1966138	Cerep_000802	CCN(CC)Cc1cc(NC(=O)OCCC(C)c2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I05	compound treatment	0.775	-0.0141	-0.19	0.715	0.00702	0.1	-0.0666	-0.3132	1966139	Cerep_000803	CC(C)Oc1ccc(CN2CCCCC2COC(=O)NCc3csc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I06	compound treatment	0.791	0.00193	0.03	0.699	-0.00898	-0.12	-0.0682	-0.5446	1966140	Cerep_000804	COC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I07	compound treatment	0.773	-0.0161	-0.22	0.719	0.011	0.15	-0.0471	-0.1785	1966141	Cerep_000805	Fc1cccc(Cl)c1CCOC(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I08	compound treatment	0.806	0.0169	0.23	0.711	0.00302	0.04	0.1906	0.8212	1966142	Cerep_000806	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc(OC(F)(F)F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I09	compound treatment	0.788	-0.00107	-0.01	0.695	-0.013	-0.18	-0.1354	-0.7622	1966143	Cerep_000807	Cc1ccccc1C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I10	compound treatment	0.791	0.00193	0.03	0.715	0.00702	0.1	0.0861	0.868	1966144	Cerep_000808	Fc1cccc(F)c1C(=O)NCC(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I11	compound treatment	0.804	0.0149	0.2	0.702	-0.00598	-0.08	0.0847	0.3899	1966145	Cerep_000809	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I12	compound treatment	0.802	0.0129	0.17	0.705	-0.00298	-0.04	0.0946	0.528	1966146	Cerep_000810	O=C(OCCCc1ccccc1)N2CCC(CC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I13	compound treatment	0.796	0.00693	0.09	0.696	-0.012	-0.16	-0.0494	-0.2626	1966147	Cerep_000811	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccccc3SC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I14	compound treatment	0.807	0.0179	0.24	0.721	0.013	0.18	0.2966	0.9884	1966148	Cerep_000812	Fc1ccc(CCOC(=O)N2CCc3c(C2)[nH]c4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I15	compound treatment	0.771	-0.0181	-0.24	0.702	-0.00598	-0.08	-0.2301	-0.895	1966149	Cerep_000813	O=C(NNC(=O)c1ccc2nccnc2c1)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I16	compound treatment	0.757	-0.0321	-0.43	0.703	-0.00498	-0.07	-0.354	-0.8083	1966150	Cerep_000814	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(cc4)N5CCCC5)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I17	compound treatment	0.827	0.0379	0.51	0.716	0.00802	0.11	0.4391	0.8392	1966151	Cerep_000815	Cn1cccc1C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I18	compound treatment	0.81	0.0209	0.28	0.703	-0.00498	-0.07	0.1516	0.522	1966152	Cerep_000816	COc1ccc(CC(=O)NNC(=O)OCC(F)F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I19	compound treatment	0.797	0.00793	0.11	0.718	0.01	0.14	0.1722	0.9927	1966153	Cerep_000817	Cc1ccccc1N2CCN(CC2)C(=O)OCCC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I20	compound treatment	0.766	-0.0231	-0.31	0.711	0.00302	0.04	-0.191	-0.6084	1966154	Cerep_000818	NS(=O)(=O)c1ccc(CNC(=O)OCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I21	compound treatment	0.816	0.0269	0.36	0.707	-9.84E-4	-0.01	0.2474	0.6805	1966155	Cerep_000819	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC3COC4(CCCCC4)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	I22	compound treatment	0.795	0.00593	0.08	0.706	-0.00198	-0.03	0.0374	0.4433	1966156	Cerep_000820	CCN(CCOC(=O)NCc1ccncc1)c2ccc(N=Nc3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J03	compound treatment	0.8	0.0109	0.15	0.703	-0.00498	-0.07	0.0562	0.3462	1966157	Cerep_000821	CCOC(=O)N1CCN(CC1)C(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J04	compound treatment	0.786	-0.00307	-0.04	0.703	-0.00498	-0.07	-0.0773	-0.9717	1966158	Cerep_000822	NS(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)C2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J05	compound treatment	0.767	-0.0221	-0.3	0.729	0.021	0.29	-0.0079	-0.0191	1966159	Cerep_000823	CC(COC(=O)NNC(=O)CSCc1nc(cs1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J06	compound treatment	0.756	-0.0331	-0.45	0.709	0.00102	0.01	-0.3057	-0.6848	1224424	Cerep_000824	COc1cc(OC)cc(c1)C(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J07	compound treatment	0.795	0.00593	0.08	0.715	0.00702	0.1	0.1242	0.9961	1966160	Cerep_000825	CCOc1ccsc1C(=O)NNC(=O)OC/C=C(/C)\CCC=C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J08	compound treatment	0.778	-0.0111	-0.15	0.682	-0.026	-0.35	-0.3561	-0.9262	1966161	Cerep_000826	CC(=O)Nc1ccc(cc1)C(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J09	compound treatment	0.796	0.00693	0.09	0.724	0.016	0.22	0.2205	0.9283	1966162	Cerep_000827	Cc1ccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NNC(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J10	compound treatment	0.766	-0.0231	-0.31	0.706	-0.00198	-0.03	-0.2392	-0.7657	1966163	Cerep_000828	COc1ccc(CCNC(=O)c2ccc(cc2)n3cccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J11	compound treatment	0.809	0.0199	0.27	0.736	0.028	0.38	0.4603	0.9852	1966164	Cerep_000829	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J12	compound treatment	0.772	-0.0171	-0.23	0.697	-0.011	-0.15	-0.2687	-0.9783	1966165	Cerep_000830	CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J13	compound treatment	0.784	-0.00507	-0.07	0.719	0.011	0.15	0.0579	0.3506	1966166	Cerep_000831	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J14	compound treatment	0.772	-0.0171	-0.23	0.702	-0.00598	-0.08	-0.2205	-0.9027	1966167	Cerep_000832	Cc1nc(sc1C(=O)NNC(=O)c2csc(n2)c3cnccn3)c4cnccc4C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J15	compound treatment	0.796	0.00693	0.09	0.724	0.016	0.22	0.2205	0.9283	1966168	Cerep_000833	COc1ccc2[nH]cc(CCNC(=O)OCCc3cccc(Cl)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J16	compound treatment	0.756	-0.0331	-0.45	0.688	-0.02	-0.27	-0.5082	-0.972	1966169	Cerep_000834	OC1(Cc2ccccc2)CCN(CC1)C(=O)CCc3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J17	compound treatment	0.786	-0.00307	-0.04	0.684	-0.024	-0.33	-0.2605	-0.7903	1966170	Cerep_000835	CC(C)(C)c1ccc(COC(=O)N2CCC(O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J18	compound treatment	0.766	-0.0231	-0.31	0.671	-0.037	-0.5	-0.5767	-0.9731	1966171	Cerep_000836	O=C(NC1CCCC1OCc2ccccc2)c3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J19	compound treatment	0.815	0.0259	0.35	0.723	0.015	0.2	0.3922	0.9675	1966172	Cerep_000837	CSc1ncc(C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J20	compound treatment	0.802	0.0129	0.17	0.667	-0.041	-0.56	-0.2718	-0.4643	1966173	Cerep_000838	CCc1ccc(cc1)c2ccc(cc2)C(=O)N3CCN(CC3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J21	compound treatment	0.816	0.0269	0.36	0.727	0.019	0.26	0.4403	0.9863	1966174	Cerep_000839	CCCCCCOCCOCCOC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	J22	compound treatment	0.748	-0.0411	-0.55	0.702	-0.00598	-0.08	-0.4495	-0.8026	1966175	Cerep_000840	CCOC(=O)CC(=O)NNC(=O)CCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K03	compound treatment	0.816	0.0269	0.36	0.713	0.00502	0.07	0.3053	0.8257	1966176	Cerep_000841	O=C(OCCN(Cc1ccccc1)Cc2ccccc2)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K04	compound treatment	0.791	0.00193	0.03	0.721	0.013	0.18	0.1439	0.8023	1966177	Cerep_000842	O=C(NNC(=O)c1ccco1)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K05	compound treatment	0.775	-0.0141	-0.19	0.714	0.00602	0.08	-0.0762	-0.3685	1966178	Cerep_000843	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc5ccccc5c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K06	compound treatment	0.788	-0.00107	-0.01	0.697	-0.011	-0.15	-0.1161	-0.7716	1966179	Cerep_000844	COc1ccccc1CCOC(=O)NC(CSCc2ccccc2)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K07	compound treatment	0.77	-0.0191	-0.26	0.73	0.022	0.3	0.0304	0.0768	1966180	Cerep_000845	CCN(CCOC(=O)NNC(=O)c1noc(C)c1c2csc(C)n2)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K08	compound treatment	0.795	0.00593	0.08	0.73	0.022	0.3	0.2689	0.8654	1966181	Cerep_000846	CC12CCCC(=O)N2C(COC(=O)N3CCC(CC3)C(O)(c4ccccc4)c5ccccc5)C(O1)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K09	compound treatment	0.774	-0.0151	-0.2	0.737	0.029	0.4	0.136	0.3058	1966182	Cerep_000847	CCCCCCC#CCOC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K10	compound treatment	0.793	0.00393	0.05	0.736	0.028	0.38	0.3076	0.7976	1966183	Cerep_000848	COc1cc(CCNC(=O)OCC(F)F)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K11	compound treatment	0.786	-0.00307	-0.04	0.699	-0.00898	-0.12	-0.1159	-0.8963	1966184	Cerep_000849	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCC3CCCN(Cc4cc5ccccc5o4)C3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K12	compound treatment	0.788	-0.00107	-0.01	0.703	-0.00498	-0.07	-0.0583	-0.8385	1966185	Cerep_000850	COc1ccc(CCCOC(=O)N(C)CCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K13	compound treatment	0.806	0.0169	0.23	0.71	0.00202	0.03	0.1809	0.7865	1966186	Cerep_000851	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCCOc5ccc(cn5)[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K14	compound treatment	0.809	0.0199	0.27	0.714	0.00602	0.08	0.2481	0.8827	1966187	Cerep_000852	Clc1ncn(Cc2ccc(o2)C(=O)NNC(=O)OCc3ccccc3c4ccccc4)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K15	compound treatment	0.803	0.0139	0.19	0.728	0.02	0.27	0.3259	0.9834	1966188	Cerep_000853	CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)OCc2ccc(C#Cc3ccccc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K16	compound treatment	0.785	-0.00407	-0.05	0.729	0.021	0.29	0.1638	0.5615	1966189	Cerep_000854	Fc1ccccc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K17	compound treatment	0.81	0.0209	0.28	0.694	-0.014	-0.19	0.0648	0.1903	1966190	Cerep_000855	ClCCCCCCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K18	compound treatment	0.804	0.0149	0.2	0.696	-0.012	-0.16	0.0269	0.1036	1966191	Cerep_000856	CN(C)c1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K19	compound treatment	0.782	-0.00707	-0.1	0.729	0.021	0.29	0.1352	0.4477	1966192	Cerep_000857	CC(=O)Nc1ccc(NC(=O)OCCc2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K20	compound treatment	0.792	0.00293	0.04	0.713	0.00502	0.07	0.0763	0.9661	1966193	Cerep_000858	CCCCCC#CCCOC(=O)NC(C)C(=O)OCc1ccc(cc1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K21	compound treatment	0.777	-0.0121	-0.16	0.72	0.012	0.16	7.0E-4	0.0032	1966194	Cerep_000859	CC(COC(=O)NNC(=O)c1ccc2nccnc2c1)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	K22	compound treatment	0.792	0.00293	0.04	0.702	-0.00598	-0.08	-0.0297	-0.328	1966195	Cerep_000860	CC1(COC(=O)NC2CCN(Cc3c(F)cccc3Cl)C2)COC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L03	compound treatment	0.797	0.00793	0.11	0.71	0.00202	0.03	0.0951	0.8608	1966196	Cerep_000861	CCCCC#CCCOC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L04	compound treatment	0.769	-0.0201	-0.27	0.677	-0.031	-0.42	-0.4902	-0.9769	1966197	Cerep_000862	Cc1sc(nc1CC(=O)NNC(=O)Cc2ccsc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L05	compound treatment	0.788	-0.00107	-0.01	0.685	-0.023	-0.31	-0.2318	-0.7389	1966198	Cerep_000863	COc1ccc(cc1)C(=O)NNC(=O)OCC2CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L06	compound treatment	0.784	-0.00507	-0.07	0.707	-9.84E-4	-0.01	-0.0578	-0.8301	1966199	Cerep_000864	CC(NC(=O)CC(CC(=O)C1CC1)c2ccc(Br)cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L07	compound treatment	0.784	-0.00507	-0.07	0.705	-0.00298	-0.04	-0.0771	-0.9693	1966200	Cerep_000865	CCOc1ccsc1C(=O)NNC(=O)OCC2CCCN2c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L08	compound treatment	0.759	-0.0301	-0.41	0.688	-0.02	-0.27	-0.4795	-0.9813	1966201	Cerep_000866	[O-][N+](=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L09	compound treatment	0.793	0.00393	0.05	0.706	-0.00198	-0.03	0.0184	0.3085	1966202	Cerep_000867	O=C(OCc1ccc(C#N)cc1)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L10	compound treatment	0.771	-0.0181	-0.24	0.702	-0.00598	-0.08	-0.2301	-0.895	1966203	Cerep_000868	COc1ccc(cc1OC)C(=O)NNC(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L11	compound treatment	0.789	-6.9E-5	0.0	0.72	0.012	0.16	0.1152	0.7031	1966204	Cerep_000869	Clc1ccc2nc(sc2c1)N3CCCN(CC3)C(=O)OCc4cccc(OCc5ccccc5)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L12	compound treatment	0.764	-0.0251	-0.34	0.684	-0.024	-0.33	-0.4704	-0.9999	1966205	Cerep_000870	CC/1=C(CC(=O)N2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4)c5cc(F)ccc5\C1=C/c6ccc(cc6)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L13	compound treatment	0.794	0.00493	0.07	0.716	0.00802	0.11	0.1243	0.9717	1966206	Cerep_000871	COc1cc(CN2CCC(C2)NC(=O)OCc3ccc(SC(F)(F)F)cc3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L14	compound treatment	0.777	-0.0121	-0.16	0.691	-0.017	-0.23	-0.2789	-0.9851	1966207	Cerep_000872	OC(CNC(=O)c1c(F)cccc1F)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L15	compound treatment	0.788	-0.00107	-0.01	0.715	0.00702	0.1	0.0575	0.5938	1966208	Cerep_000873	COc1cccc(CCOC(=O)NCCc2c[nH]c3ccc(OC)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L16	compound treatment	0.763	-0.0261	-0.35	0.683	-0.025	-0.34	-0.4896	-0.9999	1966209	Cerep_000874	CN(C)c1cccc2c(cccc12)S(=O)(=O)NNC(=O)c3ccc(cc3)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L17	compound treatment	0.787	-0.00207	-0.03	0.71	0.00202	0.03	-3.0E-4	-0.0077	1966210	Cerep_000875	NC(=O)C1CCN(CC1)C(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L18	compound treatment	0.748	-0.0411	-0.55	0.662	-0.046	-0.63	-0.8352	-0.9981	1966211	Cerep_000876	CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCN(CC3)c4ccc(cc4)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L19	compound treatment	0.805	0.0159	0.21	0.687	-0.021	-0.29	-0.0504	-0.1407	1966212	Cerep_000877	CCOc1cccc(c1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L20	compound treatment	0.768	-0.0211	-0.28	0.708	1.57E-5	0.0	-0.2008	-0.7066	1966213	Cerep_000878	CCOc1ccc(CCNC(=O)C(C)CC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L21	compound treatment	0.8	0.0109	0.15	0.708	1.57E-5	0.0	0.1044	0.7081	1966214	Cerep_000879	CC(=CCC/C(=C\COC(=O)N1CCc2c(C1)[nH]c3ccccc23)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	L22	compound treatment	0.779	-0.0101	-0.14	0.698	-0.00998	-0.14	-0.1923	-1.0	1966215	Cerep_000880	COc1cc(CNC(=O)c2ccc(cc2)n3cccc3)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M03	compound treatment	0.791	0.00193	0.03	0.713	0.00502	0.07	0.0668	0.9125	1966216	Cerep_000881	Cc1nc(sc1C(=O)NNC(=O)OCCOCCCc2cccc(C)n2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M04	compound treatment	0.818	0.0289	0.39	0.71	0.00202	0.03	0.2954	0.755	1966217	Cerep_000882	Clc1cccc(COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M05	compound treatment	0.79	9.31E-4	0.01	0.702	-0.00598	-0.08	-0.0488	-0.5913	1966218	Cerep_000883	COc1cscc1C(=O)NNC(=O)OCC2CCCN(Cc3cc(OC)c(OC)cc3Br)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M06	compound treatment	0.782	-0.00707	-0.1	0.717	0.00902	0.12	0.0195	0.1253	1966219	Cerep_000884	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M07	compound treatment	0.807	0.0179	0.24	0.739	0.031	0.42	0.4701	0.9649	1966220	Cerep_000885	Brc1ccccc1COC(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M08	compound treatment	0.796	0.00693	0.09	0.762	0.054	0.74	0.587	0.7905	1966221	Cerep_000886	O=C(Cc1ccsc1)NNC(=O)OCCSCc2ccc3nonc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M09	compound treatment	0.79	9.31E-4	0.01	0.708	1.57E-5	0.0	0.009	0.719	1966222	Cerep_000887	Cc1ccccc1CCOC(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M10	compound treatment	0.784	-0.00507	-0.07	0.715	0.00702	0.1	0.0193	0.1641	1966223	Cerep_000888	CCOc1cccc(c1)C(=O)NNC(=O)OCCc2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M11	compound treatment	0.798	0.00893	0.12	0.72	0.012	0.16	0.2011	0.9886	1966224	Cerep_000889	Fc1ccc(c(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M12	compound treatment	0.797	0.00793	0.11	0.708	1.57E-5	0.0	0.0758	0.7085	1966225	Cerep_000890	CCCCCC#CCCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M13	compound treatment	0.792	0.00293	0.04	0.717	0.00902	0.12	0.1149	0.8896	1966226	Cerep_000891	CC(N1CCN(CC1)C(=O)OCCc2c[nH]c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M14	compound treatment	0.815	0.0259	0.35	0.742	0.034	0.46	0.5754	0.9903	1966227	Cerep_000892	[O-][N+](=O)c1cc2OCOc2cc1COC(=O)NNC(=O)CC3Sc4ccccc4NC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M15	compound treatment	0.787	-0.00207	-0.03	0.712	0.00402	0.05	0.019	0.3089	1966228	Cerep_000893	Brc1ccc(CCOC(=O)NNC(=O)c2snnc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M16	compound treatment	0.805	0.0159	0.21	0.7	-0.00798	-0.11	0.075	0.3112	1966229	Cerep_000894	Fc1ccccc1CN2CCCC(COC(=O)NCc3ccc(cc3)c4csnn4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M17	compound treatment	0.796	0.00693	0.09	0.71	0.00202	0.03	0.0856	0.8778	1966230	Cerep_000895	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc([N+](=O)[O-])c(OC)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M18	compound treatment	0.77	-0.0191	-0.26	0.706	-0.00198	-0.03	-0.201	-0.7772	1966231	Cerep_000896	Cc1ccccc1N2CCN(CC2)C(=O)OCCCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M19	compound treatment	0.801	0.0119	0.16	0.701	-0.00698	-0.1	0.0465	0.2485	1966232	Cerep_000897	Fc1cccc(Cl)c1CCOC(=O)NNC(=O)c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M20	compound treatment	0.801	0.0119	0.16	0.706	-0.00198	-0.03	0.0947	0.5801	1966233	Cerep_000898	CCN1CCCC1CNC(=O)OCc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M21	compound treatment	0.815	0.0259	0.35	0.717	0.00902	0.12	0.3343	0.9016	1966234	Cerep_000899	CC1CN(CCN1c2ccc(C)cc2)C(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	M22	compound treatment	0.797	0.00793	0.11	0.72	0.012	0.16	0.1915	0.9787	1966235	Cerep_000900	Clc1ccc(cc1)C(N2CCN(CCOCCOC(=O)N3CCN(CC3)C(c4ccccc4)c5ccc(Cl)cc5)CC2)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N03	compound treatment	0.82	0.0309	0.42	0.712	0.00402	0.05	0.3338	0.7931	1966236	Cerep_000901	CSc1cccc(NC(=O)C(=O)NNC(=O)OCC#Cc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N04	compound treatment	0.778	-0.0111	-0.15	0.694	-0.014	-0.19	-0.2404	-0.9927	1966237	Cerep_000902	O=C(CNC(=O)c1cccnc1)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N05	compound treatment	0.811	0.0219	0.3	0.717	0.00902	0.12	0.2961	0.9243	1966238	Cerep_000903	Fc1cccc(Cl)c1CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N06	compound treatment	0.786	-0.00307	-0.04	0.699	-0.00898	-0.12	-0.1159	-0.8963	1966239	Cerep_000904	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NCC(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N07	compound treatment	0.782	-0.00707	-0.1	0.771	0.063	0.86	0.5402	0.6248	1966240	Cerep_000905	CC12CCCC(=O)N2C(COC(=O)N3CCc4c(C3)[nH]c5ccccc45)C(O1)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N08	compound treatment	0.758	-0.0311	-0.42	0.721	0.013	0.18	-0.1709	-0.3754	1966241	Cerep_000906	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NC(CCC(=O)OC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N09	compound treatment	0.75	-0.0391	-0.53	0.729	0.021	0.29	-0.17	-0.2834	1966242	Cerep_000907	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccc(OC)c(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N10	compound treatment	0.776	-0.0131	-0.18	0.682	-0.026	-0.35	-0.3752	-0.9481	1966243	Cerep_000908	COc1ccccc1C(=O)NNC(=O)C2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N11	compound treatment	0.793	0.00393	0.05	0.732	0.024	0.33	0.2691	0.811	1966244	Cerep_000909	Clc1ccc(Oc2cccc(COC(=O)NCc3ccc(cc3)c4csnn4)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N12	compound treatment	0.784	-0.00507	-0.07	0.695	-0.013	-0.18	-0.1736	-0.9144	1966245	Cerep_000910	COc1cc(OC)cc(c1)C(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N13	compound treatment	0.823	0.0339	0.46	0.7	-0.00798	-0.11	0.2467	0.5243	1966246	Cerep_000911	Clc1ccc2[nH]cc(CCNC(=O)OCCc3ccsc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N14	compound treatment	0.807	0.0179	0.24	0.716	0.00802	0.11	0.2483	0.9355	1966247	Cerep_000912	COC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])NC(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N15	compound treatment	0.75	-0.0391	-0.53	0.722	0.014	0.19	-0.2375	-0.4237	1966248	Cerep_000913	Cc1cccc(CCOC(=O)NC(c2ccccc2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N16	compound treatment	0.797	0.00793	0.11	0.677	-0.031	-0.42	-0.2231	-0.5119	1966249	Cerep_000914	COc1cccc(c1)C(=O)NNC(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N17	compound treatment	0.809	0.0199	0.27	0.682	-0.026	-0.35	-0.0604	-0.1358	1966250	Cerep_000915	Cc1cc(C)c(CCOC(=O)NNC(=O)c2ccc(O)cc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N18	compound treatment	0.792	0.00293	0.04	0.698	-0.00998	-0.14	-0.0683	-0.4818	1966251	Cerep_000916	CN(Cc1cccc2ccccc12)C(=O)CC3=C(C)/C(=C/c4ccc(cc4)S(=O)C)/c5ccc(F)cc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N19	compound treatment	0.779	-0.0101	-0.14	0.685	-0.023	-0.31	-0.3177	-0.93	1966252	Cerep_000917	CC(COC(=O)NNC(=O)C(C)n1nnc(n1)N2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N20	compound treatment	0.78	-0.00907	-0.12	0.718	0.01	0.14	0.0101	0.0549	1966253	Cerep_000918	CC(=O)Nc1ccc(cc1)C(=O)NC(CSCc2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N21	compound treatment	0.809	0.0199	0.27	0.728	0.02	0.27	0.3831	1.0	1966254	Cerep_000919	[O-][N+](=O)c1ccc(cc1)N2CCCC2COC(=O)N3CCc4c(C3)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	N22	compound treatment	0.76	-0.0291	-0.39	0.675	-0.033	-0.45	-0.5953	-0.9977	1966255	Cerep_000920	O=C(NCc1ccccc1)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O03	compound treatment	0.791	0.00193	0.03	0.726	0.018	0.25	0.1921	0.7777	1966256	Cerep_000921	O=C(OCC1CCCCN1Cc2ccco2)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O04	compound treatment	0.811	0.0219	0.3	0.728	0.02	0.27	0.4022	0.9992	1966257	Cerep_000922	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cccc(SC(F)(F)F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O05	compound treatment	0.807	0.0179	0.24	0.713	0.00502	0.07	0.2194	0.8728	1966258	Cerep_000923	COc1cc(ccc1CN2CCC(C2)NC(=O)OCCc3cccc4ccccc34)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O06	compound treatment	0.807	0.0179	0.24	0.728	0.02	0.27	0.364	0.9982	1966259	Cerep_000924	CN(C)c1ccc(cc1)C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O07	compound treatment	0.808	0.0189	0.26	0.748	0.04	0.55	0.5664	0.9402	1966260	Cerep_000925	CCOc1ccsc1C(=O)NNC(=O)OCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O08	compound treatment	0.824	0.0349	0.47	0.72	0.012	0.16	0.4491	0.9001	1966261	Cerep_000926	FC(F)(F)Oc1ccccc1COC(=O)NCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O09	compound treatment	0.862	0.0729	0.98	0.766	0.058	0.79	1.2551	0.9942	1966262	Cerep_000927	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCCCc4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O10	compound treatment	0.79	9.31E-4	0.01	0.691	-0.017	-0.23	-0.1549	-0.6678	1966263	Cerep_000928	Clc1ccccc1N2CCN(CC2)C(=O)OCCCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O11	compound treatment	0.796	0.00693	0.09	0.714	0.00602	0.08	0.1241	0.9979	1966264	Cerep_000929	OC1(CCN(CC1)C(=O)OCCOc2ccc(cn2)[N+](=O)[O-])c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O12	compound treatment	0.824	0.0349	0.47	0.734	0.026	0.35	0.5841	0.9902	1966265	Cerep_000930	COc1ccccc1CNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O13	compound treatment	0.793	0.00393	0.05	0.705	-0.00298	-0.04	0.0087	0.1305	1966266	Cerep_000931	O=C(OCC1COc2ccccc2O1)N3CCc4c(C3)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O14	compound treatment	0.796	0.00693	0.09	0.725	0.017	0.23	0.2302	0.9202	1966267	Cerep_000932	CCN(CCOC(=O)NNC(=O)/C=C/c1ccco1)c2ccc(N=Nc3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O15	compound treatment	0.805	0.0159	0.21	0.695	-0.013	-0.18	0.0268	0.0961	1966268	Cerep_000933	Clc1ccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O16	compound treatment	0.785	-0.00407	-0.05	0.728	0.02	0.27	0.1542	0.5538	1966269	Cerep_000934	CN(C)c1ccc(CN2CCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O17	compound treatment	0.792	0.00293	0.04	0.746	0.038	0.52	0.3945	0.7588	1966270	Cerep_000935	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(F)c4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O18	compound treatment	0.785	-0.00407	-0.05	0.711	0.00302	0.04	-0.0097	-0.142	1966271	Cerep_000936	Clc1ccc(cc1)C2(COC(=O)N3CCN(CC3)c4nc(ns4)c5ccccc5)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O19	compound treatment	0.777	-0.0121	-0.16	0.711	0.00302	0.04	-0.0861	-0.5124	1966272	Cerep_000937	FC(F)COC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O20	compound treatment	0.763	-0.0261	-0.35	0.712	0.00402	0.05	-0.21	-0.5899	1966273	Cerep_000938	CN1CCN(CCCNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O21	compound treatment	0.823	0.0339	0.46	0.735	0.027	0.37	0.5842	0.9942	1966274	Cerep_000939	Cc1noc(c2cccs2)c1C(=O)NNC(=O)OCc3ccc(C#Cc4ccccc4)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	O22	compound treatment	0.79	9.31E-4	0.01	0.713	0.00502	0.07	0.0572	0.8232	1966275	Cerep_000940	CC1(C)COC(CCOC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)OC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P03	compound treatment	0.795	0.00593	0.08	0.745	0.037	0.5	0.4135	0.8091	1966276	Cerep_000941	Cc1cccc2c(CCNC(=O)OC/C=C/COCc3ccccc3)c[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P04	compound treatment	0.801	0.0119	0.16	0.697	-0.011	-0.15	0.0079	0.0359	1966277	Cerep_000942	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NC(C(C)C)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P05	compound treatment	0.798	0.00893	0.12	0.691	-0.017	-0.23	-0.0786	-0.301	1966278	Cerep_000943	CCC/C=C/COC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P06	compound treatment	0.767	-0.0221	-0.3	0.693	-0.015	-0.2	-0.355	-0.9831	1966279	Cerep_000944	COc1cc(nc2ccccc12)C(=O)NNC(=O)Cc3nc(oc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P07	compound treatment	0.775	-0.0141	-0.19	0.72	0.012	0.16	-0.0183	-0.0732	1966280	Cerep_000945	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P08	compound treatment	0.768	-0.0211	-0.28	0.698	-0.00998	-0.14	-0.2973	-0.9432	1966281	Cerep_000946	COc1ccccc1C(=O)NNC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P09	compound treatment	0.711	-0.0781	-1.05	0.641	-0.067	-0.91	-1.3906	-0.9975	1966282	Cerep_000947	COc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4sc(cc4[N+](=O)[O-])S(=O)(=O)N)CC2)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P10	compound treatment	0.064	-0.725	-9.78	0.084	-0.624	-8.51	-12.9334	-0.9976	1966283	Cerep_000948	COc1cc(OC)c(CN2CCC(C2)NC(=O)Cc3nc(sc3C)c4ccccc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P11	compound treatment	0.776	-0.0131	-0.18	0.714	0.00602	0.08	-0.0667	-0.3428	1966284	Cerep_000949	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCc3cccc(OC)c3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P12	compound treatment	0.751	-0.0381	-0.51	0.707	-9.84E-4	-0.01	-0.3726	-0.7253	1966285	Cerep_000950	Cc1cccc(CNC(=O)CC(CC(=O)C2CC2)c3ccc(Br)cc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P13	compound treatment	0.771	-0.0181	-0.24	0.723	0.015	0.2	-0.0276	-0.0866	1966286	Cerep_000951	CC(C)(C)OC(=O)N(CCOC(=O)NC1CCN(Cc2ccc3ccccc3c2)C1)Cc4cc5ccccc5c6ccccc46
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P14	compound treatment	0.768	-0.0211	-0.28	0.686	-0.022	-0.3	-0.413	-0.9996	1966287	Cerep_000952	NC(=O)C(Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P15	compound treatment	0.784	-0.00507	-0.07	0.69	-0.018	-0.25	-0.2218	-0.871	1966288	Cerep_000953	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P16	compound treatment	0.769	-0.0201	-0.27	0.678	-0.03	-0.41	-0.4806	-0.98	1966289	Cerep_000954	FC(F)(F)Oc1ccc(cc1)C(=O)NNC(=O)C2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P17	compound treatment	0.775	-0.0141	-0.19	0.706	-0.00198	-0.03	-0.1533	-0.7998	1966290	Cerep_000955	CCCCC#CCCOC(=O)NCCc1cc(OC)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P18	compound treatment	0.754	-0.0351	-0.47	0.676	-0.032	-0.44	-0.6429	-0.9992	1272469	Cerep_000956	COc1cc(OC)cc(c1)C(=O)NCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P19	compound treatment	0.778	-0.0111	-0.15	0.697	-0.011	-0.15	-0.2115	-1.0	1966291	Cerep_000957	COc1ccc2[nH]cc(CCNC(=O)OCC3CCC4CC3C4(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P20	compound treatment	0.767	-0.0221	-0.3	0.681	-0.027	-0.37	-0.4707	-0.9945	1966292	Cerep_000958	CS(=O)(=O)c1ccccc1C(=O)NNC(=O)CNC(=O)CNC(=O)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P21	compound treatment	0.765	-0.0241	-0.32	0.711	0.00302	0.04	-0.2005	-0.6127	1966293	Cerep_000959	CC12CCCC(=O)N2C(COC(=O)NNC(=O)c3ccccc3n4cccc4)C(O1)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.528	P22	compound treatment	0.743	-0.0461	-0.62	0.701	-0.00698	-0.1	-0.5068	-0.8061	1966294	Cerep_000960	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A03	compound treatment	0.787	-0.00266	-0.04	0.705	-0.00434	-0.06	-0.0673	-0.9713	1966295	Cerep_000961	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)C2CCN(CC2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A04	compound treatment	0.814	0.0243	0.33	0.711	0.00166	0.02	0.2481	0.7539	1966296	Cerep_000962	Cc1ccc(C)c(c1)N2CCN(CC2)C(=O)CC3(CC(=O)O)CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A05	compound treatment	0.805	0.0153	0.21	0.702	-0.00734	-0.1	0.0755	0.3283	1966297	Cerep_000963	Cc1sc(nc1CC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A06	compound treatment	0.821	0.0313	0.42	0.703	-0.00634	-0.09	0.2377	0.551	1966298	Cerep_000964	CC(CC(=O)O)CC(=O)N1CCN(CC1)C(=O)c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A07	compound treatment	0.795	0.00534	0.07	0.701	-0.00834	-0.11	-0.0296	-0.2196	1966299	Cerep_000965	Cc1ccc(cc1)C(=O)N2CCN(CCC3CCCCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A08	compound treatment	0.807	0.0173	0.23	0.718	0.00866	0.12	0.2488	0.9499	1966300	Cerep_000966	Cc1ccc(Cl)cc1N2CCN(CC2)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A09	compound treatment	0.783	-0.00666	-0.09	0.688	-0.0213	-0.29	-0.2694	-0.8843	1966301	Cerep_000967	CC1CC(C2CCCC12)C(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A10	compound treatment	0.791	0.00134	0.02	0.701	-0.00834	-0.11	-0.0677	-0.5878	1966302	Cerep_000968	CC1(C)C(CCC1(C)C(=O)N2CCC(O)(CC2)c3ccc(Br)cc3)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A11	compound treatment	0.799	0.00934	0.13	0.686	-0.0233	-0.32	-0.136	-0.3974	1966303	Cerep_000969	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NCCc3c[nH]cn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A12	compound treatment	0.799	0.00934	0.13	0.725	0.0157	0.21	0.24	0.9683	1966304	Cerep_000970	O=C(OCc1ccc(/C=C/c2ccccc2)cc1)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A13	compound treatment	0.766	-0.0237	-0.32	0.698	-0.0113	-0.15	-0.3351	-0.9447	1966305	Cerep_000971	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)c3ccco3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A14	compound treatment	0.784	-0.00566	-0.08	0.682	-0.0273	-0.37	-0.3177	-0.8347	1966306	Cerep_000972	CN(C1CCN(Cc2cc3OCOc3cc2Cl)C1)C(=O)OCc4c(C)noc4c5cc(C)on5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A15	compound treatment	0.787	-0.00266	-0.04	0.711	0.00166	0.02	-0.0095	-0.2228	1966307	Cerep_000973	CCCCCCc1ccc(cc1)C(=O)NNC(=O)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A16	compound treatment	0.809	0.0193	0.26	0.717	0.00766	0.1	0.2583	0.9192	1966308	Cerep_000974	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCC3CCCN(Cc4c(Cl)cccc4Cl)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A17	compound treatment	0.78	-0.00966	-0.13	0.704	-0.00534	-0.07	-0.1437	-0.9622	1966309	Cerep_000975	Cc1ccc(cc1)C(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A18	compound treatment	0.798	0.00834	0.11	0.717	0.00766	0.1	0.1533	0.9993	1966310	Cerep_000976	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4c(F)ccc(F)c4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A19	compound treatment	0.801	0.0113	0.15	0.716	0.00666	0.09	0.1723	0.969	1966311	Cerep_000977	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)c5ccc(OC)c(OCc6ccccc6)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A20	compound treatment	0.812	0.0223	0.3	0.718	0.00866	0.12	0.2965	0.9163	1966312	Cerep_000978	CC(=O)NCCNC(=O)OCCc1cccc(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A21	compound treatment	0.787	-0.00266	-0.04	0.718	0.00866	0.12	0.058	0.4704	1966313	Cerep_000979	CCCCC(C)C(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	A22	compound treatment	0.8	0.0103	0.14	0.716	0.00666	0.09	0.1628	0.9784	1966314	Cerep_000980	CC(C)(C)c1ccc(COC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B03	compound treatment	0.831	0.0413	0.56	0.734	0.0247	0.34	0.632	0.9707	1966315	Cerep_000981	CC(C)(C)OC(=O)C(Cc1ccc(OC(C)(C)C)cc1)NC(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B04	compound treatment	0.771	-0.0187	-0.25	0.708	-0.00134	-0.02	-0.191	-0.7566	1966316	Cerep_000982	CC(C)(O)C#Cc1ccc(COC(=O)NNC(=O)c2ccc3nsnc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B05	compound treatment	0.807	0.0173	0.23	0.735	0.0257	0.35	0.4127	0.9808	1966317	Cerep_000983	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B06	compound treatment	0.791	0.00134	0.02	0.702	-0.00734	-0.1	-0.0581	-0.5708	1966318	Cerep_000984	Fc1ccccc1CCOC(=O)NNC(=O)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B07	compound treatment	0.799	0.00934	0.13	0.712	0.00266	0.04	0.1147	0.875	1966319	Cerep_000985	Cc1ccccc1N2CCN(CC2)C(=O)OCCCCCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B08	compound treatment	0.765	-0.0247	-0.33	0.694	-0.0153	-0.21	-0.3832	-0.975	1966320	Cerep_000986	CCOc1ccccc1CNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B09	compound treatment	0.799	0.00934	0.13	0.724	0.0147	0.2	0.2304	0.9752	1966321	Cerep_000987	CC(COC(=O)NNC(=O)c1ccccc1O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B10	compound treatment	0.819	0.0293	0.4	0.695	-0.0143	-0.2	0.1415	0.3206	1966322	Cerep_000988	COc1cccc(CCNC(=O)OCCc2cccc(OC)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B11	compound treatment	0.77	-0.0197	-0.27	0.732	0.0227	0.31	0.0309	0.0758	1966323	Cerep_000989	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCCN3CCN(CCCN4c5ccccc5Sc6ccc(Cl)cc46)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B12	compound treatment	0.762	-0.0277	-0.37	0.701	-0.00834	-0.11	-0.3444	-0.8826	1966324	Cerep_000990	Fc1cccc(Cl)c1COC(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B13	compound treatment	0.783	-0.00666	-0.09	0.716	0.00666	0.09	6.0E-4	0.0047	1966325	Cerep_000991	Clc1ccccc1CCOC(=O)NNC(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B14	compound treatment	0.767	-0.0227	-0.31	0.667	-0.0423	-0.58	-0.6245	-0.9558	1966326	Cerep_000992	CC(NC(=O)OCCN1CCN(Cc2ccc(C)s2)CC1)c3cccc4OCCOc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B15	compound treatment	0.761	-0.0287	-0.39	0.737	0.0277	0.38	-0.0068	-0.0125	1966327	Cerep_000993	COc1ccc(CCCOC(=O)NNC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B16	compound treatment	0.79	3.35E-4	0.0	0.702	-0.00734	-0.1	-0.0676	-0.6745	1966328	Cerep_000994	OC1CCCCC1CNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B17	compound treatment	0.81	0.0203	0.27	0.708	-0.00134	-0.02	0.181	0.6584	1966329	Cerep_000995	O=C(OCc1ccccc1)C2CCCN2C(=O)OCCc3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B18	compound treatment	0.745	-0.0447	-0.6	0.659	-0.0503	-0.69	-0.9115	-0.9979	1966330	Cerep_000996	COc1cccc(CN2CCC(COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B19	compound treatment	0.791	0.00134	0.02	0.715	0.00566	0.08	0.0673	0.8494	1966331	Cerep_000997	NS(=O)(=O)c1ccc(CNC(=O)OCCn2cccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B20	compound treatment	0.776	-0.0137	-0.18	0.706	-0.00334	-0.05	-0.1626	-0.8562	1966332	Cerep_000998	CC(C)(O)C#Cc1ccc(COC(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B21	compound treatment	0.769	-0.0207	-0.28	0.707	-0.00234	-0.03	-0.2197	-0.7831	1966333	Cerep_000999	Cc1ccc(cc1C)N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	B22	compound treatment	0.743	-0.0467	-0.63	0.67	-0.0393	-0.54	-0.8245	-0.9968	1966334	Cerep_001000	CCCC#CCCOC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C03	compound treatment	0.776	-0.0137	-0.18	0.727	0.0177	0.24	0.0399	0.1315	1966335	Cerep_001001	Cc1cc(nn1C)C(=O)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C04	compound treatment	0.819	0.0293	0.4	0.719	0.00966	0.13	0.3729	0.8942	1966336	Cerep_001002	OC(=O)CC1(CC(=O)N2CCN(CC2)c3cccc(Cl)c3)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C05	compound treatment	0.819	0.0293	0.4	0.738	0.0287	0.39	0.5561	1.0	1966337	Cerep_001003	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NC(Cc3c[nH]c4ccccc34)C(=O)Nc5ccc6ccccc6c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C06	compound treatment	0.798	0.00834	0.11	0.729	0.0197	0.27	0.269	0.9256	1966338	Cerep_001004	CC(CC(=O)O)CC(=O)N1CCC(=CC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C07	compound treatment	0.788	-0.00166	-0.02	0.718	0.00866	0.12	0.0676	0.5625	1966339	Cerep_001005	OC(CNC(=O)CC1Cc2ccccc2C1)c3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C08	compound treatment	0.789	-6.65E-4	-0.01	0.721	0.0117	0.16	0.106	0.6662	1966340	Cerep_001006	OC(=O)C1CC1C(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C09	compound treatment	0.791	0.00134	0.02	0.711	0.00166	0.02	0.0287	0.9938	1966341	Cerep_001007	CC(C)CC(NC(=O)c1ccccc1COC(=O)c2ccccc2)C(=O)NNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C10	compound treatment	0.79	3.35E-4	0.0	0.726	0.0167	0.23	0.1638	0.7211	1966342	Cerep_001008	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C11	compound treatment	0.782	-0.00766	-0.1	0.713	0.00366	0.05	-0.0379	-0.3299	1966343	Cerep_001009	O=C(NCc1ccncc1)c2ccsc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C12	compound treatment	0.807	0.0173	0.23	0.711	0.00166	0.02	0.1813	0.7718	1966344	Cerep_001010	COC(COC(=O)NC1CCN(Cc2c(F)cccc2Cl)C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C13	compound treatment	0.789	-6.65E-4	-0.01	0.717	0.00766	0.1	0.0675	0.644	1966345	Cerep_001011	COc1ccc(OC)c(CNC(=O)c2ccccc2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C14	compound treatment	0.774	-0.0157	-0.21	0.725	0.0157	0.21	0.0015	0.0051	1966346	Cerep_001012	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cc5OCOc5c(OC)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C15	compound treatment	0.78	-0.00966	-0.13	0.687	-0.0223	-0.3	-0.3077	-0.9283	1966347	Cerep_001013	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)CCCCCNC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C16	compound treatment	0.771	-0.0187	-0.25	0.74	0.0307	0.42	0.1175	0.2409	1966348	Cerep_001014	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C17	compound treatment	0.794	0.00434	0.06	0.718	0.00866	0.12	0.1248	0.9475	1966349	Cerep_001015	Fc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)CC3Cc4ccccc4C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C18	compound treatment	0.785	-0.00466	-0.06	0.729	0.0197	0.27	0.145	0.5268	1966350	Cerep_001016	OC1(CCN(CC1)C(=O)OCc2ccc(c(F)c2F)C(F)(F)F)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C19	compound treatment	0.815	0.0253	0.34	0.676	-0.0333	-0.45	-0.0798	-0.1404	1966351	Cerep_001017	CSc1sc(C(=O)NNC(=O)CC(NC(=O)OC(C)(C)C)c2ccc(F)cc2)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C20	compound treatment	0.787	-0.00266	-0.04	0.725	0.0157	0.21	0.1255	0.5799	1966352	Cerep_001018	Cc1cccc(CCOC(=O)NNC(=O)c2cc(Cl)ccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C21	compound treatment	0.795	0.00534	0.07	0.711	0.00166	0.02	0.0669	0.8863	1966353	Cerep_001019	O=C(N1CCN(CCN2CCOCC2)CC1)c3ccccc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	C22	compound treatment	0.777	-0.0127	-0.17	0.711	0.00166	0.02	-0.1049	-0.6084	1966354	Cerep_001020	Cc1ccccc1N2CCN(CC2)C(=O)OCCCCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D03	compound treatment	0.814	0.0243	0.33	0.728	0.0187	0.25	0.412	0.9921	1966355	Cerep_001021	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccccc3O)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D04	compound treatment	0.796	0.00634	0.09	0.709	-3.45E-4	0.0	0.0571	0.6672	1966356	Cerep_001022	CCOc1ccc(CCOC(=O)N2CCC(CC2)C(O)(c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D05	compound treatment	0.794	0.00434	0.06	0.724	0.0147	0.2	0.1827	0.8773	1966357	Cerep_001023	Cc1cccc(CCOC(=O)NNC(=O)c2snnc2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D06	compound treatment	0.778	-0.0117	-0.16	0.723	0.0137	0.19	0.0204	0.0837	1966358	Cerep_001024	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D07	compound treatment	0.784	-0.00566	-0.08	0.715	0.00566	0.08	5.0E-4	0.0045	1966359	Cerep_001025	COc1cc(CCNC(=O)OCCCc2cccnc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D08	compound treatment	0.778	-0.0117	-0.16	0.702	-0.00734	-0.1	-0.1821	-0.9762	1966360	Cerep_001026	CCOc1ccc(cc1)C(=O)NNC(=O)OCC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D09	compound treatment	0.792	0.00234	0.03	0.708	-0.00134	-0.02	0.0093	0.2554	1966361	Cerep_001027	Oc1ccc(cc1)C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D10	compound treatment	0.787	-0.00266	-0.04	0.716	0.00666	0.09	0.0388	0.397	1966362	Cerep_001028	Cc1cccc(CCOC(=O)NCCc2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D11	compound treatment	0.798	0.00834	0.11	0.704	-0.00534	-0.07	0.028	0.2088	1966363	Cerep_001029	O=C(NNC(=O)/C=C/c1ccco1)OCC2COC3(CCCCC3)O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D12	compound treatment	0.793	0.00334	0.04	0.673	-0.0363	-0.5	-0.3186	-0.6403	1966364	Cerep_001030	Clc1ccc(Sc2ccccc2CN3CCN(CC3)C(=O)OCc4cccc(Br)c4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D13	compound treatment	0.795	0.00534	0.07	0.695	-0.0143	-0.2	-0.0874	-0.4194	1966365	Cerep_001031	COc1ccccc1CCOC(=O)NNC(=O)/C=C/c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D14	compound treatment	0.755	-0.0347	-0.47	0.67	-0.0393	-0.54	-0.7101	-0.9977	1966366	Cerep_001032	Fc1ccc(CCNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D15	compound treatment	0.802	0.0123	0.17	0.71	6.55E-4	0.01	0.124	0.744	1966367	Cerep_001033	O=C(NCCCC(NC(=O)OCCCCCc1ccccc1)C(=O)OCc2ccccc2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D16	compound treatment	0.793	0.00334	0.04	0.707	-0.00234	-0.03	0.0092	0.1668	1966368	Cerep_001034	Cc1ccccc1N2CCN(CC2)C(=O)OCCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D17	compound treatment	0.797	0.00734	0.1	0.709	-3.45E-4	0.0	0.0667	0.6727	1966369	Cerep_001035	CC(C)(C)Sc1ccccc1CN2CCCCC2COC(=O)N3CCN(CC3)c4sc(cc4[N+](=O)[O-])S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D18	compound treatment	0.778	-0.0117	-0.16	0.706	-0.00334	-0.05	-0.1435	-0.876	1966370	Cerep_001036	CN(C1CCN(Cc2cc3ccccc3o2)C1)C(=O)OCC4CCCN(Cc5ccc6ccccc6c5)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D19	compound treatment	0.771	-0.0187	-0.25	0.707	-0.00234	-0.03	-0.2007	-0.7906	1966371	Cerep_001037	CCN(CCOC(=O)NNC(=O)CC1Sc2ccccc2NC1=O)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D20	compound treatment	0.763	-0.0267	-0.36	0.718	0.00866	0.12	-0.1709	-0.4514	1966372	Cerep_001038	Clc1ccc(cc1)c2csc(COC(=O)NCC3COc4ccccc4O3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D21	compound treatment	0.787	-0.00266	-0.04	0.738	0.0287	0.39	0.2509	0.6394	1966373	Cerep_001039	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	D22	compound treatment	0.761	-0.0287	-0.39	0.696	-0.0133	-0.18	-0.4021	-0.9409	1966374	Cerep_001040	O=C(NCc1nc2ccccc2[nH]1)OCCc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E03	compound treatment	0.787	-0.00266	-0.04	0.719	0.00966	0.13	0.0677	0.4959	1966375	Cerep_001041	COc1cc(/C=C/C(=O)NNC(=O)c2ccccc2COC(=O)c3ccccc3)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E04	compound treatment	0.794	0.00434	0.06	0.7	-0.00934	-0.13	-0.0487	-0.3477	1966376	Cerep_001042	OC(=O)CC1(CC(=O)N2CCN(CC2)c3ccccc3F)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E05	compound treatment	0.8	0.0103	0.14	0.716	0.00666	0.09	0.1628	0.9784	1966377	Cerep_001043	O=C(NNC(=O)c1ccc(s1)c2ccccn2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E06	compound treatment	0.808	0.0183	0.25	0.707	-0.00234	-0.03	0.1523	0.6106	1966378	Cerep_001044	CC(CC(=O)O)CC(=O)N1CCN(CC1)c2ncnc3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E07	compound treatment	0.798	0.00834	0.11	0.718	0.00866	0.12	0.163	0.9997	1966379	Cerep_001045	Cc1cc(nn1C)C(=O)NNC(=O)c2cnn(c2C(F)(F)F)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E08	compound treatment	0.824	0.0343	0.46	0.705	-0.00434	-0.06	0.2856	0.6117	1966380	Cerep_001046	CC1(C)C(CCC1(C)C(=O)N2CCc3ccccc3C2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E09	compound treatment	0.792	0.00234	0.03	0.719	0.00966	0.13	0.1154	0.8523	1966381	Cerep_001047	O=C(NCc1nc2ccccc2[nH]1)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E10	compound treatment	0.772	-0.0177	-0.24	0.74	0.0307	0.42	0.1271	0.2641	1966382	Cerep_001048	CC(C)(CC(=O)O)CC(=O)N1CCN(Cc2ccc3OCOc3c2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E11	compound treatment	0.759	-0.0307	-0.41	0.709	-3.45E-4	0.0	-0.2958	-0.7151	1966383	Cerep_001049	Clc1ccccc1C(=O)Nc2ccsc2C(=O)NNC(=O)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E12	compound treatment	0.787	-0.00266	-0.04	0.694	-0.0153	-0.21	-0.1734	-0.8166	1966384	Cerep_001050	O=C(NCCOC(=O)NNC(=O)c1ccc(cc1)c2ccccc2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E13	compound treatment	0.801	0.0113	0.15	0.705	-0.00434	-0.06	0.0662	0.4039	1966385	Cerep_001051	COc1cccc(CN2CCC(C2)NC(=O)c3cc(F)cc(F)c3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E14	compound treatment	0.771	-0.0187	-0.25	0.698	-0.0113	-0.15	-0.2874	-0.9726	1966386	Cerep_001052	[O-][N+](=O)c1cc(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E15	compound treatment	0.8	0.0103	0.14	0.712	0.00266	0.04	0.1242	0.8621	1966387	Cerep_001053	CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E16	compound treatment	0.776	-0.0137	-0.18	0.7	-0.00934	-0.13	-0.2205	-0.9837	1966388	Cerep_001054	CN(C)c1ccc(CNC(=O)OCc2cccc(OCc3ccccc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E17	compound treatment	0.783	-0.00666	-0.09	0.7	-0.00934	-0.13	-0.1537	-0.9854	1966389	Cerep_001055	COc1cccc(CN2CCC(C2)NC(=O)C3CC(C)C4CCCC34)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E18	compound treatment	0.788	-0.00166	-0.02	0.704	-0.00534	-0.07	-0.0674	-0.884	1966390	Cerep_001056	CCc1ccccc1N2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E19	compound treatment	0.785	-0.00466	-0.06	0.715	0.00566	0.08	0.01	0.1008	1966391	Cerep_001057	OS(=O)(=O)c1cccc(c1)C(=O)NCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E20	compound treatment	0.796	0.00634	0.09	0.713	0.00366	0.05	0.0957	0.967	1966392	Cerep_001058	CC(C)(C)OC(=O)NC1CCN(C1)C(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E21	compound treatment	0.79	3.35E-4	0.0	0.705	-0.00434	-0.06	-0.0387	-0.6512	1966393	Cerep_001059	Cc1cc(cc(C)c1[N+](=O)[O-])C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	E22	compound treatment	0.792	0.00234	0.03	0.73	0.0207	0.28	0.2214	0.7813	1966394	Cerep_001060	Cc1cc(C)c(CCOC(=O)NNC(=O)/C=C/c2ccc(F)cc2Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F03	compound treatment	0.788	-0.00166	-0.02	0.728	0.0187	0.25	0.164	0.6422	1966395	Cerep_001061	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(C)s4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F04	compound treatment	0.756	-0.0337	-0.45	0.684	-0.0253	-0.35	-0.5655	-0.9909	1966396	Cerep_001062	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCCN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F05	compound treatment	0.791	0.00134	0.02	0.724	0.0147	0.2	0.1541	0.7677	1966397	Cerep_001063	Clc1ncn(CC(=O)NNC(=O)OCCc2ccc(Br)cc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F06	compound treatment	0.758	-0.0317	-0.43	0.695	-0.0143	-0.2	-0.4404	-0.9373	1966398	Cerep_001064	COc1ccccc1CCOC(=O)NCCc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F07	compound treatment	0.788	-0.00166	-0.02	0.711	0.00166	0.02	1.0E-4	0.0025	1966399	Cerep_001065	COc1cc(CCNC(=O)OCc2ccsc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F08	compound treatment	0.768	-0.0217	-0.29	0.689	-0.0203	-0.28	-0.4028	-0.9997	1966400	Cerep_001066	Cc1nnsc1C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F09	compound treatment	0.782	-0.00766	-0.1	0.699	-0.0103	-0.14	-0.1729	-0.9883	1966401	Cerep_001067	CN(C)c1ccc(cc1)C(=O)NNC(=O)OCCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F10	compound treatment	0.799	0.00934	0.13	0.681	-0.0283	-0.39	-0.1843	-0.4533	1966402	Cerep_001068	FC(F)(F)c1cccc(/C=C/C(=O)NNC(=O)OCCc2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F11	compound treatment	0.775	-0.0147	-0.2	0.675	-0.0343	-0.47	-0.4711	-0.9265	1966403	Cerep_001069	O=C(OCC(Cc1ccccc1)N(Cc2ccccc2)Cc3ccccc3)N4CCN(CC4)c5ccncc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F12	compound treatment	0.784	-0.00566	-0.08	0.665	-0.0443	-0.6	-0.4816	-0.7902	1966404	Cerep_001070	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F13	compound treatment	0.799	0.00934	0.13	0.703	-0.00634	-0.09	0.0279	0.1824	1966405	Cerep_001071	Clc1cccc(CCOC(=O)NNC(=O)c2cccc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F14	compound treatment	0.758	-0.0317	-0.43	0.699	-0.0103	-0.14	-0.4018	-0.8932	1966406	Cerep_001072	COc1cccc(CN2CCC(COC(=O)N3CCCC3C(=O)OCc4ccccc4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F15	compound treatment	0.792	0.00234	0.03	0.728	0.0187	0.25	0.2022	0.7887	1966407	Cerep_001073	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCCCCCCl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F16	compound treatment	0.791	0.00134	0.02	0.698	-0.0113	-0.15	-0.0967	-0.6206	1966408	Cerep_001074	COc1ccc(cc1)C(=O)NNC(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F17	compound treatment	0.764	-0.0257	-0.35	0.728	0.0187	0.25	-0.0649	-0.1512	1966409	Cerep_001075	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3cccc(O)c3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F18	compound treatment	0.764	-0.0257	-0.35	0.697	-0.0123	-0.17	-0.3639	-0.9451	1966410	Cerep_001076	COc1cc(Br)c(CN2CCCC(COC(=O)NCc3ccc4OCCc4c3)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F19	compound treatment	0.824	0.0343	0.46	0.719	0.00966	0.13	0.4206	0.8735	1966411	Cerep_001077	Brc1ccccc1COC(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F20	compound treatment	0.767	-0.0227	-0.31	0.669	-0.0403	-0.55	-0.6052	-0.9616	1966412	Cerep_001078	O=C(NNC(=O)/C=C/c1ccco1)OCCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F21	compound treatment	0.774	-0.0157	-0.21	0.746	0.0367	0.5	0.204	0.3759	1966413	Cerep_001079	Fc1cccc(Cl)c1COC(=O)NNC(=O)c2csc(Cn3cnc(Cl)c3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	F22	compound treatment	0.762	-0.0277	-0.37	0.71	6.55E-4	0.01	-0.2576	-0.69	1966414	Cerep_001080	Clc1cccc(c1)N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G03	compound treatment	0.78	-0.00966	-0.13	0.697	-0.0123	-0.17	-0.2112	-0.992	1966415	Cerep_001081	Clc1ccc(cc1)C2(CCC2)C(=O)NNC(=O)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G04	compound treatment	0.8	0.0103	0.14	0.708	-0.00134	-0.02	0.0856	0.6089	1966416	Cerep_001082	OC(=O)CC1(CC(=O)N2CCN(CC2)c3ccc(Cl)cc3)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G05	compound treatment	0.776	-0.0137	-0.18	0.659	-0.0503	-0.69	-0.6158	-0.8663	1966417	Cerep_001083	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G06	compound treatment	0.797	0.00734	0.1	0.693	-0.0163	-0.22	-0.0876	-0.3593	1966418	Cerep_001084	OC(=O)C1C(C2CC1C=C2)C(=O)N3CCCN(CC3)c4ncc(cc4Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G07	compound treatment	0.785	-0.00466	-0.06	0.721	0.0117	0.16	0.0679	0.3971	1966419	Cerep_001085	COc1cc(CN2CCC(C2)NC(=O)c3ccccc3COC(=O)c4ccccc4)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G08	compound treatment	0.778	-0.0117	-0.16	0.697	-0.0123	-0.17	-0.2303	-0.9994	1966420	Cerep_001086	CC(N1CCN(CC1)C(=O)C2(C)CCC(C(=O)O)C2(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G09	compound treatment	0.79	3.35E-4	0.0	0.715	0.00566	0.08	0.0577	0.7473	1966421	Cerep_001087	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)Nc3ccc(Br)cn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G10	compound treatment	0.754	-0.0357	-0.48	0.71	6.55E-4	0.01	-0.3339	-0.6939	1966422	Cerep_001088	O=C(NNC(=O)c1ccc(cc1)c2ccccc2)OCC3CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G11	compound treatment	0.785	-0.00466	-0.06	0.712	0.00266	0.04	-0.0189	-0.2603	1966423	Cerep_001089	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NCCCn3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G12	compound treatment	0.79	3.35E-4	0.0	0.712	0.00266	0.04	0.0288	0.7893	1966424	Cerep_001090	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCN3CNC(=S)NC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G13	compound treatment	0.782	-0.00766	-0.1	0.696	-0.0133	-0.18	-0.2018	-0.9641	1966425	Cerep_001091	O=C(C(c1ccccc1)n2cccc2)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G14	compound treatment	0.783	-0.00666	-0.09	0.722	0.0127	0.17	0.0585	0.3004	1966426	Cerep_001092	COc1ccc(CNC(=O)OCCN2CCN(Cc3cc4OCOc4c(OC)c3)CC2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G15	compound treatment	0.789	-6.65E-4	-0.01	0.702	-0.00734	-0.1	-0.0772	-0.7673	1966427	Cerep_001093	Clc1ccc(CN2CCCN(CC2)C(=O)c3cn[nH]c3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G16	compound treatment	0.792	0.00234	0.03	0.713	0.00366	0.05	0.0575	0.9755	1966428	Cerep_001094	Oc1ccccc1C(=O)NNC(=O)OCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G17	compound treatment	0.818	0.0283	0.38	0.74	0.0307	0.42	0.5659	0.999	1966429	Cerep_001095	CC(C)(C)OC(=O)C(CCCNC(=O)OCc1ccccc1)NC(=O)c2ccccc2COC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G18	compound treatment	0.811	0.0213	0.29	0.69	-0.0193	-0.26	0.017	0.0435	1966430	Cerep_001096	CCOC(=O)c1c(SC)nc2c(Cl)cccc2c1N(C)CCOC(=O)N3CCC(O)(CC3)c4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G19	compound treatment	0.802	0.0123	0.17	0.702	-0.00734	-0.1	0.0468	0.2412	1966431	Cerep_001097	COc1cccc(CN2CCC(C2)NC(=O)c3cccc(c3)C(F)(F)F)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G20	compound treatment	0.79	3.35E-4	0.0	0.709	-3.45E-4	0.0	-1.0E-4	-0.0192	1966432	Cerep_001098	CC(CCOC(=O)NCCc1ccccc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G21	compound treatment	0.808	0.0183	0.25	0.717	0.00766	0.1	0.2487	0.9264	1966433	Cerep_001099	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NC3CCOC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	G22	compound treatment	0.791	0.00134	0.02	0.726	0.0167	0.23	0.1733	0.7608	1966434	Cerep_001100	CCN(CC)CCCNC(=O)OCC#Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H03	compound treatment	0.793	0.00334	0.04	0.704	-0.00534	-0.07	-0.0197	-0.2302	1966435	Cerep_001101	CCCCN(CCCC)CCNC(=O)OCCN1CCN(Cc2cc3ccccc3o2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H04	compound treatment	0.764	-0.0257	-0.35	0.69	-0.0193	-0.26	-0.4314	-0.991	1966436	Cerep_001102	COc1ccccc1C(=O)N2CCCC2COC(=O)NCc3ccc(cc3)c4csnn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H05	compound treatment	0.803	0.0133	0.18	0.724	0.0147	0.2	0.2685	0.9986	1966437	Cerep_001103	Clc1ccc(CCOC(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H06	compound treatment	0.778	-0.0117	-0.16	0.702	-0.00734	-0.1	-0.1821	-0.9762	1966438	Cerep_001104	CC(C)(C)c1ccc(cc1)C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H07	compound treatment	0.8	0.0103	0.14	0.727	0.0177	0.24	0.2688	0.9663	1966439	Cerep_001105	CC1CN(CCN1c2cccc(C)c2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H08	compound treatment	0.782	-0.00766	-0.1	0.693	-0.0163	-0.22	-0.2307	-0.939	1966440	Cerep_001106	Clc1ccc2[nH]cc(CCNC(=O)OCC3CCCN(Cc4ccc(cc4)N(CCC#N)CCC#N)C3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H09	compound treatment	0.807	0.0173	0.23	0.715	0.00566	0.08	0.2199	0.893	1966441	Cerep_001107	[O-][N+](=O)c1cc(CN2CCC(C2)NC(=O)OCCn3cccc3)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H10	compound treatment	0.791	0.00134	0.02	0.75	0.0407	0.55	0.4048	0.7297	1966442	Cerep_001108	O=C(Nc1ccc2ccccc2c1)C3CCCN3C(=O)OCC4CCCN(Cc5ccc6ccccc6c5)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H11	compound treatment	0.785	-0.00466	-0.06	0.706	-0.00334	-0.05	-0.0767	-0.9875	1966443	Cerep_001109	O=C(NNC(=O)c1ccncc1)OCCSCc2ccc3nonc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H12	compound treatment	0.764	-0.0257	-0.35	0.661	-0.0483	-0.66	-0.711	-0.9548	1966444	Cerep_001110	COc1ccccc1C(=O)N2CCCC2COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H13	compound treatment	0.785	-0.00466	-0.06	0.729	0.0197	0.27	0.145	0.5268	1966445	Cerep_001111	COc1cccc(CCOC(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H14	compound treatment	0.786	-0.00366	-0.05	0.699	-0.0103	-0.14	-0.1347	-0.9012	1966446	Cerep_001112	Clc1ccccc1CCNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H15	compound treatment	0.795	0.00534	0.07	0.697	-0.0123	-0.17	-0.0681	-0.3722	1966447	Cerep_001113	[O-][N+](=O)c1ccc(CCCCOC(=O)N2CCC3(CC2)OCCCO3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H16	compound treatment	0.757	-0.0327	-0.44	0.703	-0.00634	-0.09	-0.3728	-0.8301	1966448	Cerep_001114	O=C(NCc1ccc(cc1)c2csnn2)OCCc3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H17	compound treatment	0.773	-0.0167	-0.22	0.74	0.0307	0.42	0.1366	0.2878	1966449	Cerep_001115	Cc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)CC2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H18	compound treatment	0.736	-0.0537	-0.72	0.706	-0.00334	-0.05	-0.5442	-0.7502	1966450	Cerep_001116	Clc1ccc2Sc3ccccc3N(CCCN4CCN(CCOC(=O)NNC(=O)/C=C/c5ccco5)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H19	compound treatment	0.809	0.0193	0.26	0.737	0.0277	0.38	0.4511	0.9838	1966451	Cerep_001117	CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)OCCc3c[nH]c4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H20	compound treatment	0.791	0.00134	0.02	0.685	-0.0243	-0.33	-0.222	-0.6678	1966452	Cerep_001118	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H21	compound treatment	0.792	0.00234	0.03	0.716	0.00666	0.09	0.0865	0.8999	1966453	Cerep_001119	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCCCc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	H22	compound treatment	0.789	-6.65E-4	-0.01	0.708	-0.00134	-0.02	-0.0193	-0.9458	1966454	Cerep_001120	O=C(Nc1ccc2ccccc2c1)C3CCCN3C(=O)OCc4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I03	compound treatment	0.79	3.35E-4	0.0	0.721	0.0117	0.16	0.1156	0.7269	1966455	Cerep_001121	OC(CNC(=O)CCC(=O)Nc1ccc(Br)cn1)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I04	compound treatment	0.771	-0.0187	-0.25	0.729	0.0197	0.27	0.0115	0.0312	1966456	Cerep_001122	CC(CC(=O)O)CC(=O)N1CCN(CC1)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I05	compound treatment	0.786	-0.00366	-0.05	0.717	0.00766	0.1	0.0389	0.3364	1966457	Cerep_001123	COc1ccc(cc1OCc2ccccc2)C(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I06	compound treatment	0.778	-0.0117	-0.16	0.694	-0.0153	-0.21	-0.2592	-0.9901	1966458	Cerep_001124	OC(=O)C1C(C2CC1C=C2)C(=O)N3CCCC3C(=O)Nc4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I07	compound treatment	0.781	-0.00866	-0.12	0.709	-3.45E-4	0.0	-0.086	-0.735	1966459	Cerep_001125	O=C(CCC(=O)c1ccccc1)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I08	compound treatment	0.796	0.00634	0.09	0.707	-0.00234	-0.03	0.0378	0.4145	1966460	Cerep_001126	CC1(C)C(CCC1(C)C(=O)N2CCN(CC2)c3cccc4[nH]ccc34)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I09	compound treatment	0.788	-0.00166	-0.02	0.708	-0.00134	-0.02	-0.0288	-0.9949	1966461	Cerep_001127	Cc1sc(nc1CC(=O)NNC(=O)/C=C/c2ccco2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I10	compound treatment	0.788	-0.00166	-0.02	0.701	-0.00834	-0.11	-0.0963	-0.8306	1966462	Cerep_001128	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC3COC(C)(C)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I11	compound treatment	0.791	0.00134	0.02	0.698	-0.0113	-0.15	-0.0967	-0.6206	1966463	Cerep_001129	Cn1c(CCC(=O)NNC(=O)c2ccco2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I12	compound treatment	0.811	0.0213	0.29	0.709	-3.45E-4	0.0	0.2002	0.6955	1966464	Cerep_001130	[O-][N+](=O)c1ccc(NCCNC(=O)OCc2ccc(C#Cc3ccccc3)s2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I13	compound treatment	0.782	-0.00766	-0.1	0.689	-0.0203	-0.28	-0.2693	-0.9095	1966465	Cerep_001131	CCN1CC(CN1CC)NC(=O)C2Cc3ccccc3CN2C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I14	compound treatment	0.804	0.0143	0.19	0.711	0.00166	0.02	0.1527	0.7843	1966466	Cerep_001132	CN(C)c1ccc(CN2CCN(CCOC(=O)NCc3ccc4OCCc4c3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I15	compound treatment	0.79	3.35E-4	0.0	0.696	-0.0133	-0.18	-0.1255	-0.6893	1966467	Cerep_001133	Cc1oc(nc1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC(C)(C)C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I16	compound treatment	0.779	-0.0107	-0.14	0.735	0.0257	0.35	0.1456	0.385	1966468	Cerep_001134	Cc1ccccc1COC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I17	compound treatment	0.816	0.0263	0.36	0.707	-0.00234	-0.03	0.2286	0.6409	1966469	Cerep_001135	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)c3ccc4nsnc4c3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I18	compound treatment	0.797	0.00734	0.1	0.717	0.00766	0.1	0.1438	0.9996	1966470	Cerep_001136	Clc1ccc(Cl)c(c1)C(=O)NNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I19	compound treatment	0.8	0.0103	0.14	0.71	6.55E-4	0.01	0.1049	0.7509	1966471	Cerep_001137	COc1ccccc1CNC(=O)c2csc(n2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I20	compound treatment	0.788	-0.00166	-0.02	0.72	0.0107	0.15	0.0869	0.5908	1966472	Cerep_001138	FC(F)(F)c1cccc(/C=C/C(=O)NNC(=O)OCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I21	compound treatment	0.833	0.0433	0.58	0.7	-0.00934	-0.13	0.3233	0.5403	1966473	Cerep_001139	FC(F)(F)c1cc(CNC(=O)CCC(=O)c2ccccc2)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	I22	compound treatment	0.82	0.0303	0.41	0.731	0.0217	0.3	0.4982	0.9872	1966474	Cerep_001140	[O-][N+](=O)c1cccc(c1)c2nnn(CC(=O)NNC(=O)OC/C=C/COCc3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J03	compound treatment	0.797	0.00734	0.1	0.701	-0.00834	-0.11	-0.0105	-0.0696	1966475	Cerep_001141	CC(C)Oc1ccc(CN2CCCCC2COC(=O)NCc3ccc4OCCc4c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J04	compound treatment	0.773	-0.0167	-0.22	0.703	-0.00634	-0.09	-0.2201	-0.9139	1966476	Cerep_001142	COc1ccc2ccccc2c1CN3CCCC(COC(=O)NC(Cc4c[nH]c5ccccc45)C(=O)OC(C)(C)C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J05	compound treatment	0.774	-0.0157	-0.21	0.706	-0.00334	-0.05	-0.1817	-0.8404	1966477	Cerep_001143	COc1cc(CCNC(=O)OCCC(C)c2ccccc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J06	compound treatment	0.771	-0.0187	-0.25	0.714	0.00466	0.06	-0.1332	-0.5128	1966478	Cerep_001144	CCCCCCC#CCOC(=O)NC1CCN(Cc2ccc(Cl)c(c2)[N+](=O)[O-])C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J07	compound treatment	0.786	-0.00366	-0.05	0.711	0.00166	0.02	-0.019	-0.3496	1966479	Cerep_001145	CCCCCCC#CCOC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J08	compound treatment	0.795	0.00534	0.07	0.699	-0.0103	-0.14	-0.0489	-0.3085	1966480	Cerep_001146	Fc1ccccc1CCOC(=O)NNC(=O)c2csc(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J09	compound treatment	0.787	-0.00266	-0.04	0.72	0.0107	0.15	0.0773	0.5166	1966481	Cerep_001147	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J10	compound treatment	0.779	-0.0107	-0.14	0.711	0.00166	0.02	-0.0858	-0.589	1966482	Cerep_001148	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)c3scc(C)c3n4cccc4)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J11	compound treatment	0.815	0.0253	0.34	0.723	0.0137	0.19	0.3734	0.9592	1966483	Cerep_001149	Cc1nc(sc1C(=O)NNC(=O)OCc2ccc(C#Cc3ccccc3)s2)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J12	compound treatment	0.767	-0.0227	-0.31	0.699	-0.0103	-0.14	-0.316	-0.9383	1966484	Cerep_001150	CN(C)c1ccc(CN2CCCCC2COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J13	compound treatment	0.774	-0.0157	-0.21	0.72	0.0107	0.15	-0.0467	-0.1821	1966485	Cerep_001151	Cc1cccc(CCOC(=O)NNC(=O)/C=C/c2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J14	compound treatment	0.788	-0.00166	-0.02	0.702	-0.00734	-0.1	-0.0867	-0.8447	1966486	Cerep_001152	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J15	compound treatment	0.826	0.0363	0.49	0.751	0.0417	0.57	0.7483	0.9973	1966487	Cerep_001153	Cc1noc(c2cccs2)c1C(=O)NNC(=O)OCc3nc(cs3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J16	compound treatment	0.764	-0.0257	-0.35	0.694	-0.0153	-0.21	-0.3928	-0.9709	1966488	Cerep_001154	Cc1ccc2[nH]cc(CCNC(=O)OCC3CCCCN3Cc4ccccc4SC(C)(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J17	compound treatment	0.791	0.00134	0.02	0.709	-3.45E-4	0.0	0.0094	0.5056	1966489	Cerep_001155	COc1ccc(cc1)C(=O)NNC(=O)OC/C=C(/C)\Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J18	compound treatment	0.769	-0.0207	-0.28	0.668	-0.0413	-0.56	-0.5958	-0.9473	1966490	Cerep_001156	Fc1cccc(Cl)c1CN2CCC(C2)NC(=O)OCC3COC4(CCCCC4)O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J19	compound treatment	0.825	0.0353	0.48	0.721	0.0117	0.16	0.4495	0.8945	1966491	Cerep_001157	O=C(NCC1(CC2CC3CC(C2)C1)C3)OCCN4CCN(Cc5cc6ccccc6o5)CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J20	compound treatment	0.796	0.00634	0.09	0.664	-0.0453	-0.62	-0.3768	-0.6036	1966492	Cerep_001158	COc1ccc(cc1)C(=O)NNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J21	compound treatment	0.823	0.0333	0.45	0.741	0.0317	0.43	0.6232	0.9998	1966493	Cerep_001159	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCc4ccsc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	J22	compound treatment	0.753	-0.0367	-0.49	0.717	0.00766	0.1	-0.2759	-0.5459	1966494	Cerep_001160	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K03	compound treatment	0.818	0.0283	0.38	0.679	-0.0303	-0.41	-0.0223	-0.0396	1966495	Cerep_001161	COc1cc(cc(OC)c1OC)C(=O)NNC(=O)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K04	compound treatment	0.806	0.0163	0.22	0.737	0.0277	0.38	0.4225	0.9673	1966496	Cerep_001162	COc1ccc(OC)c(c1)C2N(CCc3c2[nH]c4ccccc34)C(=O)CC(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K05	compound treatment	0.769	-0.0207	-0.28	0.689	-0.0203	-0.28	-0.3933	-1.0	1966497	Cerep_001163	Cc1cc([nH]n1)C(=O)NNC(=O)CC(NC(=O)OC(C)(C)C)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K06	compound treatment	0.799	0.00934	0.13	0.698	-0.0113	-0.15	-0.0203	-0.102	1966498	Cerep_001164	CN(C1CCN(Cc2c(F)cccc2Cl)C1)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K07	compound treatment	0.779	-0.0107	-0.14	0.732	0.0227	0.31	0.1167	0.3425	1966499	Cerep_001165	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K08	compound treatment	0.791	0.00134	0.02	0.741	0.0317	0.43	0.318	0.736	1966500	Cerep_001166	Cc1ccc(cc1)N2CCN(CC2)C(=O)C3(C)CCC(C(=O)O)C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K09	compound treatment	0.764	-0.0257	-0.35	0.711	0.00166	0.02	-0.2289	-0.6596	1966501	Cerep_001167	O=C(N1CCN(C/C=C/c2ccccc2)CC1)c3ccc(CSc4ccccn4)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K10	compound treatment	0.811	0.0213	0.29	0.718	0.00866	0.12	0.287	0.9225	1966502	Cerep_001168	O=C(NNC(=O)c1cc2ccccc2s1)OCc3cccc(Oc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K11	compound treatment	0.799	0.00934	0.13	0.71	6.55E-4	0.01	0.0954	0.7554	1966503	Cerep_001169	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2noc(C)c2c3csc(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K12	compound treatment	0.806	0.0163	0.22	0.726	0.0167	0.23	0.3164	0.9999	1966504	Cerep_001170	Clc1ccc(cc1)c2csc(COC(=O)NCc3cccnc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K13	compound treatment	0.777	-0.0127	-0.17	0.7	-0.00934	-0.13	-0.2109	-0.9896	1966505	Cerep_001171	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)Cc3c(Cl)cccc3Cl)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K14	compound treatment	0.774	-0.0157	-0.21	0.698	-0.0113	-0.15	-0.2588	-0.9882	1966506	Cerep_001172	CCN(Cc1ccncc1)C(=O)C(COC(=O)N2CCN(CC2)c3cc(OC)cc(OC)c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K15	compound treatment	0.826	0.0363	0.49	0.745	0.0357	0.49	0.6904	1.0	1966507	Cerep_001173	CC(C)(C)OC(=O)NC(CC(=O)NNC(=O)c1ccc2nsnc2c1)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K16	compound treatment	0.796	0.00634	0.09	0.725	0.0157	0.21	0.2114	0.9193	1966508	Cerep_001174	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3cccc(C)c3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K17	compound treatment	0.805	0.0153	0.21	0.693	-0.0163	-0.22	-0.0113	-0.0372	1966509	Cerep_001175	COc1ccc(OCCNC(=O)c2ccccc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K18	compound treatment	0.819	0.0293	0.4	0.698	-0.0113	-0.15	0.1704	0.4011	1966510	Cerep_001176	COc1ccccc1CCOC(=O)NCCNC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K19	compound treatment	0.812	0.0223	0.3	0.732	0.0227	0.31	0.4315	0.9999	1966511	Cerep_001177	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2c(C)onc2c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K20	compound treatment	0.795	0.00534	0.07	0.72	0.0107	0.15	0.1536	0.9475	1966512	Cerep_001178	COc1ccc(CCCOC(=O)Nc2ccc(NC(=O)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K21	compound treatment	0.805	0.0153	0.21	0.707	-0.00234	-0.03	0.1237	0.5908	1966513	Cerep_001179	CC(C)(C)OC(=O)NC(CCCCNC(=O)c1cccnc1)C(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	K22	compound treatment	0.815	0.0253	0.34	0.711	0.00166	0.02	0.2576	0.7522	1966514	Cerep_001180	O=C(OCC1CCC1)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L03	compound treatment	0.807	0.0173	0.23	0.725	0.0157	0.21	0.3163	0.999	1966515	Cerep_001181	O=C(OCC1CCCN(Cc2ccc3ccccc3c2)C1)N4CCN(CC4)C(=O)OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L04	compound treatment	0.768	-0.0217	-0.29	0.691	-0.0183	-0.25	-0.3836	-0.997	1966516	Cerep_001182	FC(F)(F)Sc1ccccc1COC(=O)NCCc2c[nH]c3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L05	compound treatment	0.802	0.0123	0.17	0.678	-0.0313	-0.43	-0.1846	-0.4024	1966517	Cerep_001183	COc1ccc(OCCNC(=O)OCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L06	compound treatment	0.785	-0.00466	-0.06	0.704	-0.00534	-0.07	-0.096	-0.9973	1966518	Cerep_001184	Cc1ccccc1CCOC(=O)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L07	compound treatment	0.781	-0.00866	-0.12	0.7	-0.00934	-0.13	-0.1728	-0.9991	1966519	Cerep_001185	Clc1ccc(cc1)C(NC(=O)OCCCc2ccncc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L08	compound treatment	0.776	-0.0137	-0.18	0.695	-0.0143	-0.2	-0.2687	-0.9996	1966520	Cerep_001186	FC(F)(F)c1cccc(/C=C/C(=O)NNC(=O)OCCc2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L09	compound treatment	0.8	0.0103	0.14	0.716	0.00666	0.09	0.1628	0.9784	1966521	Cerep_001187	CCOc1ccsc1C(=O)NNC(=O)OCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L10	compound treatment	0.79	3.35E-4	0.0	0.721	0.0117	0.16	0.1156	0.7269	1966522	Cerep_001188	O=C(OCc1ccccc1)C2CCCN2C(=O)OCCc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L11	compound treatment	0.789	-6.65E-4	-0.01	0.71	6.55E-4	0.01	0.0	-0.0018	1966523	Cerep_001189	CCOc1ccsc1C(=O)NNC(=O)OCc2ccc(C#CC(C)(C)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L12	compound treatment	0.774	-0.0157	-0.21	0.682	-0.0273	-0.37	-0.4131	-0.9638	1966524	Cerep_001190	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCCc3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L13	compound treatment	0.802	0.0123	0.17	0.712	0.00266	0.04	0.1433	0.8413	1966525	Cerep_001191	Cc1nn(c(C)c1CN2CCC(C2)NC(=O)OCCc3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L14	compound treatment	0.78	-0.00966	-0.13	0.679	-0.0303	-0.41	-0.3848	-0.8869	1966526	Cerep_001192	COc1ccc(CCNC(=O)OCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L15	compound treatment	0.787	-0.00266	-0.04	0.716	0.00666	0.09	0.0388	0.397	1966527	Cerep_001193	Cc1nc(sc1C(=O)NNC(=O)OCCN(Cc2ccccc2)Cc3ccccc3)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L16	compound treatment	0.765	-0.0247	-0.33	0.68	-0.0293	-0.4	-0.5182	-0.9958	1966528	Cerep_001194	CCOc1cccc(c1)C(=O)NNC(=O)OCCN2CCN(Cc3cc4OCOc4c(OC)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L17	compound treatment	0.793	0.00334	0.04	0.701	-0.00834	-0.11	-0.0486	-0.3975	1966529	Cerep_001195	CC(COC(=O)NNC(=O)c1ccc(Cl)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L18	compound treatment	0.763	-0.0267	-0.36	0.679	-0.0303	-0.41	-0.547	-0.9976	1966530	Cerep_001196	CC(COC(=O)NNC(=O)CC1Sc2ccccc2NC1=O)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L19	compound treatment	0.807	0.0173	0.23	0.691	-0.0183	-0.25	-0.0115	-0.0336	1966531	Cerep_001197	CC(C)Oc1ccc(CN2CCCCC2COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L20	compound treatment	0.775	-0.0147	-0.2	0.72	0.0107	0.15	-0.0371	-0.1513	1966532	Cerep_001198	COc1ccc(CCCOC(=O)N2CCN(CC2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L21	compound treatment	0.818	0.0283	0.38	0.716	0.00666	0.09	0.3345	0.8513	1966533	Cerep_001199	CCCC#CCCOC(=O)NNC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	L22	compound treatment	0.809	0.0193	0.26	0.71	6.55E-4	0.01	0.1908	0.7309	1966534	Cerep_001200	COc1ccc(Br)cc1COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M03	compound treatment	0.786	-0.00366	-0.05	0.716	0.00666	0.09	0.0292	0.2827	1966535	Cerep_001201	CN(C)CCCN(C)C(=O)CCc1c[nH]c2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M04	compound treatment	0.828	0.0383	0.52	0.679	-0.0303	-0.41	0.0731	0.1104	1966536	Cerep_001202	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)CC(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M05	compound treatment	0.79	3.35E-4	0.0	0.698	-0.0113	-0.15	-0.1062	-0.6861	1966537	Cerep_001203	CC(Oc1ccc(Cl)cc1C)C(=O)NNC(=O)c2cccc(c2)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M06	compound treatment	0.783	-0.00666	-0.09	0.707	-0.00234	-0.03	-0.0862	-0.9032	1966538	Cerep_001204	OC(=O)C1CC1C(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M07	compound treatment	0.806	0.0163	0.22	0.728	0.0187	0.25	0.3357	0.9974	1966539	Cerep_001205	Cc1ccc(cc1)C(=O)NCC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M08	compound treatment	0.792	0.00234	0.03	0.759	0.0497	0.68	0.5011	0.7392	1966540	Cerep_001206	CC1(C)C(CCC1(C)C(=O)N2CCCN(CC2)c3ncc(cc3Cl)C(F)(F)F)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M09	compound treatment	0.815	0.0253	0.34	0.703	-0.00634	-0.09	0.1805	0.512	1966541	Cerep_001207	CCOC(=O)N1CCN(CC1)C(=O)c2csc(n2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M10	compound treatment	0.805	0.0153	0.21	0.7	-0.00934	-0.13	0.0562	0.2312	1966542	Cerep_001208	O=C(CC1Sc2ccccc2NC1=O)NNC(=O)OCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M11	compound treatment	0.795	0.00534	0.07	0.676	-0.0333	-0.45	-0.2706	-0.5879	1966543	Cerep_001209	O=C(NCC1CCCCC1)c2ccsc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M12	compound treatment	0.809	0.0193	0.26	0.714	0.00466	0.06	0.2293	0.8543	1966544	Cerep_001210	O=C(OCCC1CCCC1)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M13	compound treatment	0.767	-0.0227	-0.31	0.717	0.00766	0.1	-0.1424	-0.4407	1966545	Cerep_001211	O=C(NCCc1ccc(Oc2ccccc2)cc1)c3ccc(CSc4ccccn4)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M14	compound treatment	0.814	0.0243	0.33	0.737	0.0277	0.38	0.4988	0.9976	1966546	Cerep_001212	CSc1ncc(C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M15	compound treatment	0.76	-0.0297	-0.4	0.711	0.00166	0.02	-0.267	-0.6662	1966547	Cerep_001213	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)c3cccc(c3)S(=O)(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M16	compound treatment	0.803	0.0133	0.18	0.698	-0.0113	-0.15	0.0178	0.0751	1966548	Cerep_001214	ON1CCC(COC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M17	compound treatment	0.797	0.00734	0.1	0.719	0.00966	0.13	0.1631	0.9901	1966549	Cerep_001215	Cc1cc([nH]n1)C(=O)NNC(=O)c2cc(F)cc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M18	compound treatment	0.803	0.0133	0.18	0.716	0.00666	0.09	0.1914	0.9498	1966550	Cerep_001216	CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)OCCc1cccc(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M19	compound treatment	0.806	0.0163	0.22	0.709	-3.45E-4	0.0	0.1525	0.6919	1966551	Cerep_001217	COc1ccc2[nH]cc(CCNC(=O)c3ccsc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M20	compound treatment	0.807	0.0173	0.23	0.711	0.00166	0.02	0.1813	0.7718	1966552	Cerep_001218	O=C(NNC(=O)c1cccc2ccccc12)OCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M21	compound treatment	0.815	0.0253	0.34	0.726	0.0167	0.23	0.4023	0.9803	1966553	Cerep_001219	CC(OCc1ccccc1)C(NC(=O)CC2Cc3ccccc3C2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	M22	compound treatment	0.814	0.0243	0.33	0.74	0.0307	0.42	0.5277	0.9929	1966554	Cerep_001220	COc1cc(CCNC(=O)OCC2CC2(Cl)Cl)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N03	compound treatment	0.822	0.0323	0.44	0.716	0.00666	0.09	0.3726	0.8363	1966555	Cerep_001221	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)COc3cccc4CC(C)(C)Oc43)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N04	compound treatment	0.798	0.00834	0.11	0.719	0.00966	0.13	0.1726	0.9969	1966556	Cerep_001222	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCCc3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N05	compound treatment	0.805	0.0153	0.21	0.714	0.00466	0.06	0.1912	0.8834	1966557	Cerep_001223	COc1ccc(CCCOC(=O)N2CCN(CC2)c3ccccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N06	compound treatment	0.784	-0.00566	-0.08	0.701	-0.00834	-0.11	-0.1345	-0.9812	1966558	Cerep_001224	Fc1ccc(/C=C/C(=O)NNC(=O)OCCCc2ccncc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N07	compound treatment	0.774	-0.0157	-0.21	0.763	0.0537	0.73	0.3679	0.4831	1966559	Cerep_001225	Fc1ccc(cc1)N2CCN(CC2)C(=O)OCC3(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N08	compound treatment	0.742	-0.0477	-0.64	0.722	0.0127	0.17	-0.3327	-0.4997	1966560	Cerep_001226	COc1ccccc1CCOC(=O)NCC2CCCCC2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N09	compound treatment	0.776	-0.0137	-0.18	0.735	0.0257	0.35	0.117	0.2959	1966561	Cerep_001227	O=C(NNC(=O)c1ccccc1n2cccc2)OCC3COc4ccccc4O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N10	compound treatment	0.779	-0.0107	-0.14	0.682	-0.0273	-0.37	-0.3654	-0.9142	1966562	Cerep_001228	Cc1ccc(C)c(c1)N2CCN(CC2)C(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N11	compound treatment	0.808	0.0183	0.25	0.745	0.0357	0.49	0.5187	0.9509	1966563	Cerep_001229	CC(C)(C)OC(=O)N(CCOC(=O)NNC(=O)c1nccc2ccccc12)C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N12	compound treatment	0.787	-0.00266	-0.04	0.703	-0.00634	-0.09	-0.0866	-0.9243	1966564	Cerep_001230	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccccc4SC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N13	compound treatment	0.824	0.0343	0.46	0.702	-0.00734	-0.1	0.2567	0.5417	1966565	Cerep_001231	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N14	compound treatment	0.812	0.0223	0.3	0.729	0.0197	0.27	0.4026	0.9983	1966566	Cerep_001232	COc1ccc(CCNC(=O)OCCc2cccc(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N15	compound treatment	0.738	-0.0517	-0.7	0.711	0.00166	0.02	-0.4769	-0.6839	1966567	Cerep_001233	COc1ccccc1C(=O)N2CCCC2COC(=O)N3CCCC3C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N16	compound treatment	0.787	-0.00266	-0.04	0.681	-0.0283	-0.39	-0.2987	-0.7695	1966568	Cerep_001234	C=CCOc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N17	compound treatment	0.819	0.0293	0.4	0.694	-0.0153	-0.21	0.1319	0.2946	1966569	Cerep_001235	COc1cc(ccc1O)C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N18	compound treatment	0.786	-0.00366	-0.05	0.702	-0.00734	-0.1	-0.1058	-0.947	1966570	Cerep_001236	COc1ccc(N2CCN(CC2)C(=O)OCCSCc3ccc4nonc4c3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N19	compound treatment	0.78	-0.00966	-0.13	0.698	-0.0113	-0.15	-0.2016	-0.9964	1966571	Cerep_001237	CC(NC(=O)OCC1CCCN(Cc2ccc3ccccc3c2)C1)c4cccc5OCCOc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N20	compound treatment	0.777	-0.0127	-0.17	0.723	0.0137	0.19	0.0109	0.043	1966572	Cerep_001238	CC(=CC1C(CNC(=O)OCc2ccc(cc2)C(C)(C)C)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N21	compound treatment	0.809	0.0193	0.26	0.724	0.0147	0.2	0.3258	0.9913	1966573	Cerep_001239	Clc1ccc(cc1)N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	N22	compound treatment	0.766	-0.0237	-0.32	0.701	-0.00834	-0.11	-0.3062	-0.9035	1966574	Cerep_001240	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O03	compound treatment	0.794	0.00434	0.06	0.703	-0.00634	-0.09	-0.0198	-0.1898	1966575	Cerep_001241	OCCCCN(Cc1ccccc1)C(=O)c2ccc3[nH]nnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O04	compound treatment	0.791	0.00134	0.02	0.713	0.00366	0.05	0.048	0.9054	1966576	Cerep_001242	CC(CC(=O)O)CC(=O)N1CCC(=CC1)n2c(=O)[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O05	compound treatment	0.828	0.0383	0.52	0.705	-0.00434	-0.06	0.3238	0.622	1966577	Cerep_001243	FC(F)(F)c1cccc(c1)C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O06	compound treatment	0.805	0.0153	0.21	0.702	-0.00734	-0.1	0.0755	0.3283	1966578	Cerep_001244	OC(=O)C1CC1C(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O07	compound treatment	0.783	-0.00666	-0.09	0.739	0.0297	0.4	0.2224	0.5368	1966579	Cerep_001245	CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)CC1Cc2ccccc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O08	compound treatment	0.815	0.0253	0.34	0.72	0.0107	0.15	0.3444	0.9274	1966580	Cerep_001246	Cc1ccc(N2CCN(CC2)C(=O)C3(C)CCC(C(=O)O)C3(C)C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O09	compound treatment	0.867	0.0773	1.04	0.792	0.0827	1.13	1.5347	0.9993	1966581	Cerep_001247	CCCCCCc1ccc(cc1)C(=O)NNC(=O)C(C)n2nnc(n2)c3cc(cc(c3)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O10	compound treatment	0.781	-0.00866	-0.12	0.697	-0.0123	-0.17	-0.2017	-0.9841	1966582	Cerep_001248	CC1CC1COC(=O)NNC(=O)c2noc(C)c2c3csc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O11	compound treatment	0.801	0.0113	0.15	0.707	-0.00234	-0.03	0.0855	0.5474	1966583	Cerep_001249	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O12	compound treatment	0.813	0.0233	0.31	0.737	0.0277	0.38	0.4893	0.996	1966584	Cerep_001250	FC(F)(F)c1ccc2Sc3ccccc3N(CCCN4CCN(CCOC(=O)N5CCN(Cc6ccco6)CC5)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O13	compound treatment	0.775	-0.0147	-0.2	0.702	-0.00734	-0.1	-0.2107	-0.9503	1966585	Cerep_001251	Cn1c(CCC(=O)NNC(=O)c2cc3ccccc3s2)nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O14	compound treatment	0.79	3.35E-4	0.0	0.724	0.0147	0.2	0.1445	0.7229	1966586	Cerep_001252	COc1ccc(CN2CCCC(COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)C2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O15	compound treatment	0.838	0.0483	0.65	0.699	-0.0103	-0.14	0.3613	0.5416	1966587	Cerep_001253	CSc1sc(C(=O)NNC(=O)c2cccc(c2)C(F)(F)F)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O16	compound treatment	0.812	0.0223	0.3	0.723	0.0137	0.19	0.3447	0.9732	1966588	Cerep_001254	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O17	compound treatment	0.809	0.0193	0.26	0.731	0.0217	0.3	0.3933	0.9981	1966589	Cerep_001255	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCC(CC3)(C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O18	compound treatment	0.795	0.00534	0.07	0.708	-0.00134	-0.02	0.0379	0.5106	1966590	Cerep_001256	COc1cccc(CCOC(=O)NC(C)C(=O)Nc2ccc3ccccc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O19	compound treatment	0.82	0.0303	0.41	0.716	0.00666	0.09	0.3536	0.8434	1966591	Cerep_001257	O=C(N1CCC2(CC1)N(CNC2=O)c3ccccc3)c4ccc(cc4)n5nc(cc5c6ccccc6)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O20	compound treatment	0.79	3.35E-4	0.0	0.702	-0.00734	-0.1	-0.0676	-0.6745	1966592	Cerep_001258	O=C(NCCOc1ccccc1)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O21	compound treatment	0.817	0.0273	0.37	0.733	0.0237	0.32	0.4889	0.9978	1966593	Cerep_001259	Cc1cc([nH]n1)C(=O)NNC(=O)c2cc(C)n(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	O22	compound treatment	0.822	0.0323	0.44	0.736	0.0267	0.36	0.5655	0.9959	1966594	Cerep_001260	COc1ccc2[nH]cc(CCNC(=O)OCc3ccc(F)cc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P03	compound treatment	0.808	0.0183	0.25	0.744	0.0347	0.47	0.5091	0.9544	1966595	Cerep_001261	O=C(NNC(=O)c1nccc2ccccc12)OCCc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P04	compound treatment	0.767	-0.0227	-0.31	0.692	-0.0173	-0.24	-0.3835	-0.9919	1966596	Cerep_001262	CC(C)(C)c1ccc(O)c(NC(=O)OCCC2CCCCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P05	compound treatment	0.804	0.0143	0.19	0.69	-0.0193	-0.26	-0.0498	-0.1522	1966597	Cerep_001263	CCN(CC)Cc1cc(NC(=O)OCCCCCc2ccccc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P06	compound treatment	0.758	-0.0317	-0.43	0.687	-0.0223	-0.3	-0.5175	-0.9863	1966598	Cerep_001264	Oc1ccc(cc1)C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P07	compound treatment	0.77	-0.0197	-0.27	0.72	0.0107	0.15	-0.0848	-0.2805	1966599	Cerep_001265	C/C(=C/COC(=O)N1CCN(CC1)c2ccccc2C)/Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P08	compound treatment	0.756	-0.0337	-0.45	0.7	-0.00934	-0.13	-0.4112	-0.8718	1966600	Cerep_001266	Clc1cccc(CCOC(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P09	compound treatment	0.691	-0.0987	-1.33	0.649	-0.0603	-0.82	-1.5231	-0.9733	1966601	Cerep_001267	OC1(CCN(CC1)C(=O)OCCc2ccc(cc2)[N+](=O)[O-])c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P10	compound treatment	0.052	-0.738	-9.95	0.077	-0.632	-8.62	-13.1342	-0.9975	1966602	Cerep_001268	CC(NC(=O)OCc1ccc(cc1)c2ccccc2)c3cccc4OCCOc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P11	compound treatment	0.771	-0.0187	-0.25	0.706	-0.00334	-0.05	-0.2103	-0.8218	1966603	Cerep_001269	CN1CCN(C)C(C1)C(=O)NNC(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P12	compound treatment	0.747	-0.0427	-0.58	0.705	-0.00434	-0.06	-0.4489	-0.7758	1966604	Cerep_001270	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccc(cc3)N(C)C)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P13	compound treatment	0.778	-0.0117	-0.16	0.727	0.0177	0.24	0.059	0.205	1966605	Cerep_001271	CC(C)(C)c1ccc(O)c(NC(=O)OCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P14	compound treatment	0.791	0.00134	0.02	0.698	-0.0113	-0.15	-0.0967	-0.6206	1966606	Cerep_001272	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P15	compound treatment	0.785	-0.00466	-0.06	0.696	-0.0133	-0.18	-0.1732	-0.8994	1966607	Cerep_001273	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccc(N(C)C)c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P16	compound treatment	0.782	-0.00766	-0.1	0.704	-0.00534	-0.07	-0.1247	-0.9853	1966608	Cerep_001274	O=C(NC1CCCCNC1=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P17	compound treatment	0.792	0.00234	0.03	0.701	-0.00834	-0.11	-0.0582	-0.4928	1966609	Cerep_001275	CCOc1cccc(c1)C(=O)NNC(=O)OCCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P18	compound treatment	0.756	-0.0337	-0.45	0.685	-0.0243	-0.33	-0.5559	-0.9881	1966610	Cerep_001276	O=C(OCc1ccc(C#Cc2ccccc2)s1)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P19	compound treatment	0.779	-0.0107	-0.14	0.701	-0.00834	-0.11	-0.1822	-0.9933	1966611	Cerep_001277	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)c3cc(n[nH]3)C(C)(C)C)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P20	compound treatment	0.767	-0.0227	-0.31	0.689	-0.0203	-0.28	-0.4124	-0.9988	1966612	Cerep_001278	CCN(CC)CCCNC(=O)OCCc1c(C)cc(C)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P21	compound treatment	0.772	-0.0177	-0.24	0.715	0.00566	0.08	-0.114	-0.4551	1966613	Cerep_001279	CCCCCCC#CCOC(=O)NNC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.529	P22	compound treatment	0.752	-0.0377	-0.51	0.714	0.00466	0.06	-0.3144	-0.614	1966614	Cerep_001280	Fc1cccc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A03	compound treatment	0.801	0.0303	0.41	0.731	0.0292	0.4	0.5703	0.9999	1966615	Cerep_001281	CCCCC#CCCOC(=O)NNC(=O)Cc1ccc(OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A04	compound treatment	0.803	0.0323	0.44	0.706	0.00417	0.06	0.3484	0.7926	1966616	Cerep_001282	FC(F)(F)c1c(cnn1c2ccc(Cl)cc2)C(=O)NNC(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A05	compound treatment	0.792	0.0213	0.29	0.709	0.00717	0.1	0.2724	0.8972	1966617	Cerep_001283	Clc1ccc(CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A06	compound treatment	0.818	0.0473	0.64	0.706	0.00417	0.06	0.4915	0.7671	1966618	Cerep_001284	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(OC)c(Br)c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A07	compound treatment	0.792	0.0213	0.29	0.731	0.0292	0.4	0.4845	0.9873	1966619	Cerep_001285	CCOc1ccsc1C(=O)NNC(=O)OCC2C(OC3(C)CCCC(=O)N23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A08	compound treatment	0.795	0.0243	0.33	0.724	0.0222	0.3	0.4456	0.9992	1966620	Cerep_001286	COc1ccc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A09	compound treatment	0.796	0.0253	0.34	0.682	-0.0198	-0.27	0.0502	0.1152	1966621	Cerep_001287	CC(Sc1ccc(Cl)cc1)C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A10	compound treatment	0.776	0.0053	0.07	0.716	0.0142	0.19	0.1872	0.9087	1966622	Cerep_001288	Cc1ccccc1N2CCN(CC2)C(=O)OCCc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A11	compound treatment	0.792	0.0213	0.29	0.703	0.00117	0.02	0.2145	0.7452	1966623	Cerep_001289	CCC/C=C/COC(=O)NNC(=O)c1ccccc1n2cccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A12	compound treatment	0.805	0.0343	0.46	0.737	0.0352	0.48	0.6664	0.9998	1966624	Cerep_001290	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccccc5[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A13	compound treatment	0.769	-0.0017	-0.02	0.707	0.00517	0.07	0.0337	0.4543	1966625	Cerep_001291	Clc1cncc(Cl)c1N2CCN(CC2)C(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A14	compound treatment	0.775	0.0043	0.06	0.677	-0.0248	-0.34	-0.1984	-0.5774	1966626	Cerep_001292	COc1cccc(CCOC(=O)N(C)CCc2ccccn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A15	compound treatment	0.781	0.0103	0.14	0.708	0.00617	0.08	0.1578	0.9711	1966627	Cerep_001293	COc1cc(CN2CCN(CCOC(=O)NNC(=O)CSCc3nc(cs3)c4ccccc4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A16	compound treatment	0.799	0.0283	0.38	0.715	0.0132	0.18	0.397	0.9408	1966628	Cerep_001294	OC1CCCN(C1)C(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A17	compound treatment	0.79	0.0193	0.26	0.711	0.00917	0.13	0.2726	0.9435	1966629	Cerep_001295	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCc3cccc(Cl)c3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A18	compound treatment	0.777	0.0063	0.09	0.711	0.00917	0.13	0.1486	0.9824	1966630	Cerep_001296	CC1(C)Cc2cccc(OCC(=O)NNC(=O)OCC#Cc3ccccc3)c2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A19	compound treatment	0.812	0.0413	0.56	0.714	0.0122	0.17	0.5114	0.8795	1966631	Cerep_001297	O=C(OCc1ccccc1)C2CCCN2C(=O)OCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A20	compound treatment	0.801	0.0303	0.41	0.72	0.0182	0.25	0.4643	0.9712	1966632	Cerep_001298	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cc(ccc3F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A21	compound treatment	0.792	0.0213	0.29	0.731	0.0292	0.4	0.4845	0.9873	1966633	Cerep_001299	O=C(OCc1cccc(OCc2ccccc2)c1)N3CCN(CC3)C(=O)C4COc5ccccc5O4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	A22	compound treatment	0.8	0.0293	0.4	0.722	0.0202	0.28	0.474	0.9843	1966634	Cerep_001300	COc1ccccc1CCOC(=O)NNC(=O)/C=C/c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B03	compound treatment	0.801	0.0303	0.41	0.727	0.0252	0.34	0.5318	0.9962	1966635	Cerep_001301	CC(CNC(=O)OCCCCc1ccc(cc1)[N+](=O)[O-])c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B04	compound treatment	0.735	-0.0357	-0.48	0.68	-0.0218	-0.3	-0.551	-0.9733	1966636	Cerep_001302	CC/1=C(CC(=O)NNC(=O)c2ccc(CSc3ccc(cn3)C(F)(F)F)o2)c4cc(F)ccc4\C1=C/c5ccc(cc5)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B05	compound treatment	0.785	0.0143	0.19	0.754	0.0522	0.71	0.6395	0.8676	1966637	Cerep_001303	CCOc1ccc(cc1)N2CCN(CC2)C(=O)OCCN(Cc3cc4ccccc4c5ccccc35)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B06	compound treatment	0.776	0.0053	0.07	0.701	-8.31E-4	-0.01	0.0426	0.5878	1966638	Cerep_001304	Cc1cc(nn1C)C(=O)NNC(=O)c2cccc(c2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B07	compound treatment	0.794	0.0233	0.31	0.702	1.69E-4	0.0	0.2239	0.7123	1966639	Cerep_001305	CC(CCOC(=O)NNC(=O)/C=C/c1cccc(c1)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B08	compound treatment	0.731	-0.0397	-0.54	0.69	-0.0118	-0.16	-0.4927	-0.881	1966640	Cerep_001306	CC(=O)N1CCN(CC1)C(=O)c2ccc(cc2)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B09	compound treatment	0.799	0.0283	0.38	0.715	0.0132	0.18	0.397	0.9408	1966641	Cerep_001307	CCCCCCCCCCOCCOCCOC(=O)NNC(=O)c1noc(C)c1c2csc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B10	compound treatment	0.794	0.0233	0.31	0.681	-0.0208	-0.28	0.0214	0.0506	1966642	Cerep_001308	Cc1cc([nH]n1)C(=O)NNC(=O)c2cc3cc(Br)ccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B11	compound treatment	0.766	-0.0047	-0.06	0.725	0.0232	0.32	0.1786	0.5543	1966643	Cerep_001309	CN(C)c1ccc(CN2CCCCC2COC(=O)NCc3ccc4OCCc4c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B12	compound treatment	0.756	-0.0147	-0.2	0.685	-0.0168	-0.23	-0.3025	-0.9973	1966644	Cerep_001310	O=C(NNC(=O)c1ccc(cc1)n2cccc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B13	compound treatment	0.756	-0.0147	-0.2	0.696	-0.00583	-0.08	-0.1964	-0.9195	1966645	Cerep_001311	CCN(CC)CCCCCCOC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B14	compound treatment	0.74	-0.0307	-0.41	0.685	-0.0168	-0.23	-0.4551	-0.9612	1966646	Cerep_001312	COc1cc(OC)cc(c1)C(=O)N2CCC(CC2)c3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B15	compound treatment	0.763	-0.0077	-0.1	0.712	0.0102	0.14	0.0246	0.1423	1966647	Cerep_001313	Cc1ccccc1N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B16	compound treatment	0.772	0.0013	0.02	0.689	-0.0128	-0.17	-0.1113	-0.6328	1966648	Cerep_001314	FC(F)(F)c1ccccc1CNC(=O)c2ccc(CSc3ccccn3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B17	compound treatment	0.778	0.0073	0.1	0.728	0.0262	0.36	0.322	0.8698	1966649	Cerep_001315	Clc1ccccc1CCNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B18	compound treatment	0.761	-0.0097	-0.13	0.666	-0.0358	-0.49	-0.438	-0.8659	1966650	Cerep_001316	COc1ccc2c(CCNC(=O)c3cc(OC)cc(OC)c3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B19	compound treatment	0.776	0.0053	0.07	0.73	0.0282	0.38	0.3222	0.8246	1966651	Cerep_001317	CCOc1ccccc1COC(=O)NCc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B20	compound treatment	0.749	-0.0217	-0.29	0.703	0.00117	0.02	-0.1957	-0.6676	1966652	Cerep_001318	COc1ccc(CNC(=O)c2ccc(NC(=O)C)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B21	compound treatment	0.769	-0.0017	-0.02	0.712	0.0102	0.14	0.0819	0.5826	1966653	Cerep_001319	COc1ccc(cc1)C(=O)NNC(=O)OCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	B22	compound treatment	0.735	-0.0357	-0.48	0.667	-0.0348	-0.47	-0.6764	-1.0	1966654	Cerep_001320	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)C3Cc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C03	compound treatment	0.782	0.0113	0.15	0.701	-8.31E-4	-0.01	0.0998	0.6528	1966655	Cerep_001321	Clc1ccc(/C=N/OCC(=O)NNC(=O)OCC#Cc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C04	compound treatment	0.786	0.0153	0.21	0.725	0.0232	0.32	0.3694	0.9787	1966656	Cerep_001322	FC(F)(F)Oc1ccccc1COC(=O)NNC(=O)c2ccc(Cn3cnc(Cl)c3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C05	compound treatment	0.789	0.0183	0.25	0.726	0.0242	0.33	0.4077	0.9899	1966657	Cerep_001323	Fc1ccc(/C=C/C(=O)NNC(=O)OCCc2c(F)cccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C06	compound treatment	0.787	0.0163	0.22	0.727	0.0252	0.34	0.3982	0.9769	1966658	Cerep_001324	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccccc3NC(=O)c4c(F)cccc4F)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C07	compound treatment	0.77	-6.96E-4	-0.01	0.717	0.0152	0.21	0.1396	0.6743	1966659	Cerep_001325	FC(F)(F)Oc1ccccc1COC(=O)NNC(=O)/C=C/c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C08	compound treatment	0.776	0.0053	0.07	0.708	0.00617	0.08	0.1101	0.9968	1966660	Cerep_001326	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3cccc(C)c3[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C09	compound treatment	0.776	0.0053	0.07	0.702	1.69E-4	0.0	0.0522	0.7295	1966661	Cerep_001327	Clc1cccc(c1)N2CCN(CC2)C(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C10	compound treatment	0.754	-0.0167	-0.23	0.717	0.0152	0.21	-0.013	-0.0425	1966662	Cerep_001328	Clc1ccccc1CCOC(=O)NCCOc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C11	compound treatment	0.749	-0.0217	-0.29	0.694	-0.00783	-0.11	-0.2825	-0.9066	1966663	Cerep_001329	Cc1ccccc1COC(=O)NNC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C12	compound treatment	0.785	0.0143	0.19	0.708	0.00617	0.08	0.1959	0.9308	1966664	Cerep_001330	Fc1ccc(cc1COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C13	compound treatment	0.757	-0.0137	-0.18	0.677	-0.0248	-0.34	-0.3701	-0.9594	1966665	Cerep_001331	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCc3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C14	compound treatment	0.756	-0.0147	-0.2	0.713	0.0112	0.15	-0.0325	-0.13	1966666	Cerep_001332	Cc1cccc(CCOC(=O)N2CCC(CC2)N3CCCCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C15	compound treatment	0.761	-0.0097	-0.13	0.689	-0.0128	-0.17	-0.2162	-0.9897	1966667	Cerep_001333	CN(C)c1ccc(CN2CCN(CCOC(=O)NCc3ccc(cc3)c4csnn4)CC2)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C16	compound treatment	0.771	3.04E-4	0.0	0.749	0.0472	0.64	0.4577	0.7116	1966668	Cerep_001334	COc1ccc(CCCOC(=O)NCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C17	compound treatment	0.758	-0.0127	-0.17	0.714	0.0122	0.17	-0.0038	-0.0158	1966669	Cerep_001335	COc1cccc(CCOC(=O)NCc2ccc(cc2)S(=O)(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C18	compound treatment	0.767	-0.0037	-0.05	0.743	0.0412	0.56	0.3617	0.6418	1966670	Cerep_001336	Oc1ccccc1C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C19	compound treatment	0.784	0.0133	0.18	0.691	-0.0108	-0.15	0.0225	0.0967	1966671	Cerep_001337	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)OCc5ccc(SC(F)(F)F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C20	compound treatment	0.778	0.0073	0.1	0.716	0.0142	0.19	0.2063	0.9512	1966672	Cerep_001338	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc4ccccc4c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C21	compound treatment	0.784	0.0133	0.18	0.719	0.0172	0.23	0.2925	0.9914	1966673	Cerep_001339	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCc3cccc(Oc4ccc(Cl)cc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	C22	compound treatment	0.77	-6.96E-4	-0.01	0.707	0.00517	0.07	0.0432	0.6076	1966674	Cerep_001340	COc1ccc2c(CCNC(=O)OCCc3ccc(Cl)cc3Cl)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D03	compound treatment	0.799	0.0283	0.38	0.741	0.0392	0.53	0.6477	0.9865	1966675	Cerep_001341	Cc1csc(C(=O)NNC(=O)OCCc2c(C)cc(C)cc2C)c1n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D04	compound treatment	0.766	-0.0047	-0.06	0.709	0.00717	0.1	0.0243	0.2089	1966676	Cerep_001342	COc1cc(OC)cc(c1)C(=O)N(C)Cc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D05	compound treatment	0.775	0.0043	0.06	0.707	0.00517	0.07	0.0909	0.9954	1966677	Cerep_001343	[O-][N+](=O)c1cc(CN2CCC(C2)NC(=O)OCCCl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D06	compound treatment	0.758	-0.0127	-0.17	0.705	0.00317	0.04	-0.0906	-0.5126	1966678	Cerep_001344	CC(=O)Nc1ccc(cc1)C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D07	compound treatment	0.767	-0.0037	-0.05	0.688	-0.0138	-0.19	-0.1686	-0.8643	1966679	Cerep_001345	Clc1ncn(CC(=O)NNC(=O)OCCCc2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D08	compound treatment	0.753	-0.0177	-0.24	0.68	-0.0218	-0.3	-0.3793	-0.994	1966680	Cerep_001346	CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D09	compound treatment	0.756	-0.0147	-0.2	0.679	-0.0228	-0.31	-0.3603	-0.9763	1966681	Cerep_001347	Cc1onc(c1COC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)c5c(Cl)cccc5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D10	compound treatment	0.767	-0.0037	-0.05	0.682	-0.0198	-0.27	-0.2265	-0.8236	1966682	Cerep_001348	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)/C=C/c3ccco3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D11	compound treatment	0.763	-0.0077	-0.1	0.679	-0.0228	-0.31	-0.2936	-0.8945	1966683	Cerep_001349	COc1cc(CN2CCN(CCOC(=O)NCCc3ccc(O)cc3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D12	compound treatment	0.781	0.0103	0.14	0.657	-0.0448	-0.61	-0.334	-0.5327	1966684	Cerep_001350	Cc1cc(nn1C)C(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D13	compound treatment	0.76	-0.0107	-0.14	0.667	-0.0348	-0.47	-0.4379	-0.8821	1966685	Cerep_001351	CCCCCOC(=O)NNC(=O)c1cc(c(SC)s1)c2nc(C)cs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D14	compound treatment	0.728	-0.0427	-0.58	0.648	-0.0538	-0.73	-0.9263	-0.9928	1966686	Cerep_001352	Brc1ccc(cc1)C(CC(=O)NCC2COc3ccccc3O2)CC(=O)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D15	compound treatment	0.771	3.04E-4	0.0	0.705	0.00317	0.04	0.0335	0.7708	1966687	Cerep_001353	CCOc1ccc(cc1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D16	compound treatment	0.763	-0.0077	-0.1	0.693	-0.00883	-0.12	-0.1586	-0.9973	1966688	Cerep_001354	COc1ccc2[nH]cc(CCNC(=O)c3cn[nH]c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D17	compound treatment	0.786	0.0153	0.21	0.695	-0.00683	-0.09	0.0801	0.3538	1966689	Cerep_001355	CC(C)(C)c1ccc(COC(=O)NNC(=O)/C=C/c2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D18	compound treatment	0.755	-0.0157	-0.21	0.68	-0.0218	-0.3	-0.3602	-0.9861	1966690	Cerep_001356	CN(C)CCCNC(=O)CC(CC(=O)C1CC1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D19	compound treatment	0.766	-0.0047	-0.06	0.699	-0.00283	-0.04	-0.0721	-0.9718	1966691	Cerep_001357	COc1cc(COC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-])cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D20	compound treatment	0.744	-0.0267	-0.36	0.724	0.0222	0.3	-0.0409	-0.087	1966692	Cerep_001358	[O-][N+](=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D21	compound treatment	0.793	0.0223	0.3	0.709	0.00717	0.1	0.2819	0.891	1966693	Cerep_001359	CC(C)(C)c1ccc(NC(=O)OCCc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	D22	compound treatment	0.76	-0.0107	-0.14	0.708	0.00617	0.08	-0.0425	-0.2547	1966694	Cerep_001360	Fc1cccc(c1)C(=O)NNC(=O)c2cc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E03	compound treatment	0.801	0.0303	0.41	0.715	0.0132	0.18	0.4161	0.9318	1966695	Cerep_001361	FC(F)COC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E04	compound treatment	0.754	-0.0167	-0.23	0.707	0.00517	0.07	-0.1094	-0.4636	1966696	Cerep_001362	OC1(CCN(CC1)C(=O)OCCN2CCN(CC2)c3ncc(Cl)cc3C(F)(F)F)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E05	compound treatment	0.749	-0.0217	-0.29	0.708	0.00617	0.08	-0.1475	-0.4843	1966697	Cerep_001363	Fc1ccc(CCOC(=O)NNC(=O)c2ccccc2n3cccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E06	compound treatment	0.793	0.0223	0.3	0.722	0.0202	0.28	0.4072	0.999	1966698	Cerep_001364	CN(C)c1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)CC2)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E07	compound treatment	0.759	-0.0117	-0.16	0.699	-0.00283	-0.04	-0.1389	-0.8549	1966699	Cerep_001365	O=C(NC1CCN(CC1)c2ccccc2)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E08	compound treatment	0.785	0.0143	0.19	0.678	-0.0238	-0.32	-0.0933	-0.247	1966700	Cerep_001366	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(OC(F)(F)F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E09	compound treatment	0.775	0.0043	0.06	0.714	0.0122	0.17	0.1584	0.901	1966701	Cerep_001367	Cc1ccccc1CCOC(=O)NNC(=O)CSCc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E10	compound treatment	0.726	-0.0447	-0.6	0.706	0.00417	0.06	-0.3862	-0.6376	1966702	Cerep_001368	COc1ccccc1CCOC(=O)NC(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E11	compound treatment	0.756	-0.0147	-0.2	0.659	-0.0428	-0.58	-0.5532	-0.8969	1966703	Cerep_001369	Cc1csc(C(=O)NNC(=O)OCc2cc3OCOc3cc2[N+](=O)[O-])c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E12	compound treatment	0.752	-0.0187	-0.25	0.689	-0.0128	-0.17	-0.3021	-0.984	1966704	Cerep_001370	O=C(NNC(=O)c1nccc2ccccc12)OCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E13	compound treatment	0.771	3.04E-4	0.0	0.723	0.0212	0.29	0.207	0.7171	1966705	Cerep_001371	FC(F)(F)c1cc(Cl)cnc1N2CCN(CCOC(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E14	compound treatment	0.768	-0.0027	-0.04	0.697	-0.00483	-0.07	-0.0723	-0.9608	1966706	Cerep_001372	NS(=O)(=O)c1ccc(CNC(=O)OCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E15	compound treatment	0.759	-0.0117	-0.16	0.714	0.0122	0.17	0.0058	0.0252	1966707	Cerep_001373	Cc1ccccc1C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E16	compound treatment	0.785	0.0143	0.19	0.685	-0.0168	-0.23	-0.0258	-0.0862	1966708	Cerep_001374	O=C(NNC(=O)c1cccs1)OCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E17	compound treatment	0.781	0.0103	0.14	0.694	-0.00783	-0.11	0.0228	0.13	1966709	Cerep_001375	CC(NC(=O)OCCc1cccc(C)c1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E18	compound treatment	0.78	0.0093	0.13	0.692	-0.00983	-0.13	-0.006	-0.0329	1966710	Cerep_001376	O=C(OCc1ccccc1Cc2ccccc2)N3CCN(Cc4cccnc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E19	compound treatment	0.784	0.0133	0.18	0.725	0.0232	0.32	0.3503	0.9641	1966711	Cerep_001377	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCCN(Cc3cc4ccccc4c5ccccc35)C(=O)OC(C)(C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E20	compound treatment	0.785	0.0143	0.19	0.72	0.0182	0.25	0.3116	0.9924	1966712	Cerep_001378	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)OCc3ccc(SC(F)(F)F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E21	compound treatment	0.777	0.0063	0.09	0.716	0.0142	0.19	0.1968	0.9321	1966713	Cerep_001379	COc1cccc(COC(=O)N2CCN(CC2)c3cc(nc4cc(nn34)C(C)(C)C)C(F)(F)F)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	E22	compound treatment	0.78	0.0093	0.13	0.74	0.0382	0.52	0.4568	0.8532	1966714	Cerep_001380	Cc1nc(sc1C(=O)NNC(=O)OCCN2CCN(CC2)c3ncc(Cl)cc3C(F)(F)F)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F03	compound treatment	0.771	3.04E-4	0.0	0.71	0.00817	0.11	0.0817	0.7326	1966715	Cerep_001381	COc1ccc2c(CCNC(=O)OCC#Cc3ccccc3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F04	compound treatment	0.735	-0.0357	-0.48	0.668	-0.0338	-0.46	-0.6667	-0.9998	1966716	Cerep_001382	Brc1ccc(cc1)C(CC(=O)NCc2ccc(cc2)c3csnn3)CC(=O)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F05	compound treatment	0.738	-0.0327	-0.44	0.69	-0.0118	-0.16	-0.426	-0.907	1966717	Cerep_001383	Clc1ccccc1CCOC(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F06	compound treatment	0.721	-0.0497	-0.67	0.677	-0.0248	-0.34	-0.7135	-0.95	1966718	Cerep_001384	NS(=O)(=O)c1ccc(CNC(=O)CNC(=O)CNC(=O)c2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F07	compound treatment	0.743	-0.0277	-0.37	0.668	-0.0338	-0.46	-0.5904	-0.9945	1966719	Cerep_001385	COc1ccc(CCCOC(=O)NNC(=O)c2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F08	compound treatment	0.736	-0.0347	-0.47	0.65	-0.0518	-0.71	-0.8307	-0.98	1966720	Cerep_001386	Fc1ccc(cc1)C(N2CCN(CC2)C(=O)CC(c3ccccc3)(c4ccccc4)c5ccccc5)c6ccc(F)cc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F09	compound treatment	0.753	-0.0177	-0.24	0.652	-0.0498	-0.68	-0.6493	-0.9015	1966721	Cerep_001387	O=C(CC1Sc2ccccc2NC1=O)NNC(=O)OCCSc3ncc4ccccn34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F10	compound treatment	0.744	-0.0267	-0.36	0.668	-0.0338	-0.46	-0.5809	-0.9925	1966722	Cerep_001388	CC/1=C(CC(=O)NNC(=O)c2sc(nc2C)c3cnccc3C(F)(F)F)c4cc(F)ccc4\C1=C/c5ccc(cc5)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F11	compound treatment	0.762	-0.0087	-0.12	0.668	-0.0338	-0.46	-0.4092	-0.8596	1966723	Cerep_001389	COc1cc(CN2CCN(CCOC(=O)NNC(=O)CSc3ncnc4c(C)csc34)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F12	compound treatment	0.746	-0.0247	-0.33	0.663	-0.0388	-0.53	-0.61	-0.9751	1966724	Cerep_001390	COCC(Cc1ccccc1)NC(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F13	compound treatment	0.765	-0.0057	-0.08	0.671	-0.0308	-0.42	-0.3516	-0.8227	1966725	Cerep_001391	O=C(NCc1cccnc1)OCc2cccc(Oc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F14	compound treatment	0.739	-0.0317	-0.43	0.685	-0.0168	-0.23	-0.4646	-0.9574	1966726	Cerep_001392	Cc1oc(nc1CC(=O)NC(COc2ccccc2)c3ccc4OCCOc4c3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F15	compound treatment	0.776	0.0053	0.07	0.699	-0.00283	-0.04	0.0233	0.2866	1966727	Cerep_001393	COc1ccc2[nH]cc(CCNC(=O)OCCc3ccccc3C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F16	compound treatment	0.762	-0.0087	-0.12	0.69	-0.0118	-0.16	-0.197	-0.9878	1966728	Cerep_001394	Cn1c(CCC(=O)NNC(=O)/C=C/c2ccco2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F17	compound treatment	0.75	-0.0207	-0.28	0.691	-0.0108	-0.15	-0.3019	-0.9557	1966729	Cerep_001395	COc1cccc(CCNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F18	compound treatment	0.782	0.0113	0.15	0.686	-0.0158	-0.22	-0.0448	-0.1695	1966730	Cerep_001396	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)Cc5nc(oc5C)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F19	compound treatment	0.765	-0.0057	-0.08	0.697	-0.00483	-0.07	-0.1009	-0.9971	1966731	Cerep_001397	CCc1ccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F20	compound treatment	0.759	-0.0117	-0.16	0.679	-0.0228	-0.31	-0.3317	-0.9504	1920937	Cerep_001398	O=C(C(c1ccccc1)c2ccccc2)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F21	compound treatment	0.765	-0.0057	-0.08	0.742	0.0402	0.55	0.333	0.602	1966732	Cerep_001399	COc1ccccc1CCOC(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	F22	compound treatment	0.766	-0.0047	-0.06	0.698	-0.00383	-0.05	-0.0817	-0.9954	1966733	Cerep_001400	Cn1c(cc2ccccc12)C(=O)NNC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G03	compound treatment	0.776	0.0053	0.07	0.7	-0.00183	-0.02	0.0329	0.4347	1966734	Cerep_001401	Cc1ccccc1CCOC(=O)N2CCCN(CC2)c3nc4ccc(Cl)cc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G04	compound treatment	0.78	0.0093	0.13	0.726	0.0242	0.33	0.3218	0.9125	1966735	Cerep_001402	O=C(NCCc1ccncc1)OCCOc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G05	compound treatment	0.756	-0.0147	-0.2	0.662	-0.0398	-0.54	-0.5243	-0.9067	1966736	Cerep_001403	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCc3ccccc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G06	compound treatment	0.774	0.0033	0.04	0.647	-0.0548	-0.75	-0.4972	-0.6638	1966737	Cerep_001404	Oc1ccc(cc1)C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G07	compound treatment	0.741	-0.0297	-0.4	0.642	-0.0598	-0.82	-0.8602	-0.9464	1966738	Cerep_001405	CN(CCOC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G08	compound treatment	0.754	-0.0167	-0.23	0.657	-0.0448	-0.61	-0.5915	-0.908	1966739	Cerep_001406	Clc1cccc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G09	compound treatment	0.774	0.0033	0.04	0.78	0.0782	1.07	0.7853	0.736	1966740	Cerep_001407	COc1ccc(cc1)C(=O)NNC(=O)OCC(C)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G10	compound treatment	0.739	-0.0317	-0.43	0.713	0.0112	0.15	-0.1947	-0.4288	1966741	Cerep_001408	Clc1cccc(CCOC(=O)N2CCN(CC2)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G11	compound treatment	0.754	-0.0167	-0.23	0.7	-0.00183	-0.02	-0.1769	-0.7807	1966742	Cerep_001409	CCN(CCOC(=O)N1CCN(CCCC(c2ccc(F)cc2)c3ccc(F)cc3)CC1)c4ccc(N=Nc5ccc(cc5)[N+](=O)[O-])cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G12	compound treatment	0.782	0.0113	0.15	0.712	0.0102	0.14	0.2059	0.9989	1966743	Cerep_001410	COc1ccc(cc1COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G13	compound treatment	0.776	0.0053	0.07	0.703	0.00117	0.02	0.0619	0.844	1966744	Cerep_001411	O=C(NCc1ccncc1)OCCOc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G14	compound treatment	0.798	0.0273	0.37	0.72	0.0182	0.25	0.4357	0.9814	1966745	Cerep_001412	CC(=CC1C(CNC(=O)OCCc2cccc(C)c2)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G15	compound treatment	0.77	-6.96E-4	-0.01	0.686	-0.0158	-0.22	-0.1593	-0.7372	1966746	Cerep_001413	Clc1cc2OCOc2cc1CN3CCCC(COC(=O)N4CCN(CC4)C(=O)OCc5ccccc5)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G16	compound treatment	0.763	-0.0077	-0.1	0.693	-0.00883	-0.12	-0.1586	-0.9973	1966747	Cerep_001414	O=C(OCCCCCc1ccccc1)N2CCN(CCC3CCCCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G17	compound treatment	0.787	0.0163	0.22	0.742	0.0402	0.55	0.5429	0.9197	1966748	Cerep_001415	Fc1ccc(/C=C/C(=O)NNC(=O)OCCc2ccc(Br)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G18	compound treatment	0.81	0.0393	0.53	0.694	-0.00783	-0.11	0.2994	0.5536	1966749	Cerep_001416	O=C(NNC(=O)c1ccc2OCOc2c1)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G19	compound treatment	0.75	-0.0207	-0.28	0.701	-8.31E-4	-0.01	-0.2054	-0.7352	1966750	Cerep_001417	COc1cc(CCNC(=O)OCCCC2CCCCC2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G20	compound treatment	0.778	0.0073	0.1	0.707	0.00517	0.07	0.1195	0.9865	1966751	Cerep_001418	CC(C)(C)OC(=O)N1CCCC1COC(=O)NCCc2c[nH]c3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G21	compound treatment	0.787	0.0163	0.22	0.715	0.0132	0.18	0.2825	0.9949	1966752	Cerep_001419	COc1cccc(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	G22	compound treatment	0.786	0.0153	0.21	0.729	0.0272	0.37	0.408	0.9619	1966753	Cerep_001420	O=C(NNC(=O)/C=C/c1ccco1)OCCOc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H03	compound treatment	0.753	-0.0177	-0.24	0.701	-8.31E-4	-0.01	-0.1768	-0.7398	1966754	Cerep_001421	CCC#CCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H04	compound treatment	0.734	-0.0367	-0.5	0.676	-0.0258	-0.35	-0.5991	-0.9861	1966755	Cerep_001422	COC(=O)C(C)(Cc1ccccc1)NC(=O)Cc2nc(oc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H05	compound treatment	0.768	-0.0027	-0.04	0.708	0.00617	0.08	0.0338	0.3685	1966756	Cerep_001423	CN1CCCC1CCNC(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H06	compound treatment	0.714	-0.0567	-0.76	0.701	-8.31E-4	-0.01	-0.5489	-0.7175	1966757	Cerep_001424	CN(C)c1ccc(CNC(=O)c2ccc(cc2)N3N=C(C)CC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H07	compound treatment	0.769	-0.0017	-0.02	0.7	-0.00183	-0.02	-0.0338	-0.9991	1966758	Cerep_001425	CC(=O)Nc1ccc(NC(=O)OCCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H08	compound treatment	0.754	-0.0167	-0.23	0.653	-0.0488	-0.67	-0.6301	-0.8964	1966759	Cerep_001426	NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(CSc3ccccn3)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H09	compound treatment	0.76	-0.0107	-0.14	0.674	-0.0278	-0.38	-0.3704	-0.9122	1966760	Cerep_001427	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCN3CCN(Cc4ccc(cc4)[N+](=O)[O-])CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H10	compound treatment	0.759	-0.0117	-0.16	0.666	-0.0358	-0.49	-0.4571	-0.8902	1966761	Cerep_001428	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NNC(=O)C3(CCC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H11	compound treatment	0.738	-0.0327	-0.44	0.689	-0.0128	-0.17	-0.4356	-0.918	1966762	Cerep_001429	CC(C)Oc1ccc(CN2CCN(CCOC(=O)NCc3ccc4OCCc4c3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H12	compound treatment	0.746	-0.0247	-0.33	0.669	-0.0328	-0.45	-0.5521	-0.9894	1966763	Cerep_001430	COc1cc(CCNC(=O)CNC(=O)CNC(=O)c2ccc(cc2)[N+](=O)[O-])cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H13	compound treatment	0.743	-0.0277	-0.37	0.682	-0.0198	-0.27	-0.4554	-0.9874	1966764	Cerep_001431	O=C(OCc1ccc2OCOc2c1)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H14	compound treatment	0.772	0.0013	0.02	0.695	-0.00683	-0.09	-0.0534	-0.5636	1966765	Cerep_001432	OC(C1CCN(CC1)C(=O)Cc2ccc(F)c(F)c2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H15	compound treatment	0.761	-0.0097	-0.13	0.667	-0.0348	-0.47	-0.4283	-0.8695	1966766	Cerep_001433	CC(=C)C1CCC(=CC1)COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H16	compound treatment	0.742	-0.0287	-0.39	0.675	-0.0268	-0.37	-0.5325	-0.9996	1966767	Cerep_001434	CCOC(=O)N1CCN(CC1)C(=O)C(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H17	compound treatment	0.76	-0.0107	-0.14	0.737	0.0352	0.48	0.2371	0.4734	1966768	Cerep_001435	COc1cc(ccc1CN2CCCC(COC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)C2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H18	compound treatment	0.747	-0.0237	-0.32	0.696	-0.00583	-0.08	-0.2823	-0.8569	1966769	Cerep_001436	Fc1ccc(CC(=O)N2CCC(Cc3ccccc3)CC2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H19	compound treatment	0.782	0.0113	0.15	0.711	0.00917	0.13	0.1962	0.9951	1966770	Cerep_001437	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(Cl)cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H20	compound treatment	0.758	-0.0127	-0.17	0.675	-0.0268	-0.37	-0.3798	-0.9402	1966771	Cerep_001438	CC(N1CCN(CC1)C(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H21	compound treatment	0.776	0.0053	0.07	0.71	0.00817	0.11	0.1294	0.9771	1966772	Cerep_001439	CN1CCN(CCCNC(=O)OCCc2cccc(Cl)c2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	H22	compound treatment	0.765	-0.0057	-0.08	0.71	0.00817	0.11	0.0244	0.1806	1966773	Cerep_001440	O=C(N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccc5[nH]nnc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I03	compound treatment	0.78	0.0093	0.13	0.713	0.0112	0.15	0.1965	0.9954	1966774	Cerep_001441	COc1ccc2[nH]cc(CCNC(=O)OCCCc3ccccn3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I04	compound treatment	0.737	-0.0337	-0.45	0.708	0.00617	0.08	-0.2619	-0.5666	1966775	Cerep_001442	CN(CCOC(=O)N1CCc2c(C1)[nH]c3ccccc23)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I05	compound treatment	0.748	-0.0227	-0.31	0.673	-0.0288	-0.39	-0.4945	-0.9924	1966776	Cerep_001443	[O-][N+](=O)c1cc2OCOc2cc1COC(=O)NNC(=O)c3ccc4nccnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I06	compound treatment	0.76	-0.0107	-0.14	0.689	-0.0128	-0.17	-0.2258	-0.9954	1966777	Cerep_001444	Clc1cc2OCOc2cc1CN3CCCC(COC(=O)NCc4csc5ccccc45)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I07	compound treatment	0.748	-0.0227	-0.31	0.685	-0.0168	-0.23	-0.3788	-0.9899	1966778	Cerep_001445	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCN4CCN(Cc5ccc6ccccc6c5)CC4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I08	compound treatment	0.801	0.0303	0.41	0.677	-0.0248	-0.34	0.0497	0.0935	1966779	Cerep_001446	FC(F)(F)Sc1ccc(COC(=O)N2CCN(Cc3cc4ccccc4o3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I09	compound treatment	0.751	-0.0197	-0.27	0.673	-0.0288	-0.39	-0.4659	-0.9818	1966780	Cerep_001447	Cc1csc(C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3)c1n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I10	compound treatment	0.771	3.04E-4	0.0	0.688	-0.0138	-0.19	-0.1305	-0.6916	1966781	Cerep_001448	COc1cccc(CCOC(=O)N2CCN(CC2)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I11	compound treatment	0.759	-0.0117	-0.16	0.673	-0.0288	-0.39	-0.3896	-0.9196	1966782	Cerep_001449	CCCCCCOCCOCCOC(=O)NNC(=O)CNS(=O)(=O)c1cccc2nsnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I12	compound treatment	0.763	-0.0077	-0.1	0.71	0.00817	0.11	0.0054	0.0352	1966783	Cerep_001450	Clc1ccc(cc1)C(NC(=O)OCC2CCC=CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I13	compound treatment	0.741	-0.0297	-0.4	0.679	-0.0228	-0.31	-0.5034	-0.9922	1966784	Cerep_001451	CN(CCOC(=O)NNC(=O)c1ccccc1n2cccc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I14	compound treatment	0.805	0.0343	0.46	0.71	0.00817	0.11	0.406	0.853	1966785	Cerep_001452	Cc1cccc(CCOC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I15	compound treatment	0.784	0.0133	0.18	0.687	-0.0148	-0.2	-0.0161	-0.0595	1966786	Cerep_001453	CCc1ccccc1N2CCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I16	compound treatment	0.781	0.0103	0.14	0.71	0.00817	0.11	0.1771	0.994	1966787	Cerep_001454	COc1ccccc1CNC(=O)OCc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I17	compound treatment	0.798	0.0273	0.37	0.74	0.0382	0.52	0.6285	0.9857	1966788	Cerep_001455	Cc1ccc(CCOC(=O)NCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I18	compound treatment	0.788	0.0173	0.23	0.731	0.0292	0.4	0.4463	0.9677	1966789	Cerep_001456	Fc1ccccc1COC(=O)N2CCCC2C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I19	compound treatment	0.758	-0.0127	-0.17	0.671	-0.0308	-0.42	-0.4184	-0.9216	1966790	Cerep_001457	COc1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I20	compound treatment	0.779	0.0083	0.11	0.735	0.0332	0.45	0.399	0.8564	1966791	Cerep_001458	CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(Cc2ccccc2F)CC1)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I21	compound treatment	0.802	0.0313	0.42	0.726	0.0242	0.33	0.5317	0.9925	1966792	Cerep_001459	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(cc5)C(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	I22	compound treatment	0.816	0.0453	0.61	0.711	0.00917	0.13	0.5206	0.8345	1966793	Cerep_001460	Cc1ncc([N+](=O)[O-])n1CCOC(=O)N2CCC(CC2)C(O)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J03	compound treatment	0.798	0.0273	0.37	0.712	0.0102	0.14	0.3585	0.9109	1966794	Cerep_001461	O=C(CSCc1nc(cs1)c2ccccc2)NNC(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J04	compound treatment	0.752	-0.0187	-0.25	0.686	-0.0158	-0.22	-0.331	-0.997	1966795	Cerep_001462	CCOc1ccc(cc1OCC)C(=O)N2CCN(Cc3ccc4n(CC)c5ccccc5c4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J05	compound treatment	0.743	-0.0277	-0.37	0.705	0.00317	0.04	-0.2336	-0.6212	1966796	Cerep_001463	COc1cccc(CCOC(=O)NCCC2CCCN2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J06	compound treatment	0.755	-0.0157	-0.21	0.69	-0.0118	-0.16	-0.2638	-0.991	1966797	Cerep_001464	COc1ccccc1C(=O)NCCCN2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J07	compound treatment	0.746	-0.0247	-0.33	0.689	-0.0128	-0.17	-0.3593	-0.9548	1966798	Cerep_001465	Fc1cccc(CCNC(=O)OCCCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J08	compound treatment	0.751	-0.0197	-0.27	0.665	-0.0368	-0.5	-0.543	-0.9557	1966799	Cerep_001466	O=C(NCC1CCCCC1)c2cn[nH]c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J09	compound treatment	0.737	-0.0337	-0.45	0.698	-0.00383	-0.05	-0.3584	-0.7832	1966800	Cerep_001467	O=C(NNC(=O)c1ccccc1NC(=O)c2cccs2)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J10	compound treatment	0.735	-0.0357	-0.48	0.673	-0.0288	-0.39	-0.6185	-0.9949	1966801	Cerep_001468	COc1ccccc1C(=O)NNC(=O)c2cc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J11	compound treatment	0.776	0.0053	0.07	0.701	-8.31E-4	-0.01	0.0426	0.5878	1966802	Cerep_001469	CC(Cl)COC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J12	compound treatment	0.759	-0.0117	-0.16	0.691	-0.0108	-0.15	-0.216	-0.9995	1966803	Cerep_001470	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NCCc3c[nH]c4ccc(Cl)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J13	compound treatment	0.759	-0.0117	-0.16	0.706	0.00417	0.06	-0.0714	-0.4255	1966804	Cerep_001471	CC(C)(C)c1ccc(COC(=O)NNC(=O)c2snnc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J14	compound treatment	0.754	-0.0167	-0.23	0.688	-0.0138	-0.19	-0.2926	-0.9961	1966805	Cerep_001472	C=CCCC(=O)NCc1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J15	compound treatment	0.771	3.04E-4	0.0	0.709	0.00717	0.1	0.072	0.7361	1966806	Cerep_001473	Cc1ccc(CCOC(=O)N2CCC(CC2)C(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J16	compound treatment	0.745	-0.0257	-0.35	0.688	-0.0138	-0.19	-0.3785	-0.9591	1966807	Cerep_001474	O=C(CCCCCNC(=O)OCc1ccccc1)N2CCN(CC2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J17	compound treatment	0.77	-6.96E-4	-0.01	0.694	-0.00783	-0.11	-0.0821	-0.7663	1966808	Cerep_001475	COc1ccc2c(CCNC(=O)OCC3CCCN(Cc4cc(OC)c(OC)cc4Br)C3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J18	compound treatment	0.743	-0.0277	-0.37	0.673	-0.0288	-0.39	-0.5422	-0.9997	1966809	Cerep_001476	Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J19	compound treatment	0.792	0.0213	0.29	0.707	0.00517	0.07	0.2531	0.8552	1966810	Cerep_001477	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(F)c(c5)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J20	compound treatment	0.788	0.0173	0.23	0.672	-0.0298	-0.41	-0.1226	-0.2613	1966811	Cerep_001478	OC1(CCN(CC1)C(=O)c2ccc(CSc3ccccn3)o2)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J21	compound treatment	0.803	0.0323	0.44	0.734	0.0322	0.44	0.6183	1.0	1966812	Cerep_001479	COc1cccc(CCOC(=O)NCCCN2CCN(C)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	J22	compound treatment	0.754	-0.0167	-0.23	0.705	0.00317	0.04	-0.1287	-0.5612	1966813	Cerep_001480	CCOc1ccccc1C(=O)NNC(=O)c2ccc(cc2)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K03	compound treatment	0.788	0.0173	0.23	0.698	-0.00383	-0.05	0.1281	0.5356	1966814	Cerep_001481	COc1cscc1C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K04	compound treatment	0.789	0.0183	0.25	0.705	0.00317	0.04	0.2052	0.8184	1966815	Cerep_001482	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCN4CCN(Cc5ccc(cc5)S(=O)(=O)C)CC4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K05	compound treatment	0.739	-0.0317	-0.43	0.672	-0.0298	-0.41	-0.59	-0.9997	1966816	Cerep_001483	CCN(CCOC(=O)NNC(=O)c1csc(CS(=O)(=O)Cc2ccco2)n1)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K06	compound treatment	0.75	-0.0207	-0.28	0.704	0.00217	0.03	-0.1765	-0.6287	1966817	Cerep_001484	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCc3cccc(Oc4ccc(Cl)cc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K07	compound treatment	0.767	-0.0037	-0.05	0.679	-0.0228	-0.31	-0.2554	-0.81	1966818	Cerep_001485	O=C(OCc1ccccc1)N2CCN(CC2)C(=O)OCc3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K08	compound treatment	0.792	0.0213	0.29	0.688	-0.0138	-0.19	0.0699	0.2032	1966819	Cerep_001486	O=C(OCCc1ccsc1)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K09	compound treatment	0.743	-0.0277	-0.37	0.687	-0.0148	-0.2	-0.4072	-0.9584	1966820	Cerep_001487	CCOc1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K10	compound treatment	0.794	0.0233	0.31	0.731	0.0292	0.4	0.5036	0.9932	1966821	Cerep_001488	Fc1ccccc1COC(=O)N2CCN(CC2)c3cc(ccn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K11	compound treatment	0.735	-0.0357	-0.48	0.689	-0.0128	-0.17	-0.4642	-0.9061	1966822	Cerep_001489	CC(=CCC/C(=C\COC(=O)NNC(=O)c1ccccc1n2cccc2)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K12	compound treatment	0.777	0.0063	0.09	0.702	1.69E-4	0.0	0.0618	0.726	1966823	Cerep_001490	COc1ccc2[nH]cc(CCNC(=O)OCCc3ccccc3F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K13	compound treatment	0.744	-0.0267	-0.36	0.648	-0.0538	-0.73	-0.7737	-0.9463	1966824	Cerep_001491	FC(F)(F)Oc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K14	compound treatment	0.77	-6.96E-4	-0.01	0.702	1.69E-4	0.0	-0.005	-0.5178	1966825	Cerep_001492	CN(CCc1ccccn1)C(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K15	compound treatment	0.795	0.0243	0.33	0.737	0.0352	0.48	0.571	0.9828	1966826	Cerep_001493	COc1ccc(CN2CCCC(COC(=O)NNC(=O)c3ccc(C)s3)C2)cc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K16	compound treatment	0.794	0.0233	0.31	0.748	0.0462	0.63	0.6675	0.9485	1966827	Cerep_001494	CC(NC(=O)OCCCCc1ccc(cc1)[N+](=O)[O-])C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K17	compound treatment	0.797	0.0263	0.35	0.707	0.00517	0.07	0.3008	0.8313	1966828	Cerep_001495	CC(CCOC(=O)NNC(=O)c1ccc(F)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K18	compound treatment	0.791	0.0203	0.27	0.712	0.0102	0.14	0.2917	0.9503	1966829	Cerep_001496	COc1cccc(COC(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K19	compound treatment	0.725	-0.0457	-0.62	0.668	-0.0338	-0.46	-0.7621	-0.9898	1966830	Cerep_001497	COc1cc(CN2CCC(C2)NC(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K20	compound treatment	0.791	0.0203	0.27	0.705	0.00317	0.04	0.2242	0.8087	1966831	Cerep_001498	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCCCC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K21	compound treatment	0.784	0.0133	0.18	0.717	0.0152	0.21	0.2732	0.9975	1966832	Cerep_001499	CN1CCN(C)C(C1)C(=O)NNC(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	K22	compound treatment	0.791	0.0203	0.27	0.717	0.0152	0.21	0.34	0.9904	1966833	Cerep_001500	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(OC(F)(F)F)cc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L03	compound treatment	0.772	0.0013	0.02	0.681	-0.0208	-0.28	-0.1884	-0.662	1966834	Cerep_001501	Cc1cccc(C(=O)NNC(=O)OCCc2cccc(F)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L04	compound treatment	0.784	0.0133	0.18	0.685	-0.0168	-0.23	-0.0354	-0.1214	1966835	Cerep_001502	Cc1cc(Cl)ccc1OCCCC(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L05	compound treatment	0.768	-0.0027	-0.04	0.67	-0.0318	-0.43	-0.3326	-0.7637	1966352	Cerep_001503	Cc1cccc(CCOC(=O)NNC(=O)c2cc(Cl)ccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L06	compound treatment	0.748	-0.0227	-0.31	0.681	-0.0208	-0.28	-0.4174	-0.9993	1966836	Cerep_001504	O=C(NCCc1ccncc1)c2cc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L07	compound treatment	0.757	-0.0137	-0.18	0.694	-0.00783	-0.11	-0.2062	-0.966	1966837	Cerep_001505	CCN(CCOC(=O)NNC(=O)c1sc(nc1C)c2ccccc2)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L08	compound treatment	0.722	-0.0487	-0.66	0.645	-0.0568	-0.77	-1.0125	-0.9966	1966838	Cerep_001506	Cc1cccc(C)c1N2CCN(CC2)C(=O)CCc3nc4ccccc4n3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L09	compound treatment	0.74	-0.0307	-0.41	0.672	-0.0298	-0.41	-0.5805	-1.0	1966839	Cerep_001507	Cn1c(=O)n(C)c2ncn(CCOC(=O)N3CCC(O)(Cc4ccccc4)CC3)c2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L10	compound treatment	0.755	-0.0157	-0.21	0.693	-0.00883	-0.12	-0.2349	-0.9642	1966840	Cerep_001508	[O-][N+](=O)c1ccc(OCC(=O)NNC(=O)c2cc(nc3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L11	compound treatment	0.756	-0.0147	-0.2	0.686	-0.0158	-0.22	-0.2928	-0.9991	1966841	Cerep_001509	Cc1nc(cs1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L12	compound treatment	0.756	-0.0147	-0.2	0.71	0.00817	0.11	-0.0614	-0.2701	1966842	Cerep_001510	COc1ccccc1C(=O)NCCOCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L13	compound treatment	0.767	-0.0037	-0.05	0.682	-0.0198	-0.27	-0.2265	-0.8236	1966843	Cerep_001511	[O-][N+](=O)c1ccc(CCCCOC(=O)NNC(=O)c2cccc3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L14	compound treatment	0.771	3.04E-4	0.0	0.691	-0.0108	-0.15	-0.1015	-0.6872	1966844	Cerep_001512	O=C(CCc1c[nH]c2ccccc12)NNC(=O)c3ccc4nsnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L15	compound treatment	0.784	0.0133	0.18	0.711	0.00917	0.13	0.2153	0.9844	1966845	Cerep_001513	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L16	compound treatment	0.751	-0.0197	-0.27	0.711	0.00917	0.13	-0.0995	-0.3387	1966846	Cerep_001514	O=C(NCc1cccs1)C2Cc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L17	compound treatment	0.785	0.0143	0.19	0.731	0.0292	0.4	0.4177	0.9448	1966847	Cerep_001515	COc1ccc(CN2CCCC(COC(=O)NC(Cc3c[nH]c4ccccc34)C(=O)N)C2)cc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L18	compound treatment	0.752	-0.0187	-0.25	0.722	0.0202	0.28	0.0161	0.0432	1966848	Cerep_001516	CC(C(=O)NCC(=O)Nc1ccc2ccccc2c1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L19	compound treatment	0.76	-0.0107	-0.14	0.687	-0.0148	-0.2	-0.245	-0.9863	1966849	Cerep_001517	Cc1cccc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L20	compound treatment	0.769	-0.0017	-0.02	0.724	0.0222	0.3	0.1976	0.6517	1966850	Cerep_001518	[O-][N+](=O)c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c3cn[nH]c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L21	compound treatment	0.805	0.0343	0.46	0.721	0.0192	0.26	0.5121	0.9634	1966851	Cerep_001519	Cc1cccc(CCOC(=O)NC(CCCNC(=O)OCc2ccccc2)C(=O)OCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	L22	compound treatment	0.787	0.0163	0.22	0.709	0.00717	0.1	0.2247	0.9334	1966852	Cerep_001520	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)C(c5ccccc5)c6ccccc6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M03	compound treatment	0.792	0.0213	0.29	0.69	-0.0118	-0.16	0.0891	0.2705	1966853	Cerep_001521	Clc1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M04	compound treatment	0.788	0.0173	0.23	0.701	-8.31E-4	-0.01	0.1571	0.672	1966854	Cerep_001522	C=CCOc1ccccc1COC(=O)N2CCCC2C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M05	compound treatment	0.77	-6.96E-4	-0.01	0.684	-0.0178	-0.24	-0.1786	-0.7339	1966855	Cerep_001523	CCCCCCOCCOCCOC(=O)NNC(=O)CC1Sc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M06	compound treatment	0.766	-0.0047	-0.06	0.699	-0.00283	-0.04	-0.0721	-0.9718	1966856	Cerep_001524	COc1ccccc1COC(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M07	compound treatment	0.784	0.0133	0.18	0.719	0.0172	0.23	0.2925	0.9914	1966857	Cerep_001525	CCOc1ccc(Br)cc1NC2CCCCC2COC(=O)NCCc3c[nH]c4ccc(C)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M08	compound treatment	0.794	0.0233	0.31	0.747	0.0452	0.62	0.6578	0.9513	1966858	Cerep_001526	CC(C)(C)OC(=O)N(CCOC(=O)N1CCCC1C(=O)OCc2ccc(cc2)[N+](=O)[O-])Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M09	compound treatment	0.752	-0.0187	-0.25	0.674	-0.0278	-0.38	-0.4467	-0.9803	1966859	Cerep_001527	CC(COC(=O)NNC(=O)c1csc(C)n1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M10	compound treatment	0.79	0.0193	0.26	0.719	0.0172	0.23	0.3497	0.9986	1966860	Cerep_001528	COc1ccc(OC)c(COC(=O)NCc2ccc3OCCc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M11	compound treatment	0.791	0.0203	0.27	0.726	0.0242	0.33	0.4267	0.9958	1966861	Cerep_001529	[O-][N+](=O)c1ccc(cc1)N2CCCC2COC(=O)NNC(=O)c3ccccc3n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M12	compound treatment	0.775	0.0043	0.06	0.706	0.00417	0.06	0.0813	0.9999	1966862	Cerep_001530	COc1cc(CCNC(=O)OCCc2ccccc2Cl)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M13	compound treatment	0.794	0.0233	0.31	0.692	-0.00983	-0.13	0.1275	0.3731	1966863	Cerep_001531	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCc3ccccc3OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M14	compound treatment	0.807	0.0363	0.49	0.708	0.00617	0.08	0.4058	0.8166	1966864	Cerep_001532	CN1CCN(CCCNC(=O)OCCc2ccc(C)cc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M15	compound treatment	0.748	-0.0227	-0.31	0.698	-0.00383	-0.05	-0.2534	-0.816	1966865	Cerep_001533	Clc1ccc(cc1)C(NC(=O)OCCc2ccccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M16	compound treatment	0.796	0.0253	0.34	0.696	-0.00583	-0.08	0.1852	0.5283	1966866	Cerep_001534	COc1cc(ccc1O)C(=O)NNC(=O)OCCc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M17	compound treatment	0.814	0.0433	0.58	0.691	-0.0108	-0.15	0.3087	0.5122	1966867	Cerep_001535	Cc1cccc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M18	compound treatment	0.792	0.0213	0.29	0.713	0.0112	0.15	0.3109	0.9559	1966868	Cerep_001536	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccc(cc5)C(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M19	compound treatment	0.769	-0.0017	-0.02	0.716	0.0142	0.19	0.1204	0.6191	1966869	Cerep_001537	COc1ccc(CN2CCCC(COC(=O)N3CCN(CC3)c4ccccc4O)C2)cc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M20	compound treatment	0.786	0.0153	0.21	0.719	0.0172	0.23	0.3115	0.998	1966870	Cerep_001538	Fc1ccccc1CCOC(=O)N2CCN(CC2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M21	compound treatment	0.796	0.0253	0.34	0.745	0.0432	0.59	0.6576	0.9664	1966871	Cerep_001539	COc1ccc(CCCOC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	M22	compound treatment	0.812	0.0413	0.56	0.739	0.0372	0.51	0.7524	0.9989	1966872	Cerep_001540	C=CCOc1ccccc1COC(=O)NCc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N03	compound treatment	0.799	0.0283	0.38	0.728	0.0262	0.36	0.5223	0.9994	1966873	Cerep_001541	CC(C)(C)c1ccc(O)c(NC(=O)OCCC2=CCC3CC2C3(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N04	compound treatment	0.79	0.0193	0.26	0.689	-0.0128	-0.17	0.0604	0.1926	1966874	Cerep_001542	CC(C(=O)NCCOc1ccccc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N05	compound treatment	0.785	0.0143	0.19	0.703	0.00117	0.02	0.1477	0.7629	1966875	Cerep_001543	Brc1ccc(CCOC(=O)NCCN2CCOCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N06	compound treatment	0.768	-0.0027	-0.04	0.688	-0.0138	-0.19	-0.1591	-0.8282	1966876	Cerep_001544	Cn1c(cc2ccccc12)C(=O)NCCCN3CCCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N07	compound treatment	0.761	-0.0097	-0.13	0.763	0.0612	0.83	0.4973	0.589	1966877	Cerep_001545	O=C(Cc1csc(n1)c2ccccc2)NNC(=O)OCc3ccc(/C=C/c4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N08	compound treatment	0.758	-0.0127	-0.17	0.719	0.0172	0.23	0.0444	0.1532	1966878	Cerep_001546	CC(C)(C)OC(=O)NC(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)N1CCN(Cc2ccc(OCC=C)cc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N09	compound treatment	0.768	-0.0027	-0.04	0.662	-0.0398	-0.54	-0.4098	-0.7528	1966879	Cerep_001547	CC(C)Oc1ccc(CN2CCC(C2)NC(=O)OCc3c(C)noc3c4cc(C)on4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N10	compound treatment	0.77	-6.96E-4	-0.01	0.656	-0.0458	-0.62	-0.4486	-0.7176	1966880	Cerep_001548	COc1ccccc1C(=O)NNC(=O)c2cc3ccccc3n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N11	compound treatment	0.789	0.0183	0.25	0.713	0.0112	0.15	0.2823	0.973	1966881	Cerep_001549	CC(COC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N12	compound treatment	0.769	-0.0017	-0.02	0.706	0.00417	0.06	0.024	0.392	1966882	Cerep_001550	CCOC(=O)CC(=O)NNC(=O)c1cc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N13	compound treatment	0.807	0.0363	0.49	0.687	-0.0148	-0.2	0.2033	0.3837	1966883	Cerep_001551	Cc1cc(C)c(CCOC(=O)NNC(=O)COc2cccc3CC(C)(C)Oc32)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N14	compound treatment	0.795	0.0243	0.33	0.717	0.0152	0.21	0.3781	0.9753	1966884	Cerep_001552	CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)NNC(=O)C(Cc2c[nH]cn2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N15	compound treatment	0.743	-0.0277	-0.37	0.71	0.00817	0.11	-0.1854	-0.4756	1966885	Cerep_001553	O=C(NCCNc1ccccc1)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N16	compound treatment	0.778	0.0073	0.1	0.697	-0.00483	-0.07	0.0231	0.1949	1966886	Cerep_001554	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)N3CCN(CC3)c4ccc(cn4)C(F)(F)F)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N17	compound treatment	0.786	0.0153	0.21	0.693	-0.00883	-0.12	0.0608	0.2546	1966887	Cerep_001555	Cc1nc(cs1)C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N18	compound treatment	0.766	-0.0047	-0.06	0.693	-0.00883	-0.12	-0.1299	-0.955	1966888	Cerep_001556	Cc1cc([nH]n1)C(=O)NNC(=O)CCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N19	compound treatment	0.773	0.0023	0.03	0.689	-0.0128	-0.17	-0.1017	-0.5725	1966889	Cerep_001557	CCn1c2ccccc2c3cc(CN(CCOC(=O)NC(Cc4c[nH]c5ccccc45)C(=O)OC)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N20	compound treatment	0.76	-0.0107	-0.14	0.716	0.0142	0.19	0.0346	0.1435	1966890	Cerep_001558	Cn1c(CCC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N21	compound treatment	0.799	0.0283	0.38	0.744	0.0422	0.58	0.6766	0.9802	1966891	Cerep_001559	Brc1ccc(CCOC(=O)NNC(=O)c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	N22	compound treatment	0.76	-0.0107	-0.14	0.694	-0.00783	-0.11	-0.1775	-0.989	1966892	Cerep_001560	FC(F)(F)c1ccc(SCc2ccc(o2)C(=O)NNC(=O)CC(c3ccccc3)(c4ccccc4)c5ccccc5)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O03	compound treatment	0.788	0.0173	0.23	0.716	0.0142	0.19	0.3017	0.9956	1966893	Cerep_001561	CC(COC(=O)NNC(=O)c1ccccc1NC(=O)c2c(F)cccc2F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O04	compound treatment	0.79	0.0193	0.26	0.729	0.0272	0.37	0.4461	0.9851	1966894	Cerep_001562	COc1ccc(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O05	compound treatment	0.795	0.0243	0.33	0.726	0.0242	0.33	0.4649	1.0	1966895	Cerep_001563	CC(=CCC/C(=C\COC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3)/C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O06	compound treatment	0.789	0.0183	0.25	0.729	0.0272	0.37	0.4366	0.9806	1966896	Cerep_001564	COc1cccc(COC(=O)N2CCN(Cc3ccccc3SC(C)(C)C)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O07	compound treatment	0.791	0.0203	0.27	0.723	0.0212	0.29	0.3978	0.9997	1966897	Cerep_001565	COc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)CC2)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O08	compound treatment	0.792	0.0213	0.29	0.734	0.0322	0.44	0.5134	0.979	1966898	Cerep_001566	COc1ccc(CC(=O)NNC(=O)OCCCC2CCCCC2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O09	compound treatment	0.857	0.0863	1.16	0.751	0.0492	0.67	1.2974	0.9656	1966899	Cerep_001567	CN(C)CCCCCCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O10	compound treatment	0.772	0.0013	0.02	0.693	-0.00883	-0.12	-0.0727	-0.5975	1966900	Cerep_001568	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3ccc(C)cc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O11	compound treatment	0.787	0.0163	0.22	0.715	0.0132	0.18	0.2825	0.9949	1966901	Cerep_001569	OC(C1CCN(CC1)C(=O)OCCN2CCNC2=S)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O12	compound treatment	0.812	0.0413	0.56	0.738	0.0362	0.49	0.7428	0.9981	1966902	Cerep_001570	COc1cc(CCNC(=O)OCCc2ccccc2OC)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O13	compound treatment	0.763	-0.0077	-0.1	0.738	0.0362	0.49	0.2753	0.5463	1966903	Cerep_001571	COc1ccc(CN2CCCCC2COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O14	compound treatment	0.785	0.0143	0.19	0.729	0.0272	0.37	0.3984	0.9538	1966904	Cerep_001572	CC(CCOC(=O)NCCNC(=O)C)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O15	compound treatment	0.789	0.0183	0.25	0.726	0.0242	0.33	0.4077	0.9899	1966905	Cerep_001573	COc1ccccc1CCOC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O16	compound treatment	0.787	0.0163	0.22	0.711	0.00917	0.13	0.2439	0.9642	1966906	Cerep_001574	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCCCCCCl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O17	compound treatment	0.769	-0.0017	-0.02	0.734	0.0322	0.44	0.294	0.6693	1966907	Cerep_001575	Clc1ccc2[nH]cc(CCNC(=O)OCc3cc4OCOc4cc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O18	compound treatment	0.789	0.0183	0.25	0.739	0.0372	0.51	0.533	0.9454	1966908	Cerep_001576	OC1(CCN(CC1)C(=O)OCc2ccccc2[N+](=O)[O-])c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O19	compound treatment	0.781	0.0103	0.14	0.71	0.00817	0.11	0.1771	0.994	1966909	Cerep_001577	Cc1ncc([N+](=O)[O-])n1CCNC(=O)OCc2ccccc2Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O20	compound treatment	0.76	-0.0107	-0.14	0.728	0.0262	0.36	0.1503	0.3905	1966910	Cerep_001578	Fc1ccc(/C=C/C(=O)NNC(=O)OCCc2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O21	compound treatment	0.792	0.0213	0.29	0.732	0.0302	0.41	0.4941	0.9846	1966911	Cerep_001579	CN(CCc1ccccn1)C(=O)OCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	O22	compound treatment	0.796	0.0253	0.34	0.715	0.0132	0.18	0.3684	0.955	1966912	Cerep_001580	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccc(cc4)N5CCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P03	compound treatment	0.812	0.0413	0.56	0.727	0.0252	0.34	0.6367	0.9729	1966913	Cerep_001581	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(CC4)C(=O)c5ccc(OC)c(F)c5)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P04	compound treatment	0.768	-0.0027	-0.04	0.712	0.0102	0.14	0.0723	0.5046	1966914	Cerep_001582	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)N3CCN(Cc4ccc(cc4)C(C)(C)C)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P05	compound treatment	0.766	-0.0047	-0.06	0.711	0.00917	0.13	0.0436	0.3112	1966915	Cerep_001583	NC(=O)C1CCN(CC1)C(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P06	compound treatment	0.734	-0.0367	-0.5	0.703	0.00117	0.02	-0.3388	-0.684	1966916	Cerep_001584	COc1cccc(CN2CCC(C2)NC(=O)CCc3c[nH]c4ccccc34)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P07	compound treatment	0.77	-6.96E-4	-0.01	0.703	0.00117	0.02	0.0046	0.2505	1966917	Cerep_001585	CCCOCCOC(=O)NNC(=O)c1noc(C)c1c2csc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P08	compound treatment	0.747	-0.0237	-0.32	0.7	-0.00183	-0.02	-0.2437	-0.76	1966918	Cerep_001586	O=C(CCCCCNC(=O)OCc1ccccc1)NCCc2c[nH]cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P09	compound treatment	0.656	-0.115	-1.55	0.611	-0.0908	-1.24	-1.9699	-0.9939	1966919	Cerep_001587	O=C(OCC1CCCCN1Cc2ccncc2)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P10	compound treatment	0.05	-0.721	-9.72	0.069	-0.633	-8.63	-12.977	-0.9982	1966920	Cerep_001588	FC(F)(F)c1cccc(c1)N2CCN(CC2)C(=O)c3ccc4[nH]nnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P11	compound treatment	0.745	-0.0257	-0.35	0.714	0.0122	0.17	-0.1278	-0.3325	1966921	Cerep_001589	Fc1ccc(COC(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P12	compound treatment	0.731	-0.0397	-0.54	0.702	1.69E-4	0.0	-0.377	-0.7041	1966922	Cerep_001590	CN(CCCNC(=O)c1cc2ccccc2n1C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P13	compound treatment	0.768	-0.0027	-0.04	0.728	0.0262	0.36	0.2266	0.6318	1966923	Cerep_001591	COCCCCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P14	compound treatment	0.763	-0.0077	-0.1	0.699	-0.00283	-0.04	-0.1007	-0.9092	1966924	Cerep_001592	CC(C)(C)OC(=O)NC1CCN(C1)C(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P15	compound treatment	0.786	0.0153	0.21	0.7	-0.00183	-0.02	0.1283	0.6171	1966925	Cerep_001593	COc1ccc(CCCOC(=O)NC(C)C(=O)Nc2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P16	compound treatment	0.756	-0.0147	-0.2	0.706	0.00417	0.06	-0.1	-0.4848	1966926	Cerep_001594	CC/1=C(CC(=O)NNC(=O)c2sc(nc2C)c3cccc(c3)n4cccc4)c5cc(F)ccc5\C1=C/c6ccc(cc6)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P17	compound treatment	0.764	-0.0067	-0.09	0.721	0.0192	0.26	0.121	0.4374	1966927	Cerep_001595	Fc1cccc(F)c1COC(=O)N2CCN(CC2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P18	compound treatment	0.775	0.0043	0.06	0.669	-0.0328	-0.45	-0.2755	-0.6103	1966928	Cerep_001596	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3cc(C)n(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P19	compound treatment	0.787	0.0163	0.22	0.718	0.0162	0.22	0.3114	1.0	1966929	Cerep_001597	CC(C)(C)OC(=O)N(CCOC(=O)NCc1nc2ccccc2[nH]1)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P20	compound treatment	0.756	-0.0147	-0.2	0.677	-0.0248	-0.34	-0.3796	-0.9675	1966930	Cerep_001598	COc1ccccc1CNC(=O)C(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P21	compound treatment	0.77	-6.96E-4	-0.01	0.719	0.0172	0.23	0.1589	0.6782	1966931	Cerep_001599	CN1CCCC1CCNC(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.530	P22	compound treatment	0.741	-0.0297	-0.4	0.716	0.0142	0.19	-0.1467	-0.3297	1966932	Cerep_001600	O=C(NCCc1c[nH]cn1)c2ccc(CSc3ccccn3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A03	compound treatment	0.752	-0.0295	-0.4	0.725	0.0051	0.07	-0.2319	-0.5747	1966933	Cerep_001601	COc1cc(CN(Cc2ccco2)C(=O)NC(COc3ccccc3)c4ccc5OCCOc5c4)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A04	compound treatment	0.821	0.0395	0.53	0.725	0.0051	0.07	0.4263	0.7925	1966934	Cerep_001602	CCOc1ccc(CCNC(=O)N(CC)CCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A05	compound treatment	0.79	0.00854	0.12	0.708	-0.0119	-0.16	-0.0333	-0.1674	1966935	Cerep_001603	O=C(NCCc1c[nH]c2ccccc12)N(CCc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A06	compound treatment	0.813	0.0315	0.43	0.707	-0.0129	-0.18	0.1764	0.3832	1966936	Cerep_001604	O=C(N/N=C/c1ccnc2ccccc12)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A07	compound treatment	0.793	0.0115	0.16	0.725	0.0051	0.07	0.1592	0.934	1966937	Cerep_001605	COc1cc(CNC(=O)N(C)CCc2ccccn2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A08	compound treatment	0.809	0.0275	0.37	0.718	-0.0019	-0.03	0.2444	0.6561	1966938	Cerep_001606	O=C(N/N=C/c1cccc2OCOc21)c3ccccc3CCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A09	compound treatment	0.785	0.00354	0.05	0.682	-0.0379	-0.52	-0.3317	-0.6391	1966939	Cerep_001607	Cc1oc(nc1CC(=O)N2CCN(Cc3cccc(C)n3)CC2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A10	compound treatment	0.801	0.0195	0.26	0.725	0.0051	0.07	0.2355	0.864	1966940	Cerep_001608	O=C(N/N=C/c1cc2ccccc2o1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A11	compound treatment	0.796	0.0145	0.2	0.69	-0.0299	-0.41	-0.1496	-0.3307	1966941	Cerep_001609	CN(CCO)C(=O)NCc1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A12	compound treatment	0.802	0.0205	0.28	0.734	0.0141	0.19	0.3319	0.984	1966942	Cerep_001610	[O-][N+](=O)c1cc(/C=N/NC(=O)c2ccco2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A13	compound treatment	0.769	-0.0125	-0.17	0.717	-0.0029	-0.04	-0.1469	-0.8504	1966943	Cerep_001611	CC(C)Oc1ccc(CN(Cc2ccco2)C(=O)NC3CCN(Cc4ccc5ccccc5c4)C3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A14	compound treatment	0.791	0.00954	0.13	0.706	-0.0139	-0.19	-0.0431	-0.1879	1966944	Cerep_001612	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A15	compound treatment	0.779	-0.00246	-0.03	0.707	-0.0129	-0.18	-0.1479	-0.826	1966945	Cerep_001613	Clc1ccc(Sc2ccccc2CN3CCC(C3)NC(=O)N(Cc4ccco4)Cc5cc6ccccc6o5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A16	compound treatment	0.819	0.0375	0.51	0.727	0.0071	0.1	0.4265	0.8273	1966946	Cerep_001614	COc1ccc(/C=N/NC(=O)c2ccc[nH]2)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A17	compound treatment	0.778	-0.00346	-0.05	0.719	-9.03E-4	-0.01	-0.0417	-0.864	1966947	Cerep_001615	Cc1noc(c1C(=O)NNC(=O)NC2CCN(Cc3ccccc3)CC2)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A18	compound treatment	0.791	0.00954	0.13	0.717	-0.0029	-0.04	0.063	0.468	1966948	Cerep_001616	Cn1cc(/C=N/NC(=O)Nc2ccccc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A19	compound treatment	0.792	0.0105	0.14	0.71	-0.0099	-0.14	0.005	0.0258	1966949	Cerep_001617	CCOC(=O)CCNC(=O)NCc1nc2ccccc2[nH]1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A20	compound treatment	0.813	0.0315	0.43	0.718	-0.0019	-0.03	0.2825	0.6628	1966950	Cerep_001618	O=C(N/N=C/c1c[nH]c2cnc(OCc3ccccc3)cc12)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A21	compound treatment	0.797	0.0155	0.21	0.726	0.0061	0.08	0.207	0.918	1966951	Cerep_001619	COc1ccc(OCCNC(=O)N2CCN(CC2)c3cnccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	A22	compound treatment	0.794	0.0125	0.17	0.719	-9.03E-4	-0.01	0.1109	0.6539	1966952	Cerep_001620	O=C(N/N=C/c1ccnc2ccccc12)c3ccccc3Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B03	compound treatment	0.821	0.0395	0.53	0.739	0.0191	0.26	0.5613	0.9456	1966953	Cerep_001621	CCN1CC(CN1CC)NS(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B04	compound treatment	0.757	-0.0245	-0.33	0.703	-0.0169	-0.23	-0.3963	-0.9846	1966954	Cerep_001622	CC(=O)NCCNS(=O)(=O)c1cc(Cl)sc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B05	compound treatment	0.792	0.0105	0.14	0.756	0.0361	0.49	0.4486	0.8756	1233553	Cerep_001623	Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B06	compound treatment	0.793	0.0115	0.16	0.697	-0.0229	-0.31	-0.1108	-0.3174	1966955	Cerep_001624	Cc1cccc(c1)S(=O)(=O)N2CCCC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B07	compound treatment	0.802	0.0205	0.28	0.715	-0.0049	-0.07	0.1487	0.5215	1966956	Cerep_001625	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCc3ccccc3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B08	compound treatment	0.763	-0.0185	-0.25	0.711	-0.0089	-0.12	-0.2619	-0.9454	1966957	Cerep_001626	CC1(C)CCCN(C1)S(=O)(=O)c2cc(F)c(Br)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B09	compound treatment	0.795	0.0135	0.18	0.718	-0.0019	-0.03	0.1108	0.6006	1966958	Cerep_001627	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2S(=O)(=O)c3cccc4nonc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B10	compound treatment	0.808	0.0265	0.36	0.71	-0.0099	-0.14	0.1577	0.4121	1966959	Cerep_001628	COc1cccc(c1)C2N(CCc3c2[nH]c4ccccc34)S(=O)(=O)c5cc(F)c(Br)cc5F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B11	compound treatment	0.762	-0.0195	-0.26	0.728	0.0081	0.11	-0.1076	-0.3777	1966960	Cerep_001629	OC1(CCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B12	compound treatment	0.765	-0.0165	-0.22	0.694	-0.0259	-0.35	-0.4068	-0.975	1966961	Cerep_001630	CC(C)(C)OC(=O)C(NS(=O)(=O)c1cccc(F)c1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B13	compound treatment	0.774	-0.00746	-0.1	0.711	-0.0089	-0.12	-0.157	-0.9957	1966962	Cerep_001631	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)N3CCCC3C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B14	compound treatment	0.772	-0.00946	-0.13	0.702	-0.0179	-0.24	-0.2629	-0.9542	1966963	Cerep_001632	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccnc4ccccc34)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B15	compound treatment	0.774	-0.00746	-0.1	0.732	0.0121	0.16	0.0455	0.2353	1966964	Cerep_001633	O=S(=O)(NCCc1ccccn1)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B16	compound treatment	0.774	-0.00746	-0.1	0.696	-0.0239	-0.33	-0.3017	-0.8843	1966965	Cerep_001634	COc1ccc(cc1OC)S(=O)(=O)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B17	compound treatment	0.787	0.00554	0.07	0.734	0.0141	0.19	0.1888	0.9153	1966966	Cerep_001635	Clc1ccc(Cl)c(c1)S(=O)(=O)NCCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B18	compound treatment	0.753	-0.0285	-0.38	0.683	-0.0369	-0.5	-0.6273	-0.9911	1966967	Cerep_001636	CC(=O)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B19	compound treatment	0.794	0.0125	0.17	0.724	0.0041	0.06	0.1591	0.8932	1966968	Cerep_001637	FC(F)(F)c1cc(cc(c1)S(=O)(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B20	compound treatment	0.779	-0.00246	-0.03	0.697	-0.0229	-0.31	-0.2443	-0.7779	1966969	Cerep_001638	FC(F)(F)c1ccnc(c1)N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B21	compound treatment	0.773	-0.00846	-0.11	0.714	-0.0059	-0.08	-0.1376	-0.9854	1966970	Cerep_001639	COc1ccc(Oc2cccc(/C=N/NC(=O)Cc3csc(n3)c4ccccc4)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	B22	compound treatment	0.743	-0.0385	-0.52	0.682	-0.0379	-0.52	-0.7324	-1.0	1966971	Cerep_001640	Fc1cccc(c1)S(=O)(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C03	compound treatment	0.782	5.39E-4	0.01	0.705	-0.0149	-0.2	-0.1386	-0.6814	1966972	Cerep_001641	CCOc1ccc(CN(Cc2ccco2)C(=O)NC3CCN(Cc4cc5OCOc5c(OC)c4)C3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C04	compound treatment	0.833	0.0515	0.7	0.723	0.0031	0.04	0.5215	0.7487	1966973	Cerep_001642	CCOC(=O)CC(=O)N/N=C/c1ccnc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C05	compound treatment	0.791	0.00954	0.13	0.721	0.0011	0.01	0.1016	0.784	1966974	Cerep_001643	[O-][N+](=O)c1ccc(NCCNC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C06	compound treatment	0.8	0.0185	0.25	0.732	0.0121	0.16	0.2935	0.9796	1966975	Cerep_001644	OCCCC(=O)N/N=C/c1cccc2OCOc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C07	compound treatment	0.78	-0.00146	-0.02	0.716	-0.0039	-0.05	-0.0516	-0.9086	1966976	Cerep_001645	COc1cc(CNC(=O)N2CCN(CC(=O)N3CCCC3)CC2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C08	compound treatment	0.796	0.0145	0.2	0.738	0.0181	0.25	0.3132	0.9935	1966977	Cerep_001646	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C09	compound treatment	0.777	-0.00446	-0.06	0.717	-0.0029	-0.04	-0.0705	-0.9793	1966978	Cerep_001647	Cc1ncc([N+](=O)[O-])n1CCNC(=O)N(Cc2ccco2)Cc3cccc(Oc4ccc(Cl)cc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C10	compound treatment	0.759	-0.0225	-0.3	0.718	-0.0019	-0.03	-0.2326	-0.7649	1966979	Cerep_001648	CCOC(=O)CC(=O)N/N=C/c1csc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C11	compound treatment	0.768	-0.0135	-0.18	0.719	-9.03E-4	-0.01	-0.1371	-0.7533	1966980	Cerep_001649	COc1cccc(CNC(=O)NCCC#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C12	compound treatment	0.814	0.0325	0.44	0.721	0.0011	0.01	0.321	0.7308	1966981	Cerep_001650	COc1ccc(cc1OC)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C13	compound treatment	0.753	-0.0285	-0.38	0.711	-0.0089	-0.12	-0.3573	-0.8874	1966982	Cerep_001651	CN(CC(=O)OC(C)(C)C)C(=O)NC1CCN(Cc2ccc3ccccc3c2)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C14	compound treatment	0.747	-0.0345	-0.46	0.734	0.0141	0.19	-0.1928	-0.3832	1966983	Cerep_001652	COc1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C15	compound treatment	0.769	-0.0125	-0.17	0.731	0.0111	0.15	-0.0119	-0.0525	1966984	Cerep_001653	CCOc1ccc(CN(Cc2ccco2)C(=O)NC3CCN(Cc4ccccc4Sc5ccc(Cl)cc5)C3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C16	compound treatment	0.792	0.0105	0.14	0.757	0.0371	0.51	0.4582	0.8721	1966985	Cerep_001654	Cn1cc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C17	compound treatment	0.772	-0.00946	-0.13	0.742	0.0221	0.3	0.1228	0.3753	1966986	Cerep_001655	O=C(Cc1csc(n1)c2ccccc2)NNC(=O)NC3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C18	compound treatment	0.778	-0.00346	-0.05	0.747	0.0271	0.37	0.2283	0.6129	1966987	Cerep_001656	O=C(N/N=C/c1c[nH]c2cnc(OCc3ccccc3)cc12)c4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C19	compound treatment	0.805	0.0235	0.32	0.716	-0.0039	-0.05	0.1869	0.5805	1966988	Cerep_001657	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)CNC(=O)c5ccccc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C20	compound treatment	0.785	0.00354	0.05	0.727	0.0071	0.1	0.1022	0.947	1966989	Cerep_001658	FC(F)(F)c1ccc(nc1)S(=O)(=O)CC(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C21	compound treatment	0.788	0.00654	0.09	0.714	-0.0059	-0.08	0.0055	0.0457	1966990	Cerep_001659	COc1ccc(OCCNC(=O)N2CCN(CC2)C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	C22	compound treatment	0.768	-0.0135	-0.18	0.715	-0.0049	-0.07	-0.1757	-0.9079	1966991	Cerep_001660	CSc1ncc(C(=O)N/N=C/c2cccc3OCOc32)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D03	compound treatment	0.8	0.0185	0.25	0.724	0.0041	0.06	0.2164	0.8443	1966992	Cerep_001661	CN(CCCNS(=O)(=O)c1cc(Cl)ccc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D04	compound treatment	0.781	-4.61E-4	-0.01	0.723	0.0031	0.04	0.0255	0.5966	1966993	Cerep_001662	CSCCC(CO)NS(=O)(=O)c1cc(Cl)sc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D05	compound treatment	0.777	-0.00446	-0.06	0.721	0.0011	0.01	-0.032	-0.5156	1966994	Cerep_001663	COc1ccc(OC)c(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)ccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D06	compound treatment	0.762	-0.0195	-0.26	0.709	-0.0109	-0.15	-0.2908	-0.9637	1408268	Cerep_001664	Cc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3c(C)cccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D07	compound treatment	0.784	0.00254	0.03	0.721	0.0011	0.01	0.0348	0.931	1242113	Cerep_001665	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)NCc3ccccn3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D08	compound treatment	0.778	-0.00346	-0.05	0.691	-0.0289	-0.39	-0.3117	-0.7854	1966995	Cerep_001666	Cc1cccc(C)c1N2CCN(CC2)S(=O)(=O)c3cc(F)c(Br)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D09	compound treatment	0.78	-0.00146	-0.02	0.697	-0.0229	-0.31	-0.2348	-0.7502	1966996	Cerep_001667	Clc1cccc(CCNS(=O)(=O)c2cccc3nonc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D10	compound treatment	0.787	0.00554	0.07	0.712	-0.0079	-0.11	-0.0234	-0.1781	1966997	Cerep_001668	COc1ccc2[nH]cc(CCNS(=O)(=O)c3cc(F)c(Br)cc3F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D11	compound treatment	0.785	0.00354	0.05	0.706	-0.0139	-0.19	-0.1003	-0.513	1966998	Cerep_001669	CCN(CC)CCNS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D12	compound treatment	0.776	-0.00546	-0.07	0.678	-0.0419	-0.57	-0.4561	-0.7917	1966999	Cerep_001670	Fc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D13	compound treatment	0.794	0.0125	0.17	0.733	0.0131	0.18	0.2459	0.9996	1967000	Cerep_001671	OCC(NS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D14	compound treatment	0.74	-0.0415	-0.56	0.686	-0.0339	-0.46	-0.7224	-0.9955	1967001	Cerep_001672	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3cc(Br)c(OC)cc3OC)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D15	compound treatment	0.791	0.00954	0.13	0.718	-0.0019	-0.03	0.0726	0.5534	1967002	Cerep_001673	O=S(=O)(NC1CCN(CC1)c2ccccc2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D16	compound treatment	0.791	0.00954	0.13	0.716	-0.0039	-0.05	0.0534	0.3832	1967003	Cerep_001674	COc1ccc(cc1OC)S(=O)(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D17	compound treatment	0.794	0.0125	0.17	0.716	-0.0039	-0.05	0.082	0.4623	1158544	Cerep_001675	Clc1ccc(Cl)c(c1)S(=O)(=O)NCC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D18	compound treatment	0.77	-0.0115	-0.15	0.687	-0.0329	-0.45	-0.4266	-0.8989	1967004	Cerep_001676	CC1(C)OCC(NS(=O)(=O)c2ccccc2Br)C(O1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D19	compound treatment	0.776	-0.00546	-0.07	0.715	-0.0049	-0.07	-0.0994	-0.9988	1967005	Cerep_001677	Cc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D20	compound treatment	0.754	-0.0275	-0.37	0.735	0.0151	0.21	-0.1164	-0.2746	1967006	Cerep_001678	Clc1cc(c(Cl)s1)S(=O)(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D21	compound treatment	0.782	5.39E-4	0.01	0.724	0.0041	0.06	0.0447	0.7925	1967007	Cerep_001679	Cc1ccc(Oc2cccc(/C=N/NC(=O)Cc3csc(n3)c4ccccc4)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	D22	compound treatment	0.77	-0.0115	-0.15	0.715	-0.0049	-0.07	-0.1566	-0.9297	1967008	Cerep_001680	Fc1cccc(c1)S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E03	compound treatment	0.784	0.00254	0.03	0.718	-0.0019	-0.03	0.0059	0.1367	1967009	Cerep_001681	CCN(Cc1ccncc1)C(=O)NC(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E04	compound treatment	0.764	-0.0175	-0.24	0.725	0.0051	0.07	-0.1174	-0.4781	1967010	Cerep_001682	Clc1ccc(Cl)c(c1)C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E05	compound treatment	0.799	0.0175	0.24	0.736	0.0161	0.22	0.3225	0.9993	1967011	Cerep_001683	CSCCNC(=O)NCCNc1ccc(cn1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E06	compound treatment	0.801	0.0195	0.26	0.707	-0.0129	-0.18	0.062	0.1956	1967012	Cerep_001684	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E07	compound treatment	0.787	0.00554	0.07	0.717	-0.0029	-0.04	0.0248	0.2939	1967013	Cerep_001685	FC(F)(F)c1cccc(c1)N2CCN(CC2)C(=O)NC3CCN(Cc4ccccc4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E08	compound treatment	0.823	0.0415	0.56	0.727	0.0071	0.1	0.4647	0.8171	1967014	Cerep_001686	COc1ccc(cc1OC)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E09	compound treatment	0.773	-0.00846	-0.11	0.719	-9.03E-4	-0.01	-0.0894	-0.7789	1967015	Cerep_001687	Cc1ncc([N+](=O)[O-])n1CCNC(=O)N(Cc2ccco2)Cc3ccccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E10	compound treatment	0.774	-0.00746	-0.1	0.727	0.0071	0.1	-0.0027	-0.0196	1967016	Cerep_001688	[O-][N+](=O)c1cc(/C=N/NC(=O)c2cc(Cl)ccc2Cl)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E11	compound treatment	0.749	-0.0325	-0.44	0.705	-0.0149	-0.2	-0.4534	-0.9391	1967017	Cerep_001689	COc1cccc(CNC(=O)NCCNC(=O)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E12	compound treatment	0.785	0.00354	0.05	0.731	0.0111	0.15	0.1408	0.8871	1967018	Cerep_001690	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E13	compound treatment	0.766	-0.0155	-0.21	0.729	0.0091	0.12	-0.0598	-0.2463	1967019	Cerep_001691	CN(C)c1ccc(CNC(=O)N(Cc2ccco2)Cc3ccc(OCc4ccccc4)c(OCc5ccccc5)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E14	compound treatment	0.774	-0.00746	-0.1	0.698	-0.0219	-0.3	-0.2824	-0.8959	1967020	Cerep_001692	COc1ccc(/C=N/NC(=O)c2ccccc2OC)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E15	compound treatment	0.787	0.00554	0.07	0.725	0.0051	0.07	0.102	0.9993	1967021	Cerep_001693	CC(C)Oc1ccc(CN(Cc2ccco2)C(=O)NC3CCN(Cc4ccccc4Sc5ccc(Cl)cc5)C3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E16	compound treatment	0.799	0.0175	0.24	0.705	-0.0149	-0.2	0.0236	0.0757	1967022	Cerep_001694	Cn1cc(/C=N/NC(=O)c2ccncc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E17	compound treatment	0.772	-0.00946	-0.13	0.713	-0.0069	-0.09	-0.1568	-0.9888	1967023	Cerep_001695	FC(F)(F)c1ccc(SCc2ccc(o2)C(=O)NNC(=O)NC3CCN(Cc4ccccc4)CC3)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E18	compound treatment	0.783	0.00154	0.02	0.713	-0.0069	-0.09	-0.0519	-0.5382	1967024	Cerep_001696	COc1ccc(cc1OC)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E19	compound treatment	0.804	0.0225	0.3	0.718	-0.0019	-0.03	0.1967	0.6444	1967025	Cerep_001697	CCN(CCc1ccccn1)C(=O)NCC2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E20	compound treatment	0.794	0.0125	0.17	0.722	0.0021	0.03	0.1398	0.8151	1967026	Cerep_001698	O=C(N/N=C/c1ccnc2ccccc12)c3cc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E21	compound treatment	0.79	0.00854	0.12	0.721	0.0011	0.01	0.092	0.7923	1967027	Cerep_001699	CN(C)CCCNC(=O)NCc1ccc(c(F)c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	E22	compound treatment	0.792	0.0105	0.14	0.734	0.0141	0.19	0.2365	0.989	1967028	Cerep_001700	CN(C)c1ccc(cc1)C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F03	compound treatment	0.788	0.00654	0.09	0.718	-0.0019	-0.03	0.044	0.4788	1967029	Cerep_001701	OCCOCCNS(=O)(=O)c1cc(Cl)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F04	compound treatment	0.764	-0.0175	-0.24	0.681	-0.0389	-0.53	-0.5417	-0.9332	1635931	Cerep_001702	Fc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F05	compound treatment	0.785	0.00354	0.05	0.735	0.0151	0.21	0.1793	0.8486	1967030	Cerep_001703	CCCc1ccc(cc1)S(=O)(=O)NC(CC(C)C)C(=O)NNC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F06	compound treatment	0.757	-0.0245	-0.33	0.701	-0.0189	-0.26	-0.4156	-0.9925	1967031	Cerep_001704	Cc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F07	compound treatment	0.786	0.00454	0.06	0.724	0.0041	0.06	0.0828	0.999	1650754	Cerep_001705	COc1cccc(CNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F08	compound treatment	0.767	-0.0145	-0.2	0.708	-0.0119	-0.16	-0.2527	-0.9958	1967032	Cerep_001706	Fc1cc(c(F)cc1Br)S(=O)(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F09	compound treatment	0.78	-0.00146	-0.02	0.707	-0.0129	-0.18	-0.1383	-0.7814	1967033	Cerep_001707	CCN(CCNS(=O)(=O)c1cccc2nonc12)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F10	compound treatment	0.791	0.00954	0.13	0.722	0.0021	0.03	0.1112	0.8437	1967034	Cerep_001708	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)S(=O)(=O)c3cc(F)c(Br)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F11	compound treatment	0.777	-0.00446	-0.06	0.685	-0.0349	-0.48	-0.3791	-0.7902	1967035	Cerep_001709	OCCN1CCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F12	compound treatment	0.771	-0.0105	-0.14	0.704	-0.0159	-0.22	-0.2531	-0.9783	1967036	Cerep_001710	CC(C)(C)OC(=O)C1CCCN1S(=O)(=O)c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F13	compound treatment	0.803	0.0215	0.29	0.718	-0.0019	-0.03	0.1871	0.6414	1967037	Cerep_001711	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2S(=O)(=O)c3ccc4CCN(Cc4c3)C(=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F14	compound treatment	0.768	-0.0135	-0.18	0.706	-0.0139	-0.19	-0.2625	-0.9998	1967038	Cerep_001712	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F15	compound treatment	0.785	0.00354	0.05	0.729	0.0091	0.12	0.1215	0.9139	1967039	Cerep_001713	COc1ccc(CNS(=O)(=O)c2ccc(C#N)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F16	compound treatment	0.785	0.00354	0.05	0.723	0.0031	0.04	0.0636	0.9981	1967040	Cerep_001714	COc1ccc(cc1OC)S(=O)(=O)NCc2cccc(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F17	compound treatment	0.777	-0.00446	-0.06	0.725	0.0051	0.07	0.0066	0.0717	1182746	Cerep_001715	Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F18	compound treatment	0.776	-0.00546	-0.07	0.711	-0.0089	-0.12	-0.1379	-0.9713	1967041	Cerep_001716	Brc1ccccc1S(=O)(=O)NC2CCN(Cc3ccccc3OCc4ccccc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F19	compound treatment	0.799	0.0175	0.24	0.723	0.0031	0.04	0.1972	0.8204	1967042	Cerep_001717	[O-][N+](=O)c1ccc(NCCNS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F20	compound treatment	0.77	-0.0115	-0.15	0.689	-0.0309	-0.42	-0.4073	-0.9074	1967043	Cerep_001718	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F21	compound treatment	0.777	-0.00446	-0.06	0.751	0.0311	0.42	0.2573	0.6007	1967044	Cerep_001719	O=C(Nc1ccccc1C(=O)N/N=C/c2cccc(Oc3ccccc3)c2)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	F22	compound treatment	0.774	-0.00746	-0.1	0.707	-0.0129	-0.18	-0.1956	-0.9649	1967045	Cerep_001720	COc1cccc(CN2CCN(CC2)S(=O)(=O)c3cccc(F)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G03	compound treatment	0.774	-0.00746	-0.1	0.695	-0.0249	-0.34	-0.3113	-0.8789	1967046	Cerep_001721	CN(Cc1cccnc1)C(=O)NC(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G04	compound treatment	0.799	0.0175	0.24	0.726	0.0061	0.08	0.2261	0.9015	1967047	Cerep_001722	Clc1ccccc1OCC(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G05	compound treatment	0.776	-0.00546	-0.07	0.703	-0.0169	-0.23	-0.2151	-0.8888	1967048	Cerep_001723	Cn1cccc1C(=O)NNC(=O)NCCNc2ccc(cn2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G06	compound treatment	0.802	0.0205	0.28	0.701	-0.0189	-0.26	0.0137	0.0361	1967049	Cerep_001724	COc1ccc(CC(=O)N/N=C/c2cccc3OCOc32)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G07	compound treatment	0.774	-0.00746	-0.1	0.753	0.0331	0.45	0.248	0.5362	1967050	Cerep_001725	FC(F)(F)c1cccc(CCNC(=O)NC2CCN(Cc3ccccc3)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G08	compound treatment	0.785	0.00354	0.05	0.729	0.0091	0.12	0.1215	0.9139	1967051	Cerep_001726	O=C(N/N=C/c1cc2ccccc2o1)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G09	compound treatment	0.776	-0.00546	-0.07	0.713	-0.0069	-0.09	-0.1187	-0.9926	1967052	Cerep_001727	COCCN(CCOC)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G10	compound treatment	0.765	-0.0165	-0.22	0.713	-0.0069	-0.09	-0.2236	-0.927	1967053	Cerep_001728	[O-][N+](=O)c1cc(/C=N/NC(=O)COc2ccccc2Cl)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G11	compound treatment	0.774	-0.00746	-0.1	0.716	-0.0039	-0.05	-0.1088	-0.9556	1967054	Cerep_001729	CC(=O)NCCNC(=O)NCCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G12	compound treatment	0.804	0.0225	0.3	0.735	0.0151	0.21	0.3606	0.982	1967055	Cerep_001730	COc1cc(cc(OC)c1OC)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G13	compound treatment	0.77	-0.0115	-0.15	0.716	-0.0039	-0.05	-0.147	-0.8988	1967056	Cerep_001731	C=CCOc1ccc(CN2CCN(CC2)C(=O)CCCCC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G14	compound treatment	0.795	0.0135	0.18	0.723	0.0031	0.04	0.159	0.8482	1967057	Cerep_001732	COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G15	compound treatment	0.774	-0.00746	-0.1	0.711	-0.0089	-0.12	-0.157	-0.9957	1967058	Cerep_001733	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NCCCN3CCCCC3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G16	compound treatment	0.782	5.39E-4	0.01	0.724	0.0041	0.06	0.0447	0.7925	1967059	Cerep_001734	Cn1cc(/C=N/NC(=O)c2cccc(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G17	compound treatment	0.794	0.0125	0.17	0.819	0.0991	1.35	1.0752	0.7895	1967060	Cerep_001735	COc1ccc(N2CCN(CC2)C(=O)NC3CCN(Cc4ccccc4)CC3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G18	compound treatment	0.808	0.0265	0.36	0.706	-0.0139	-0.19	0.1191	0.294	1967061	Cerep_001736	COc1cc(cc(OC)c1OC)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G19	compound treatment	0.798	0.0165	0.22	0.733	0.0131	0.18	0.2841	0.9939	1967062	Cerep_001737	Fc1ccc(cc1)C(=O)CCC(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G20	compound treatment	0.786	0.00454	0.06	0.716	-0.0039	-0.05	0.0057	0.0699	1967063	Cerep_001738	Cc1ccc(s1)C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G21	compound treatment	0.788	0.00654	0.09	0.746	0.0261	0.36	0.314	0.8565	1967064	Cerep_001739	CCN(Cc1ccncc1)C(=O)NCCc2c[nH]c3ccc(C)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	G22	compound treatment	0.782	5.39E-4	0.01	0.727	0.0071	0.1	0.0736	0.7581	1967065	Cerep_001740	O=C(N/N=C/c1cccc2OCOc21)c3cc(nc4ccccc34)C5CC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H03	compound treatment	0.779	-0.00246	-0.03	0.707	-0.0129	-0.18	-0.1479	-0.826	1230183	Cerep_001741	OCC1CCCN(C1)S(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H04	compound treatment	0.748	-0.0335	-0.45	0.706	-0.0139	-0.19	-0.4533	-0.9257	1967066	Cerep_001742	Fc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H05	compound treatment	0.805	0.0235	0.32	0.743	0.0231	0.31	0.4473	1.0	1967067	Cerep_001743	CCCc1ccc(cc1)S(=O)(=O)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H06	compound treatment	0.753	-0.0285	-0.38	0.734	0.0141	0.19	-0.1356	-0.3157	1705447	Cerep_001744	CC1CN(CCN1c2ccc(C)cc2)S(=O)(=O)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H07	compound treatment	0.817	0.0355	0.48	0.746	0.0261	0.36	0.5907	0.9892	1967068	Cerep_001745	COc1ccccc1CNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H08	compound treatment	0.764	-0.0175	-0.24	0.698	-0.0219	-0.3	-0.3778	-0.9931	1967069	Cerep_001746	CC1CN(CCN1c2ccc(C)cc2)S(=O)(=O)c3cc(F)c(Br)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H09	compound treatment	0.794	0.0125	0.17	0.711	-0.0089	-0.12	0.0338	0.1622	1967070	Cerep_001747	O=S(=O)(NCCc1ccncc1)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H10	compound treatment	0.751	-0.0305	-0.41	0.72	9.72E-5	0.0	-0.2896	-0.7048	1967071	Cerep_001748	Fc1cc(c(F)cc1Br)S(=O)(=O)NCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H11	compound treatment	0.775	-0.00646	-0.09	0.737	0.0171	0.23	0.1032	0.4147	1967072	Cerep_001749	CCCCCCNS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H12	compound treatment	0.762	-0.0195	-0.26	0.71	-0.0099	-0.14	-0.2811	-0.9522	1967073	Cerep_001750	Fc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3cccc(F)c3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H13	compound treatment	0.776	-0.00546	-0.07	0.725	0.0051	0.07	-0.0029	-0.0291	1967074	Cerep_001751	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H14	compound treatment	0.781	-4.61E-4	-0.01	0.716	-0.0039	-0.05	-0.042	-0.7844	1967075	Cerep_001752	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC2CCN(Cc3c(F)cccc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H15	compound treatment	0.777	-0.00446	-0.06	0.692	-0.0279	-0.38	-0.3116	-0.8089	1967076	Cerep_001753	CC(NS(=O)(=O)c1ccc(C#N)cc1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H16	compound treatment	0.748	-0.0335	-0.45	0.706	-0.0139	-0.19	-0.4533	-0.9257	1967077	Cerep_001754	COc1ccc(cc1OC)S(=O)(=O)N(CCN(C)C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H17	compound treatment	0.766	-0.0155	-0.21	0.756	0.0361	0.49	0.2006	0.3752	1717781	Cerep_001755	COc1ccc(CNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H18	compound treatment	0.741	-0.0405	-0.55	0.702	-0.0179	-0.24	-0.5586	-0.9342	1967078	Cerep_001756	COc1cccc(CN(Cc2ccco2)S(=O)(=O)c3ccccc3Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H19	compound treatment	0.783	0.00154	0.02	0.736	0.0161	0.22	0.1699	0.7706	1967079	Cerep_001757	CCN(CCNS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H20	compound treatment	0.778	-0.00346	-0.05	0.702	-0.0179	-0.24	-0.2056	-0.8273	1967080	Cerep_001758	CN(C)CCCNS(=O)(=O)c1cc(Cl)sc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H21	compound treatment	0.813	0.0315	0.43	0.73	0.0101	0.14	0.3982	0.8905	1967081	Cerep_001759	OC(=O)/C=C/c1ccc(\C=N\NC(=O)c2ccccc2NC(=O)c3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	H22	compound treatment	0.782	5.39E-4	0.01	0.705	-0.0149	-0.2	-0.1386	-0.6814	1967082	Cerep_001760	CC(=O)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I03	compound treatment	0.795	0.0135	0.18	0.725	0.0051	0.07	0.1783	0.9124	1967083	Cerep_001761	FC(F)(F)c1cccc(c1)N2CCN(CC2)C(=O)NCCCn3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I04	compound treatment	0.76	-0.0215	-0.29	0.725	0.0051	0.07	-0.1556	-0.5225	1967084	Cerep_001762	O=C(N/N=C/c1ccnc2ccccc12)c3ccccc3CCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I05	compound treatment	0.76	-0.0215	-0.29	0.707	-0.0129	-0.18	-0.3291	-0.9715	1967085	Cerep_001763	[O-][N+](=O)c1ccc(o1)C(=O)NNC(=O)NCCNc2ccc(cn2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I06	compound treatment	0.777	-0.00446	-0.06	0.715	-0.0049	-0.07	-0.0898	-0.9986	1967086	Cerep_001764	O=C(N/N=C/c1cccc2OCOc21)c3ccccc3Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I07	compound treatment	0.767	-0.0145	-0.2	0.716	-0.0039	-0.05	-0.1756	-0.8683	1967087	Cerep_001765	COc1ccc(CNC(=O)NC2CCN(Cc3ccccc3)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I08	compound treatment	0.802	0.0205	0.28	0.697	-0.0229	-0.31	-0.0249	-0.0597	1967088	Cerep_001766	COc1cc(cc(OC)c1OC)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I09	compound treatment	0.777	-0.00446	-0.06	0.729	0.0091	0.12	0.0452	0.3276	1967089	Cerep_001767	CC(O)CN(CC(C)O)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I10	compound treatment	0.803	0.0215	0.29	0.743	0.0231	0.31	0.4282	0.9992	1967090	Cerep_001768	[O-][N+](=O)c1cc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I11	compound treatment	0.781	-4.61E-4	-0.01	0.707	-0.0129	-0.18	-0.1288	-0.7316	1967091	Cerep_001769	NC(=O)C1CCN(CC1)C(=O)NCc2ccccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I12	compound treatment	0.8	0.0185	0.25	0.754	0.0341	0.46	0.5056	0.9577	1967092	Cerep_001770	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c3ccccc3Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I13	compound treatment	0.781	-4.61E-4	-0.01	0.727	0.0071	0.1	0.064	0.6603	1967093	Cerep_001771	COc1cc(CN2CCC(C2)NC(=O)N(Cc3ccco3)Cc4ccccc4OCc5ccccc5)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I14	compound treatment	0.796	0.0145	0.2	0.721	0.0011	0.01	0.1493	0.7588	1967094	Cerep_001772	CCN(CC)c1ccc(cc1)C(=O)N/N=C/c2ccc(OC)c(C)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I15	compound treatment	0.774	-0.00746	-0.1	0.701	-0.0189	-0.26	-0.2534	-0.9159	1967095	Cerep_001773	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)c5ccc(Oc6ccccc6)cc5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I16	compound treatment	0.762	-0.0195	-0.26	0.718	-0.0019	-0.03	-0.204	-0.7732	1967096	Cerep_001774	Cn1cc(/C=N/NC(=O)COc2ccc(F)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I17	compound treatment	0.81	0.0285	0.39	0.726	0.0061	0.08	0.331	0.8404	1967097	Cerep_001775	Fc1ccccc1CN(Cc2ccco2)C(=O)NCCOc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I18	compound treatment	0.775	-0.00646	-0.09	0.733	0.0131	0.18	0.0647	0.3253	1967098	Cerep_001776	O=C(N/N=C\c1c[nH]c2cnc(OCc3ccccc3)cc12)c4ccccc4Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I19	compound treatment	0.768	-0.0135	-0.18	0.736	0.0161	0.22	0.0268	0.0941	1967099	Cerep_001777	COc1ccc(CCN(C)C(=O)NCc2cccnc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I20	compound treatment	0.754	-0.0275	-0.37	0.724	0.0041	0.06	-0.2225	-0.5938	1967100	Cerep_001778	O=C(N/N=C/c1ccnc2ccccc12)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I21	compound treatment	0.807	0.0255	0.34	0.87	0.15	2.05	1.6909	0.8147	1967101	Cerep_001779	COc1ccc2c(CCNC(=O)N(C)Cc3cccnc3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	I22	compound treatment	0.809	0.0275	0.37	0.728	0.0081	0.11	0.3408	0.8792	1967102	Cerep_001780	O=C(Cc1c[nH]c2ccccc12)N/N=C/c3cccc4OCOc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J03	compound treatment	0.8	0.0185	0.25	0.716	-0.0039	-0.05	0.1392	0.5444	1967103	Cerep_001781	CC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J04	compound treatment	0.785	0.00354	0.05	0.722	0.0021	0.03	0.054	0.97	1967104	Cerep_001782	Clc1cc(c(Cl)s1)S(=O)(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J05	compound treatment	0.757	-0.0245	-0.33	0.741	0.0211	0.29	-0.0299	-0.0683	1967105	Cerep_001783	CCCc1ccc(cc1)S(=O)(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J06	compound treatment	0.766	-0.0155	-0.21	0.697	-0.0229	-0.31	-0.3683	-0.9807	1967106	Cerep_001784	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc(C)c3)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J07	compound treatment	0.785	0.00354	0.05	0.74	0.0201	0.27	0.2275	0.818	1967107	Cerep_001785	OC1(Cc2ccccc2)CCN(CC1)S(=O)(=O)c3ccc(Oc4cccc(Cl)c4C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J08	compound treatment	0.771	-0.0105	-0.14	0.709	-0.0109	-0.15	-0.2049	-0.9997	1967108	Cerep_001786	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(F)c(Br)cc3F)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J09	compound treatment	0.781	-4.61E-4	-0.01	0.734	0.0141	0.19	0.1315	0.6839	1507128	Cerep_001787	CCN1CCCC1CNS(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J10	compound treatment	0.742	-0.0395	-0.53	0.724	0.0041	0.06	-0.3369	-0.6294	1967109	Cerep_001788	Fc1cc(c(F)cc1Br)S(=O)(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J11	compound treatment	0.793	0.0115	0.16	0.731	0.0111	0.15	0.2171	0.9999	1967110	Cerep_001789	CC1(CC2CC(C)(C)C1)CN2S(=O)(=O)c3ccc4CCN(Cc4c3)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J12	compound treatment	0.771	-0.0105	-0.14	0.718	-0.0019	-0.03	-0.1181	-0.8233	1967111	Cerep_001790	Fc1ccc(cc1)C(=O)C2CCN(CC2)S(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J13	compound treatment	0.767	-0.0145	-0.2	0.712	-0.0079	-0.11	-0.2141	-0.9609	1967112	Cerep_001791	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J14	compound treatment	0.765	-0.0165	-0.22	0.699	-0.0209	-0.29	-0.3586	-0.9924	1967113	Cerep_001792	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N(C)CCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J15	compound treatment	0.773	-0.00846	-0.11	0.719	-9.03E-4	-0.01	-0.0894	-0.7789	1967114	Cerep_001793	OCC1CCCN1S(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J16	compound treatment	0.747	-0.0345	-0.46	0.695	-0.0249	-0.34	-0.5689	-0.9881	1967115	Cerep_001794	CCN(CCN(C)C)S(=O)(=O)c1ccc(OC)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J17	compound treatment	0.778	-0.00346	-0.05	0.711	-0.0089	-0.12	-0.1189	-0.9138	1967116	Cerep_001795	OCC1CCCN1S(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J18	compound treatment	0.762	-0.0195	-0.26	0.681	-0.0389	-0.53	-0.5608	-0.9474	1967117	Cerep_001796	Fc1ccccc1CNS(=O)(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J19	compound treatment	0.815	0.0335	0.45	0.735	0.0151	0.21	0.4655	0.9365	1967118	Cerep_001797	FC(F)(F)c1cc(cc(c1)S(=O)(=O)NCCc2ccncc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J20	compound treatment	0.79	0.00854	0.12	0.684	-0.0359	-0.49	-0.2647	-0.5264	1967119	Cerep_001798	Cc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J21	compound treatment	0.816	0.0345	0.47	0.734	0.0141	0.19	0.4654	0.9233	1967120	Cerep_001799	COc1cc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc(O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	J22	compound treatment	0.748	-0.0335	-0.45	0.71	-0.0099	-0.14	-0.4147	-0.8801	1967121	Cerep_001800	Fc1cccc(c1)S(=O)(=O)NC2CCN(Cc3ccccc3OCc4ccccc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K03	compound treatment	0.807	0.0255	0.34	0.71	-0.0099	-0.14	0.1481	0.4003	1967122	Cerep_001801	O=C(NCCCn1ccnc1)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K04	compound treatment	0.796	0.0145	0.2	0.732	0.0121	0.16	0.2553	0.9963	1967123	Cerep_001802	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K05	compound treatment	0.762	-0.0195	-0.26	0.711	-0.0089	-0.12	-0.2715	-0.9386	1967124	Cerep_001803	CCN(CC)c1ccc(cc1)C(=O)NNC(=O)NCCNc2ccc(cn2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K06	compound treatment	0.785	0.00354	0.05	0.72	9.72E-5	0.0	0.0347	0.7265	1967125	Cerep_001804	CCOC(=O)CC(=O)N/N=C/c1cccc2OCOc21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K07	compound treatment	0.761	-0.0205	-0.28	0.716	-0.0039	-0.05	-0.2328	-0.8282	1967126	Cerep_001805	NC(=O)C(CSC(c1ccccc1)(c2ccccc2)c3ccccc3)NC(=O)NC4CCN(Cc5ccccc5)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K08	compound treatment	0.788	0.00654	0.09	0.729	0.0091	0.12	0.1501	0.986	1967127	Cerep_001806	O=C(N/N=C/c1cc2ccccc2o1)c3ccccc3Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K09	compound treatment	0.745	-0.0365	-0.49	0.725	0.0051	0.07	-0.2987	-0.6012	1967128	Cerep_001807	CN(CCCNC(=O)N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K10	compound treatment	0.778	-0.00346	-0.05	0.741	0.0211	0.29	0.1704	0.5847	1967129	Cerep_001808	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2csc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K11	compound treatment	0.773	-0.00846	-0.11	0.732	0.0121	0.16	0.0359	0.1791	1967130	Cerep_001809	O=C(NC1CCN(Cc2ccc3ccccc3c2)C1)N(Cc4ccco4)Cc5ccccc5OCc6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K12	compound treatment	0.783	0.00154	0.02	0.718	-0.0019	-0.03	-0.0037	-0.1103	1967131	Cerep_001810	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K13	compound treatment	0.762	-0.0195	-0.26	0.714	-0.0059	-0.08	-0.2426	-0.8833	1967132	Cerep_001811	COc1cc(CN2CCC(C2)NC(=O)N(Cc3ccco3)Cc4cc5ccccc5o4)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K14	compound treatment	0.772	-0.00946	-0.13	0.71	-0.0099	-0.14	-0.1857	-0.9996	1967133	Cerep_001812	COc1ccc(/C=N/NC(=O)c2ccccc2Cc3ccccc3)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K15	compound treatment	0.79	0.00854	0.12	0.774	0.0541	0.74	0.6031	0.8077	1967134	Cerep_001813	OC(C1CCN(CC1)C(=O)CCC(=O)c2ccc(F)cc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K16	compound treatment	0.783	0.00154	0.02	0.731	0.0111	0.15	0.1217	0.7967	1967135	Cerep_001814	CC(Oc1ccc(Cl)cc1C)C(=O)N/N=C/c2cn(C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K17	compound treatment	0.782	5.39E-4	0.01	0.717	-0.0029	-0.04	-0.0228	-0.5677	1967136	Cerep_001815	COc1cccc(CN(CC2CCCO2)C(=O)NCCOc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K18	compound treatment	0.796	0.0145	0.2	0.728	0.0081	0.11	0.2168	0.9631	1967137	Cerep_001816	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K19	compound treatment	0.78	-0.00146	-0.02	0.753	0.0331	0.45	0.3052	0.6756	1967138	Cerep_001817	CCN(Cc1ccncc1)C(=O)NCc2csc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K20	compound treatment	0.783	0.00154	0.02	0.72	9.72E-5	0.0	0.0156	0.7507	1967139	Cerep_001818	OCCCC(=O)N/N=C/c1ccnc2ccccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K21	compound treatment	0.786	0.00454	0.06	0.723	0.0031	0.04	0.0732	0.9836	1967140	Cerep_001819	Fc1cccc(F)c1C(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	K22	compound treatment	0.795	0.0135	0.18	0.719	-9.03E-4	-0.01	0.1204	0.658	1967141	Cerep_001820	FC(F)(F)c1ccc(nc1)S(=O)(=O)CC(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L03	compound treatment	0.799	0.0175	0.24	0.707	-0.0129	-0.18	0.0429	0.1455	1505900	Cerep_001821	Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L04	compound treatment	0.768	-0.0135	-0.18	0.699	-0.0209	-0.29	-0.33	-0.9763	1967142	Cerep_001822	CC(C)(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L05	compound treatment	0.788	0.00654	0.09	0.698	-0.0219	-0.3	-0.1488	-0.4778	1167785	Cerep_001823	CCCc1ccc(cc1)S(=O)(=O)N(CCN(C)C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L06	compound treatment	0.768	-0.0135	-0.18	0.694	-0.0259	-0.35	-0.3782	-0.9522	1967143	Cerep_001824	Cc1cccc(c1)S(=O)(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L07	compound treatment	0.766	-0.0155	-0.21	0.715	-0.0049	-0.07	-0.1948	-0.8892	1967144	Cerep_001825	OC1CCN(C1)S(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L08	compound treatment	0.767	-0.0145	-0.2	0.696	-0.0239	-0.33	-0.3684	-0.9699	1967145	Cerep_001826	Fc1cc(c(F)cc1Br)S(=O)(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L09	compound treatment	0.772	-0.00946	-0.13	0.735	0.0151	0.21	0.0553	0.2284	1967146	Cerep_001827	[O-][N+](=O)c1ccc(NCCNS(=O)(=O)c2cccc3nonc23)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L10	compound treatment	0.778	-0.00346	-0.05	0.719	-9.03E-4	-0.01	-0.0417	-0.864	1967147	Cerep_001828	Fc1cc(c(F)cc1Br)S(=O)(=O)N2CCN(CC2)c3ncccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L11	compound treatment	0.788	0.00654	0.09	0.72	9.72E-5	0.0	0.0633	0.7176	1967148	Cerep_001829	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L12	compound treatment	0.764	-0.0175	-0.24	0.721	0.0011	0.01	-0.156	-0.6609	1967149	Cerep_001830	Fc1cccc(c1)S(=O)(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L13	compound treatment	0.798	0.0165	0.22	0.725	0.0051	0.07	0.2069	0.8854	1967150	Cerep_001831	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)Nc3ccc4OCCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L14	compound treatment	0.771	-0.0105	-0.14	0.701	-0.0189	-0.26	-0.2821	-0.9598	1967151	Cerep_001832	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(COC)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L15	compound treatment	0.788	0.00654	0.09	0.719	-9.03E-4	-0.01	0.0537	0.6026	1967152	Cerep_001833	O=S(=O)(N1CCN(Cc2ccc3OCOc3c2)CC1)c4ccc(C#N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L16	compound treatment	0.758	-0.0235	-0.32	0.727	0.0071	0.1	-0.1554	-0.4694	1967153	Cerep_001834	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)c3cc(nc4ccc(C)cc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L17	compound treatment	0.782	5.39E-4	0.01	0.736	0.0161	0.22	0.1604	0.7301	1519484	Cerep_001835	Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCN(Cc3ccc4OCOc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L18	compound treatment	0.755	-0.0265	-0.36	0.709	-0.0109	-0.15	-0.3575	-0.9246	1967154	Cerep_001836	CC1CCCCN1CCCNS(=O)(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L19	compound treatment	0.802	0.0205	0.28	0.726	0.0061	0.08	0.2547	0.8805	1967155	Cerep_001837	OCCCN1CCN(CC1)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L20	compound treatment	0.764	-0.0175	-0.24	0.729	0.0091	0.12	-0.0788	-0.2962	1967156	Cerep_001838	Clc1cc(c(Cl)s1)S(=O)(=O)NC2CCCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L21	compound treatment	0.811	0.0295	0.4	0.719	-9.03E-4	-0.01	0.2731	0.6849	1967157	Cerep_001839	COc1cc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	L22	compound treatment	0.787	0.00554	0.07	0.71	-0.0099	-0.14	-0.0426	-0.2763	1967158	Cerep_001840	Fc1cccc(c1)S(=O)(=O)NCCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M03	compound treatment	0.821	0.0395	0.53	0.76	0.0401	0.55	0.7638	0.9999	1967159	Cerep_001841	CCC(C)(C)c1ccc(OCCCCNC(=O)N(CC(C)O)CC(C)O)c(c1)C(C)(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M04	compound treatment	0.804	0.0225	0.3	0.712	-0.0079	-0.11	0.1388	0.4303	1967160	Cerep_001842	Fc1cccc(F)c1C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M05	compound treatment	0.786	0.00454	0.06	0.714	-0.0059	-0.08	-0.0136	-0.1346	1967161	Cerep_001843	CC(C)(C)OC(=O)C(Cc1ccccc1)NC(=O)N2CCN(CC2)c3sc(cc3[N+](=O)[O-])S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M06	compound treatment	0.777	-0.00446	-0.06	0.715	-0.0049	-0.07	-0.0898	-0.9986	1967162	Cerep_001844	Clc1ccc(Cl)c(c1)C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M07	compound treatment	0.777	-0.00446	-0.06	0.739	0.0191	0.26	0.1416	0.5297	1967163	Cerep_001845	FC(F)(F)c1cc(CNC(=O)NC2CCN(Cc3ccccc3)C2)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M08	compound treatment	0.796	0.0145	0.2	0.757	0.0371	0.51	0.4964	0.9149	1967164	Cerep_001846	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M09	compound treatment	0.776	-0.00546	-0.07	0.71	-0.0099	-0.14	-0.1476	-0.9594	1967165	Cerep_001847	CN(CCCNC(=O)NCCNc1ccc(cn1)[N+](=O)[O-])c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M10	compound treatment	0.773	-0.00846	-0.11	0.72	9.72E-5	0.0	-0.0798	-0.6989	1967166	Cerep_001848	[O-][N+](=O)c1cc(/C=N/NC(=O)c2c(F)cccc2F)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M11	compound treatment	0.797	0.0155	0.21	0.732	0.0121	0.16	0.2649	0.993	1967167	Cerep_001849	O=C(NC1CCN(Cc2ccc3ccccc3c2)C1)N(Cc4ccco4)Cc5cc6ccccc6o5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M12	compound treatment	0.799	0.0175	0.24	0.718	-0.0019	-0.03	0.149	0.6258	1967168	Cerep_001850	O=C(COc1ccccc1)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M13	compound treatment	0.763	-0.0185	-0.25	0.731	0.0111	0.15	-0.0691	-0.2371	1967169	Cerep_001851	COc1cc(CN2CCC(C2)NC(=O)N(Cc3ccco3)Cc4ccc(OC(C)C)cc4)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M14	compound treatment	0.815	0.0335	0.45	0.742	0.0221	0.3	0.533	0.9805	1967170	Cerep_001852	COc1ccc(/C=N/NC(=O)c2cccn2C)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M15	compound treatment	0.747	-0.0345	-0.46	0.716	-0.0039	-0.05	-0.3664	-0.7829	1967171	Cerep_001853	O=C(NCCc1cccs1)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M16	compound treatment	0.793	0.0115	0.16	0.713	-0.0069	-0.09	0.0435	0.2392	1967172	Cerep_001854	Cn1cc(/C=N/NC(=O)c2cccnc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M17	compound treatment	0.767	-0.0145	-0.2	0.722	0.0021	0.03	-0.1177	-0.5971	1967173	Cerep_001855	CC(NC(=O)N1CCN(Cc2cccc(C)n2)CC1)C(=O)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M18	compound treatment	0.779	-0.00246	-0.03	0.71	-0.0099	-0.14	-0.119	-0.8555	1967174	Cerep_001856	O=C(COc1ccccc1)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M19	compound treatment	0.802	0.0205	0.28	0.747	0.0271	0.37	0.4572	0.9899	1967175	Cerep_001857	O=C(NCc1ccc(cc1)c2csnn2)N3CCN(CC3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M20	compound treatment	0.8	0.0185	0.25	0.727	0.0071	0.1	0.2453	0.9146	1967176	Cerep_001858	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M21	compound treatment	0.807	0.0255	0.34	0.744	0.0241	0.33	0.476	0.9997	1967177	Cerep_001859	CCN(Cc1ccncc1)C(=O)NCCc2c[nH]c3cc(OC)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	M22	compound treatment	0.803	0.0215	0.29	0.736	0.0161	0.22	0.3607	0.9904	1967178	Cerep_001860	O=C(N/N=C/c1cccc2OCOc21)c3cc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N03	compound treatment	0.817	0.0355	0.48	0.733	0.0131	0.18	0.4653	0.9095	1967179	Cerep_001861	CCCc1ccc(cc1)S(=O)(=O)N(C)CCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N04	compound treatment	0.775	-0.00646	-0.09	0.702	-0.0179	-0.24	-0.2343	-0.9037	1967180	Cerep_001862	Clc1cc(c(Cl)s1)S(=O)(=O)N2CCN(CC2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N05	compound treatment	0.8	0.0185	0.25	0.717	-0.0029	-0.04	0.1489	0.5879	1967181	Cerep_001863	CCCc1ccc(cc1)S(=O)(=O)N(CC)CCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N06	compound treatment	0.777	-0.00446	-0.06	0.704	-0.0159	-0.22	-0.1959	-0.8704	1967182	Cerep_001864	COc1ccc(F)c(CN2CCN(CC2)S(=O)(=O)c3cccc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N07	compound treatment	0.769	-0.0125	-0.17	0.769	0.0491	0.67	0.3545	0.5136	1967183	Cerep_001865	FC(F)(F)c1ccccc1CNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N08	compound treatment	0.738	-0.0435	-0.59	0.72	9.72E-5	0.0	-0.4136	-0.7055	1967184	Cerep_001866	Fc1cc(c(F)cc1Br)S(=O)(=O)N2CCN(Cc3c(Cl)cccc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N09	compound treatment	0.769	-0.0125	-0.17	0.702	-0.0179	-0.24	-0.2915	-0.9834	1967185	Cerep_001867	CN1CCCC1CCNS(=O)(=O)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N10	compound treatment	0.774	-0.00746	-0.1	0.685	-0.0349	-0.48	-0.4077	-0.8381	1967186	Cerep_001868	COc1ccc(CCNS(=O)(=O)c2cc(F)c(Br)cc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N11	compound treatment	0.786	0.00454	0.06	0.726	0.0061	0.08	0.1021	0.9887	1967187	Cerep_001869	CN(C(=O)CN1CCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N12	compound treatment	0.782	5.39E-4	0.01	0.722	0.0021	0.03	0.0254	0.8596	1694030	Cerep_001870	CC(C)(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc(F)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N13	compound treatment	0.809	0.0275	0.37	0.7	-0.0199	-0.27	0.0708	0.1539	1967188	Cerep_001871	CN1CCN(CCCNS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N14	compound treatment	0.808	0.0265	0.36	0.738	0.0181	0.25	0.4277	0.9835	1433510	Cerep_001872	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N15	compound treatment	0.729	-0.0525	-0.71	0.717	-0.0029	-0.04	-0.5284	-0.7455	1967189	Cerep_001873	Cc1ncc([N+](=O)[O-])n1CCNS(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N16	compound treatment	0.79	0.00854	0.12	0.708	-0.0119	-0.16	-0.0333	-0.1674	1967190	Cerep_001874	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N17	compound treatment	0.82	0.0385	0.52	0.715	-0.0049	-0.07	0.3204	0.6111	1967191	Cerep_001875	CC(NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N18	compound treatment	0.786	0.00454	0.06	0.712	-0.0079	-0.11	-0.0329	-0.2654	1967192	Cerep_001876	CCCN(CC1CC1)S(=O)(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N19	compound treatment	0.762	-0.0195	-0.26	0.685	-0.0349	-0.48	-0.5222	-0.9607	1967193	Cerep_001877	OC1(CCN(CC1)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccc(Cl)c(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N20	compound treatment	0.777	-0.00446	-0.06	0.724	0.0041	0.06	-0.003	-0.0371	1967194	Cerep_001878	Clc1cc(c(Cl)s1)S(=O)(=O)N(CCC#N)CCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N21	compound treatment	0.819	0.0375	0.51	0.756	0.0361	0.49	0.7062	0.9999	1967195	Cerep_001879	CCOc1cccc(/C=N/NC(=O)c2cc3ccccc3s2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	N22	compound treatment	0.768	-0.0135	-0.18	0.69	-0.0299	-0.41	-0.4167	-0.9336	1967196	Cerep_001880	COc1cccc(CN(Cc2ccco2)S(=O)(=O)c3cccc(F)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O03	compound treatment	0.76	-0.0215	-0.29	0.722	0.0021	0.03	-0.1845	-0.6342	1967197	Cerep_001881	O=C(NCCc1c[nH]c2ccccc12)N3CCN(Cc4ccc5OCOc5c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O04	compound treatment	0.81	0.0285	0.39	0.729	0.0091	0.12	0.36	0.8899	1967198	Cerep_001882	O=C(CC1Sc2ccccc2NC1=O)N/N=C/c3ccnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O05	compound treatment	0.794	0.0125	0.17	0.726	0.0061	0.08	0.1784	0.9465	1967199	Cerep_001883	CCN(CCc1ccccn1)C(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O06	compound treatment	0.808	0.0265	0.36	0.725	0.0051	0.07	0.3023	0.8289	1967200	Cerep_001884	Clc1ccccc1OCC(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O07	compound treatment	0.761	-0.0205	-0.28	0.752	0.0321	0.44	0.1143	0.2209	1967201	Cerep_001885	CCOC(=O)N1CCN(CC1)C(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O08	compound treatment	0.812	0.0305	0.41	0.739	0.0191	0.26	0.4755	0.9755	1967202	Cerep_001886	O=C(COc1ccccc1)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O09	compound treatment	0.861	0.0795	1.07	0.766	0.0461	0.63	1.2032	0.9675	1967203	Cerep_001887	CS(=O)(=O)c1ccc(CNC(=O)N2CCCC2C(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O10	compound treatment	0.771	-0.0105	-0.14	0.695	-0.0249	-0.34	-0.3399	-0.9243	1967204	Cerep_001888	[O-][N+](=O)c1cc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O11	compound treatment	0.791	0.00954	0.13	0.735	0.0151	0.21	0.2366	0.9744	1967205	Cerep_001889	CCOc1ccc(CN(Cc2ccco2)C(=O)NC3CCN(Cc4ccc5ccccc5c4)C3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O12	compound treatment	0.813	0.0315	0.43	0.747	0.0271	0.37	0.5621	0.9975	1967206	Cerep_001890	O=C(CC#N)N/N=C/c1cccc(OCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O13	compound treatment	0.773	-0.00846	-0.11	0.725	0.0051	0.07	-0.0316	-0.2362	1967207	Cerep_001891	Clc1ccc(Sc2ccccc2CN3CCC(C3)NC(=O)N(Cc4ccco4)Cc5ccccc5OCc6ccccc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O14	compound treatment	0.798	0.0165	0.22	0.736	0.0161	0.22	0.313	1.0	1967208	Cerep_001892	COc1ccc(cc1)C(=O)N/N=C/c2ccc(OC)c(C)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O15	compound treatment	0.822	0.0405	0.55	0.736	0.0161	0.22	0.5419	0.9196	1967209	Cerep_001893	O=C(NNC(=O)c1csc(n1)c2ccccc2)NC3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O16	compound treatment	0.786	0.00454	0.06	0.713	-0.0069	-0.09	-0.0233	-0.2071	1967210	Cerep_001894	Cn1cc(/C=N/NC(=O)Cn2cncn2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O17	compound treatment	0.798	0.0165	0.22	0.745	0.0251	0.34	0.3998	0.9785	1967211	Cerep_001895	CC(NC(=O)N1CCN(Cc2ccsc2)CC1)C(=O)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O18	compound treatment	0.778	-0.00346	-0.05	0.737	0.0171	0.23	0.1318	0.5545	1967212	Cerep_001896	O=C(CC#N)N/N=C/c1c[nH]c2cnc(OCc3ccccc3)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O19	compound treatment	0.781	-4.61E-4	-0.01	0.722	0.0021	0.03	0.0158	0.5408	1967213	Cerep_001897	CCN(CCc1ccccn1)C(=O)NCCc2cc(OC)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O20	compound treatment	0.764	-0.0175	-0.24	0.715	-0.0049	-0.07	-0.2138	-0.8733	1967214	Cerep_001898	COc1ccc(CC(=O)N/N=C/c2ccnc3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O21	compound treatment	0.803	0.0215	0.29	0.773	0.0531	0.72	0.7175	0.9196	1967215	Cerep_001899	CCOc1ccccc1CN(Cc2ccco2)C(=O)NC(COc3ccccc3)c4ccc5OCCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	O22	compound treatment	0.8	0.0185	0.25	0.739	0.0191	0.26	0.361	0.9998	1967216	Cerep_001900	Cc1ccc(s1)C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P03	compound treatment	0.781	-4.61E-4	-0.01	0.723	0.0031	0.04	0.0255	0.5966	1967217	Cerep_001901	CCCc1ccc(cc1)S(=O)(=O)NC(COC)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P04	compound treatment	0.767	-0.0145	-0.2	0.712	-0.0079	-0.11	-0.2141	-0.9609	1967218	Cerep_001902	COc1ccc2ccccc2c1CN3CCN(CC3)S(=O)(=O)c4cc(Cl)sc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P05	compound treatment	0.79	0.00854	0.12	0.721	0.0011	0.01	0.092	0.7923	1967219	Cerep_001903	CCCc1ccc(cc1)S(=O)(=O)NC(C)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P06	compound treatment	0.761	-0.0205	-0.28	0.714	-0.0059	-0.08	-0.2521	-0.8768	1967220	Cerep_001904	COc1cccc(c1)C2N(CCc3c2[nH]c4ccccc34)S(=O)(=O)c5cccc(C)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P07	compound treatment	0.77	-0.0115	-0.15	0.703	-0.0169	-0.23	-0.2723	-0.9811	1967221	Cerep_001905	CCc1ccc(NS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P08	compound treatment	0.755	-0.0265	-0.36	0.713	-0.0069	-0.09	-0.319	-0.864	1967222	Cerep_001906	COc1ccc(F)c(CN2CCN(CC2)S(=O)(=O)c3cc(F)c(Br)cc3F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P09	compound treatment	0.648	-0.133	-1.8	0.668	-0.0519	-0.71	-1.7736	-0.9168	1967223	Cerep_001907	O=S(=O)(NCCCCc1ccccc1)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P10	compound treatment	0.053	-0.728	-9.83	0.088	-0.632	-8.62	-13.0421	-0.9979	1967224	Cerep_001908	COc1ccc(cc1)N2CCN(CC2C)S(=O)(=O)c3cc(F)c(Br)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P11	compound treatment	0.771	-0.0105	-0.14	0.722	0.0021	0.03	-0.0796	-0.5526	1967225	Cerep_001909	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)N3CCN(CC3)C(=O)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P12	compound treatment	0.74	-0.0415	-0.56	0.707	-0.0129	-0.18	-0.5199	-0.8867	1723551	Cerep_001910	Fc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P13	compound treatment	0.769	-0.0125	-0.17	0.73	0.0101	0.14	-0.0215	-0.099	1967226	Cerep_001911	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P14	compound treatment	0.767	-0.0145	-0.2	0.716	-0.0039	-0.05	-0.1756	-0.8683	1967227	Cerep_001912	COCC(NS(=O)(=O)c1ccc(OC)c(OC)c1)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P15	compound treatment	0.776	-0.00546	-0.07	0.701	-0.0189	-0.26	-0.2344	-0.8742	1967228	Cerep_001913	CCN1CC(CN1CC)NS(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P16	compound treatment	0.767	-0.0145	-0.2	0.713	-0.0069	-0.09	-0.2045	-0.9441	1967229	Cerep_001914	COc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P17	compound treatment	0.78	-0.00146	-0.02	0.723	0.0031	0.04	0.0159	0.3418	1967230	Cerep_001915	Cc1ncc([N+](=O)[O-])n1CCNS(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P18	compound treatment	0.748	-0.0335	-0.45	0.685	-0.0349	-0.48	-0.6557	-0.9997	1967231	Cerep_001916	FC(F)(F)c1cc(N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P19	compound treatment	0.772	-0.00946	-0.13	0.718	-0.0019	-0.03	-0.1086	-0.8338	1967232	Cerep_001917	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P20	compound treatment	0.762	-0.0195	-0.26	0.685	-0.0349	-0.48	-0.5222	-0.9607	1967233	Cerep_001918	COc1ccc2ccccc2c1CN3CCN(CC3)S(=O)(=O)c4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P21	compound treatment	0.765	-0.0165	-0.22	0.721	0.0011	0.01	-0.1464	-0.658	1967234	Cerep_001919	COc1cc(C)c(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.531	P22	compound treatment	0.751	-0.0305	-0.41	0.739	0.0191	0.26	-0.1064	-0.2188	1967235	Cerep_001920	COc1cccc(CCNS(=O)(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A03	compound treatment	0.812	0.0279	0.38	0.723	-0.00507	-0.07	0.2177	0.568	1967236	Cerep_001921	Brc1ccc(cc1)S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A04	compound treatment	0.824	0.0399	0.54	0.74	0.0119	0.16	0.496	0.8813	1967237	Cerep_001922	CCc1cc(Br)ccc1S(=O)(=O)NC(c2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A05	compound treatment	0.74	-0.0441	-0.59	0.719	-0.00907	-0.12	-0.5077	-0.8363	1967238	Cerep_001923	CC(NS(=O)(=O)c1ccc(Br)cc1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A06	compound treatment	0.832	0.0479	0.65	0.726	-0.00207	-0.03	0.4374	0.6756	1967239	Cerep_001924	COc1ccc(cc1OC)S(=O)(=O)N(C)CCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A07	compound treatment	0.745	-0.0391	-0.53	0.721	-0.00707	-0.1	-0.4408	-0.8228	1967240	Cerep_001925	CC(C)(C)CCNS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A08	compound treatment	0.793	0.00894	0.12	0.715	-0.0131	-0.18	-0.0407	-0.1893	1967241	Cerep_001926	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A09	compound treatment	0.788	0.00394	0.05	0.712	-0.0161	-0.22	-0.1174	-0.5205	1967242	Cerep_001927	CCCCN(CCCC)CCNS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A10	compound treatment	0.78	-0.00406	-0.05	0.721	-0.00707	-0.1	-0.1069	-0.9641	1967243	Cerep_001928	COc1ccc(cc1F)C(=O)N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A11	compound treatment	0.794	0.00994	0.13	0.706	-0.0221	-0.3	-0.118	-0.3581	1967244	Cerep_001929	CC1CCCCN1CCCNS(=O)(=O)c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A12	compound treatment	0.793	0.00894	0.12	0.744	0.0159	0.22	0.2389	0.9614	1203711	Cerep_001930	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A13	compound treatment	0.763	-0.0211	-0.28	0.715	-0.0131	-0.18	-0.3269	-0.9748	1967245	Cerep_001931	COc1ccc(OCCNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A14	compound treatment	0.79	0.00594	0.08	0.697	-0.0311	-0.42	-0.2429	-0.5634	1967246	Cerep_001932	CCN(CC)CCCNS(=O)(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A15	compound treatment	0.799	0.0149	0.2	0.717	-0.0111	-0.15	0.0358	0.1421	1967247	Cerep_001933	COc1ccc2[nH]cc(CCNS(=O)(=O)c3cccc(Cl)c3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A16	compound treatment	0.825	0.0409	0.55	0.723	-0.00507	-0.07	0.3417	0.6138	1967248	Cerep_001934	COc1ccccc1C2CCN(CC2)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A17	compound treatment	0.792	0.00794	0.11	0.723	-0.00507	-0.07	0.0269	0.2108	1967249	Cerep_001935	Fc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3ccccc3Br)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A18	compound treatment	0.795	0.0109	0.15	0.697	-0.0311	-0.42	-0.1952	-0.4351	1967250	Cerep_001936	CCn1c2ccccc2c3cc(CN4CCC(C4)NS(=O)(=O)c5ccc(Cl)s5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A19	compound treatment	0.818	0.0339	0.46	0.724	-0.00407	-0.06	0.2845	0.6169	1967251	Cerep_001937	COc1cccc(CCNS(=O)(=O)c2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A20	compound treatment	0.807	0.0229	0.31	0.711	-0.0171	-0.23	0.0543	0.1401	1967252	Cerep_001938	CCn1c2ccccc2c3cc(CN4CCC(C4)NS(=O)(=O)c5ccc(Br)cc5OC(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A21	compound treatment	0.799	0.0149	0.2	0.723	-0.00507	-0.07	0.0936	0.4395	1967253	Cerep_001939	CCN(CCN(C)C)S(=O)(=O)c1c(C)cccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	A22	compound treatment	0.809	0.0249	0.34	0.725	-0.00307	-0.04	0.2083	0.6144	1967254	Cerep_001940	CC(NS(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B03	compound treatment	0.818	0.0339	0.46	0.749	0.0209	0.29	0.5256	0.9741	1967255	Cerep_001941	CCOc1ccc(cc1)N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B04	compound treatment	0.771	-0.0131	-0.18	0.713	-0.0151	-0.21	-0.2699	-0.9971	1967256	Cerep_001942	O=C(NNC(=O)c1ccccc1n2cccc2)OCCC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B05	compound treatment	0.797	0.0129	0.17	0.752	0.0239	0.33	0.3542	0.957	1967257	Cerep_001943	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CC2)C(=O)C3COc4ccccc4O3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B06	compound treatment	0.782	-0.00206	-0.03	0.711	-0.0171	-0.23	-0.1842	-0.7859	1967258	Cerep_001944	COC(COC(=O)NNC(=O)c1cc(c(SC)s1)c2nc(C)cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B07	compound treatment	0.804	0.0199	0.27	0.726	-0.00207	-0.03	0.1703	0.6295	1967259	Cerep_001945	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)C(=O)C(CC(=O)O)Cc3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B08	compound treatment	0.755	-0.0291	-0.39	0.697	-0.0311	-0.42	-0.5768	-0.9992	1967260	Cerep_001946	COc1cscc1C(=O)NNC(=O)OCCc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B09	compound treatment	0.786	0.00194	0.03	0.732	0.00393	0.05	0.0564	0.9457	1967261	Cerep_001947	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccccc3CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B10	compound treatment	0.826	0.0419	0.57	0.71	-0.0181	-0.25	0.2259	0.366	1967262	Cerep_001948	OC1(CNC(=O)OCc2cccc(OCc3ccccc3)c2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B11	compound treatment	0.768	-0.0161	-0.22	0.739	0.0109	0.15	-0.0478	-0.1817	1967263	Cerep_001949	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B12	compound treatment	0.764	-0.0201	-0.27	0.717	-0.0111	-0.15	-0.2981	-0.962	1967264	Cerep_001950	NC(=O)C1CCN(CC1)C(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B13	compound treatment	0.765	-0.0191	-0.26	0.717	-0.0111	-0.15	-0.2885	-0.9678	1967265	Cerep_001951	COc1cccc(c1)C2N(CCc3c2[nH]c4ccccc34)C(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B14	compound treatment	0.773	-0.0111	-0.15	0.689	-0.0391	-0.53	-0.4822	-0.8716	1967266	Cerep_001952	COc1ccccc1CCOC(=O)NCc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B15	compound treatment	0.776	-0.00806	-0.11	0.731	0.00293	0.04	-0.0486	-0.4197	1967267	Cerep_001953	OC(=O)CCC(=O)N1CCN(CC1)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B16	compound treatment	0.787	0.00294	0.04	0.697	-0.0311	-0.42	-0.2715	-0.6381	1967268	Cerep_001954	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(c(F)c5F)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B17	compound treatment	0.786	0.00194	0.03	0.719	-0.00907	-0.12	-0.0689	-0.5453	1967269	Cerep_001955	OC(=O)CCC(=O)N1CCC(=CC1)n2c(=O)[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B18	compound treatment	0.76	-0.0241	-0.32	0.675	-0.0531	-0.72	-0.7412	-0.9346	1967270	Cerep_001956	CC1C(COC(=O)Nc2ccc(NC(=O)C)cc2)C3CCC1C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B19	compound treatment	0.786	0.00194	0.03	0.719	-0.00907	-0.12	-0.0689	-0.5453	1967271	Cerep_001957	OC(=O)C1CC=CCC1C(=O)N2CCN(CC2)c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B20	compound treatment	0.766	-0.0181	-0.24	0.705	-0.0231	-0.31	-0.3947	-0.992	1967272	Cerep_001958	CCN(CC)CCOCCOC(=O)N1CCc2c(C1)[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B21	compound treatment	0.79	0.00594	0.08	0.726	-0.00207	-0.03	0.0367	0.4322	1967273	Cerep_001959	OC(=O)CC1(CC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	B22	compound treatment	0.749	-0.0351	-0.47	0.669	-0.0591	-0.81	-0.904	-0.9678	1967274	Cerep_001960	Cc1cc(no1)c2onc(C)c2COC(=O)N3CCN(CC3)C(=O)Cc4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C03	compound treatment	0.802	0.0179	0.24	0.775	0.0469	0.64	0.6237	0.9115	1967275	Cerep_001961	COc1cccc(CNS(=O)(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C04	compound treatment	0.808	0.0239	0.32	0.736	0.00793	0.11	0.3048	0.895	1967276	Cerep_001962	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CCN3CCOCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C05	compound treatment	0.803	0.0189	0.26	0.731	0.00293	0.04	0.2089	0.8079	1600475	Cerep_001963	Brc1ccc(cc1)S(=O)(=O)NC2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C06	compound treatment	0.793	0.00894	0.12	0.747	0.0189	0.26	0.2678	0.9399	1967277	Cerep_001964	COc1ccc(cc1OC)S(=O)(=O)NC2CCCCC2CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C07	compound treatment	0.777	-0.00706	-0.1	0.74	0.0119	0.16	0.0477	0.253	1967278	Cerep_001965	Cc1cccc(CNS(=O)(=O)c2ccc(Br)cc2)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C08	compound treatment	0.794	0.00994	0.13	0.748	0.0199	0.27	0.287	0.947	1967279	Cerep_001966	CN(C1CCN(Cc2cccc(Cl)c2)C1)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C09	compound treatment	0.78	-0.00406	-0.05	0.725	-0.00307	-0.04	-0.0683	-0.9912	1967280	Cerep_001967	CCOC(=O)CCC(NS(=O)(=O)c1ccc(Br)cc1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C10	compound treatment	0.798	0.0139	0.19	0.745	0.0169	0.23	0.2962	0.9948	1967281	Cerep_001968	Fc1cccc(F)c1CNS(=O)(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C11	compound treatment	0.768	-0.0161	-0.22	0.746	0.0179	0.24	0.0197	0.0603	1967282	Cerep_001969	Fc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3cc(nc4ccccc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C12	compound treatment	0.812	0.0279	0.38	0.727	-0.00107	-0.01	0.2562	0.6793	1967283	Cerep_001970	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C13	compound treatment	0.781	-0.00306	-0.04	0.733	0.00493	0.07	0.0184	0.2327	1967284	Cerep_001971	COc1ccc(cc1OC)S(=O)(=O)NCc2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C14	compound treatment	0.776	-0.00806	-0.11	0.729	9.31E-4	0.01	-0.0679	-0.6203	1967285	Cerep_001972	CC(=O)Nc1ccc(cc1)S(=O)(=O)N(Cc2ccco2)Cc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C15	compound treatment	0.769	-0.0151	-0.2	0.703	-0.0251	-0.34	-0.3854	-0.9691	1967286	Cerep_001973	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C16	compound treatment	0.782	-0.00206	-0.03	0.747	0.0189	0.26	0.1629	0.6274	1967287	Cerep_001974	CN(CCCC1(CCC2c3ccccc31)c4ccccc24)S(=O)(=O)c5cc(cc(c5)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C17	compound treatment	0.768	-0.0161	-0.22	0.719	-0.00907	-0.12	-0.2406	-0.9646	1967288	Cerep_001975	Brc1ccccc1S(=O)(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C18	compound treatment	0.784	-5.96E-5	0.0	0.737	0.00893	0.12	0.0855	0.7024	1322722	Cerep_001976	CC1CN(CCN1c2cccc(C)c2)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C19	compound treatment	0.811	0.0269	0.36	0.688	-0.0401	-0.55	-0.1294	-0.1971	1967289	Cerep_001977	Cc1cccc(Cl)c1S(=O)(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C20	compound treatment	0.791	0.00694	0.09	0.736	0.00793	0.11	0.1427	0.9974	1967290	Cerep_001978	CCCCN(CCCC)CCNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C21	compound treatment	0.788	0.00394	0.05	0.731	0.00293	0.04	0.0659	0.9901	1967291	Cerep_001979	OC1(CCN(CC1)S(=O)(=O)c2ccc(Br)s2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	C22	compound treatment	0.789	0.00494	0.07	0.719	-0.00907	-0.12	-0.0403	-0.287	1967292	Cerep_001980	COc1cc2CCN(C(CC#N)c2cc1OC)S(=O)(=O)c3ccc4CCN(Cc4c3)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D03	compound treatment	0.813	0.0289	0.39	0.745	0.0169	0.23	0.4393	0.9686	1967293	Cerep_001981	CN(C1CCN(Cc2cccc(Cl)c2)C1)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D04	compound treatment	0.77	-0.0141	-0.19	0.723	-0.00507	-0.07	-0.183	-0.9065	1967294	Cerep_001982	Clc1ccc(cc1)c2csc(COC(=O)NNC(=O)c3cc(nc4ccccc34)c5ccccc5)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D05	compound treatment	0.791	0.00694	0.09	0.74	0.0119	0.16	0.1813	0.9656	1967295	Cerep_001983	CC(C)(C)CC(=C)CC(CC(=O)O)C(=O)N1CCN(CC1)c2cccc3[nH]ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D06	compound treatment	0.758	-0.0261	-0.35	0.729	9.31E-4	0.01	-0.2396	-0.6811	1967296	Cerep_001984	CCN(CC)CCOCCOC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D07	compound treatment	0.773	-0.0111	-0.15	0.725	-0.00307	-0.04	-0.1351	-0.8718	1967297	Cerep_001985	COc1ccc(CCN(C)C(=O)c2ccccc2CC(=O)O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D08	compound treatment	0.775	-0.00906	-0.12	0.711	-0.0171	-0.23	-0.251	-0.9548	1967298	Cerep_001986	Cc1nc(cs1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D09	compound treatment	0.769	-0.0151	-0.2	0.707	-0.0211	-0.29	-0.3468	-0.9856	1967299	Cerep_001987	OC(=O)Cc1ccccc1C(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D10	compound treatment	0.791	0.00694	0.09	0.721	-0.00707	-0.1	-0.002	-0.0145	1967300	Cerep_001988	COc1cc(CN2CCN(CCOC(=O)NCCc3c[nH]c4c(C)cccc34)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D11	compound treatment	0.787	0.00294	0.04	0.719	-0.00907	-0.12	-0.0594	-0.4573	1967301	Cerep_001989	Clc1cccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NNC(=O)OCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D12	compound treatment	0.795	0.0109	0.15	0.689	-0.0391	-0.53	-0.2724	-0.4927	1967302	Cerep_001990	Oc1cccc(c1)C(=O)NNC(=O)OCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D13	compound treatment	0.788	0.00394	0.05	0.725	-0.00307	-0.04	0.008	0.1182	1967303	Cerep_001991	OC(=O)/C=C\C(=O)N1CCC2(CC1)N(CNC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D14	compound treatment	0.764	-0.0201	-0.27	0.685	-0.0431	-0.59	-0.6066	-0.9381	1966288	Cerep_001992	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D15	compound treatment	0.793	0.00894	0.12	0.731	0.00293	0.04	0.1135	0.8936	1739572	Cerep_001993	COc1ccccc1N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D16	compound treatment	0.772	-0.0121	-0.16	0.71	-0.0181	-0.25	-0.2893	-0.9797	1967304	Cerep_001994	Fc1ccc(F)c(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)c1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D17	compound treatment	0.807	0.0229	0.31	0.716	-0.0121	-0.16	0.1025	0.2923	1967305	Cerep_001995	OC(=O)CCC(=O)N1CCN(CC1)C(=O)c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D18	compound treatment	0.784	-5.96E-5	0.0	0.702	-0.0261	-0.36	-0.2519	-0.7087	1967306	Cerep_001996	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCC(CC=C(C)C)C(=C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D19	compound treatment	0.785	9.4E-4	0.01	0.712	-0.0161	-0.22	-0.146	-0.6651	1967307	Cerep_001997	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)C3CC=CCC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D20	compound treatment	0.769	-0.0151	-0.2	0.733	0.00493	0.07	-0.0961	-0.4491	1967308	Cerep_001998	CC1(C)C2CC1C(=CC2)CCOC(=O)NNC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D21	compound treatment	0.812	0.0279	0.38	0.745	0.0169	0.23	0.4298	0.9723	1967309	Cerep_001999	OC(=O)CC1(CC(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	D22	compound treatment	0.773	-0.0111	-0.15	0.716	-0.0121	-0.16	-0.2219	-0.9988	1967310	Cerep_002000	COc1cc(CN2CCCCC2COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E03	compound treatment	0.803	0.0189	0.26	0.744	0.0159	0.22	0.3343	0.9967	1528850	Cerep_002001	COc1ccccc1CNS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E04	compound treatment	0.759	-0.0251	-0.34	0.728	-6.9E-5	0.0	-0.2397	-0.7091	1470500	Cerep_002002	COc1ccc(cc1OC)S(=O)(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E05	compound treatment	0.78	-0.00406	-0.05	0.743	0.0149	0.2	0.1052	0.4992	1967311	Cerep_002003	Brc1ccc(cc1)S(=O)(=O)NC2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E06	compound treatment	0.795	0.0109	0.15	0.721	-0.00707	-0.1	0.0362	0.2054	1967312	Cerep_002004	OC1CCCN(C1)S(=O)(=O)c2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E07	compound treatment	0.781	-0.00306	-0.04	0.736	0.00793	0.11	0.0473	0.4085	1967313	Cerep_002005	COC(=O)c1csc2c(cc(nc12)N3CCN(CC3)S(=O)(=O)c4ccc(Br)cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E08	compound treatment	0.797	0.0129	0.17	0.738	0.00993	0.14	0.2192	0.9921	1967314	Cerep_002006	FC(F)(F)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E09	compound treatment	0.774	-0.0101	-0.14	0.786	0.0579	0.79	0.4626	0.5772	1967315	Cerep_002007	CCCc1ccc(cc1)S(=O)(=O)Nc2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E10	compound treatment	0.771	-0.0131	-0.18	0.752	0.0239	0.33	0.1062	0.2863	1967316	Cerep_002008	CC(NS(=O)(=O)c1ccc(NC(=O)C)cc1)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E11	compound treatment	0.774	-0.0101	-0.14	0.73	0.00193	0.03	-0.0773	-0.5595	1967317	Cerep_002009	Fc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3cc(ccn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E12	compound treatment	0.773	-0.0111	-0.15	0.73	0.00193	0.03	-0.0869	-0.5734	1967318	Cerep_002010	CN(C1CCN(Cc2cccc(Cl)c2)C1)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E13	compound treatment	0.733	-0.0511	-0.69	0.715	-0.0131	-0.18	-0.6131	-0.8617	1967319	Cerep_002011	COc1ccc(cc1OC)S(=O)(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E14	compound treatment	0.784	-5.96E-5	0.0	0.724	-0.00407	-0.06	-0.0398	-0.7173	1967320	Cerep_002012	COc1cc(CN(Cc2ccco2)S(=O)(=O)c3ccc(NC(=O)C)cc3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E15	compound treatment	0.769	-0.0151	-0.2	0.712	-0.0161	-0.22	-0.2986	-0.9993	1967321	Cerep_002013	Clc1cccc(c1Cl)S(=O)(=O)NCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E16	compound treatment	0.787	0.00294	0.04	0.724	-0.00407	-0.06	-0.0112	-0.164	1967322	Cerep_002014	Fc1ccccc1S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E17	compound treatment	0.797	0.0129	0.17	0.705	-0.0231	-0.31	-0.099	-0.2752	1967323	Cerep_002015	CC(C)(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E18	compound treatment	0.789	0.00494	0.07	0.737	0.00893	0.12	0.1332	0.9598	1967324	Cerep_002016	Fc1ccc(cc1F)S(=O)(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E19	compound treatment	0.781	-0.00306	-0.04	0.739	0.0109	0.15	0.0762	0.4928	1967325	Cerep_002017	Cc1cccc(Cl)c1S(=O)(=O)NC2CCN(Cc3c(F)cccc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E20	compound treatment	0.791	0.00694	0.09	0.728	-6.9E-5	0.0	0.0655	0.7	1967326	Cerep_002018	Fc1cc(F)cc(CNS(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E21	compound treatment	0.779	-0.00506	-0.07	0.717	-0.0111	-0.15	-0.155	-0.9356	1967327	Cerep_002019	Cc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Br)s3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	E22	compound treatment	0.795	0.0109	0.15	0.741	0.0129	0.18	0.2291	0.9961	1967328	Cerep_002020	CC(=O)N1CCCN(CC1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F03	compound treatment	0.801	0.0169	0.23	0.754	0.0259	0.35	0.4116	0.9777	1967329	Cerep_002021	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F04	compound treatment	0.762	-0.0221	-0.3	0.712	-0.0161	-0.22	-0.3654	-0.9887	1967330	Cerep_002022	Cc1cc(no1)c2onc(C)c2COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F05	compound treatment	0.795	0.0109	0.15	0.759	0.0309	0.42	0.4026	0.901	1967331	Cerep_002023	CC(C)(C)CC(=C)CC(CC(=O)O)C(=O)N1CCCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F06	compound treatment	0.765	-0.0191	-0.26	0.734	0.00593	0.08	-0.1246	-0.4624	1967332	Cerep_002024	Cc1cc(COC(=O)NNC(=O)c2ccc(cc2)c3ccccc3)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F07	compound treatment	0.772	-0.0121	-0.16	0.727	-0.00107	-0.01	-0.1253	-0.7674	1967333	Cerep_002025	OC(=O)CCC(=O)N1CCC(O)(CC1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F08	compound treatment	0.77	-0.0141	-0.19	0.712	-0.0161	-0.22	-0.2891	-0.9974	1967334	Cerep_002026	COc1cc(CCNC(=O)OCCc2c(C)cc(C)cc2C)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F09	compound treatment	0.801	0.0169	0.23	0.72	-0.00807	-0.11	0.0838	0.3304	1967335	Cerep_002027	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)c3cc(nc4ccccc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F10	compound treatment	0.764	-0.0201	-0.27	0.707	-0.0211	-0.29	-0.3945	-0.9996	1967336	Cerep_002028	CCN(Cc1ccncc1)C(=O)C(COC(=O)NCCc2c[nH]c3ccc(C)cc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F11	compound treatment	0.786	0.00194	0.03	0.727	-0.00107	-0.01	0.0082	0.2738	1967337	Cerep_002029	Cc1ccc(Cl)cc1N2CCN(CC2)C(=O)c3ccccc3CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F12	compound treatment	0.768	-0.0161	-0.22	0.69	-0.0381	-0.52	-0.5203	-0.9249	1967338	Cerep_002030	Cc1ccc2[nH]cc(CCNC(=O)OCc3cccc(OCc4ccccc4)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F13	compound treatment	0.788	0.00394	0.05	0.71	-0.0181	-0.25	-0.1366	-0.5421	1967339	Cerep_002031	OC(=O)/C=C\C(=O)N1CCN(CC1)c2cccc3[nH]ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F14	compound treatment	0.775	-0.00906	-0.12	0.71	-0.0181	-0.25	-0.2607	-0.9477	1967340	Cerep_002032	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCc3cccc(C)c3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F15	compound treatment	0.797	0.0129	0.17	0.765	0.0369	0.5	0.4795	0.8997	1967341	Cerep_002033	COc1ccc(OC)c(c1)C2N(CCc3c2[nH]c4ccccc34)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F16	compound treatment	0.782	-0.00206	-0.03	0.729	9.31E-4	0.01	-0.0107	-0.3493	1967342	Cerep_002034	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F17	compound treatment	0.762	-0.0221	-0.3	0.729	9.31E-4	0.01	-0.2015	-0.6763	1967343	Cerep_002035	OC(=O)CCC(=O)N1CCC(=CC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F18	compound treatment	0.805	0.0209	0.28	0.734	0.00593	0.08	0.2569	0.8744	1967344	Cerep_002036	COc1ccccc1CCOC(=O)NC(Cc2ccccc2)C(=O)Nc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F19	compound treatment	0.787	0.00294	0.04	0.728	-6.9E-5	0.0	0.0274	0.6901	1967345	Cerep_002037	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)C3CC=CCC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F20	compound treatment	0.781	-0.00306	-0.04	0.69	-0.0381	-0.52	-0.3963	-0.7609	1967346	Cerep_002038	O=C(NNC(=O)/C=C/c1ccco1)OCC(Cc2ccccc2)NC(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F21	compound treatment	0.779	-0.00506	-0.07	0.767	0.0389	0.53	0.3271	0.6112	1967347	Cerep_002039	OC(=O)CC1(CC(=O)N2CCN(CC2)c3cc(ccn3)C(F)(F)F)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	F22	compound treatment	0.791	0.00694	0.09	0.723	-0.00507	-0.07	0.0173	0.1489	1967348	Cerep_002040	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCCN3Cc4ccc(Cl)c(c4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G03	compound treatment	0.781	-0.00306	-0.04	0.731	0.00293	0.04	-9.0E-4	-0.0161	1210789	Cerep_002041	Brc1ccc(cc1)S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G04	compound treatment	0.788	0.00394	0.05	0.738	0.00993	0.14	0.1333	0.9166	1967349	Cerep_002042	CCn1c2ccccc2c3cc(CN4CCN(CC4)S(=O)(=O)c5ccc(OC)c(OC)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G05	compound treatment	0.782	-0.00206	-0.03	0.767	0.0389	0.53	0.3557	0.6692	1967350	Cerep_002043	Brc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G06	compound treatment	0.797	0.0129	0.17	0.732	0.00393	0.05	0.1613	0.8835	1967351	Cerep_002044	Cc1nn(c(C)c1CN2CCN(CC2)S(=O)(=O)c3ccccc3OC(F)(F)F)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G07	compound treatment	0.791	0.00694	0.09	0.738	0.00993	0.14	0.162	0.9838	1967352	Cerep_002045	Brc1ccc(cc1)S(=O)(=O)NCC2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G08	compound treatment	0.772	-0.0121	-0.16	0.731	0.00293	0.04	-0.0868	-0.518	1206140	Cerep_002046	CCN(CCc1ccccn1)S(=O)(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G09	compound treatment	0.76	-0.0241	-0.32	0.732	0.00393	0.05	-0.1916	-0.5824	1967353	Cerep_002047	CCCc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3c(F)cccc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G10	compound treatment	0.777	-0.00706	-0.1	0.719	-0.00907	-0.12	-0.1548	-0.9917	1967354	Cerep_002048	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCC2CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G11	compound treatment	0.764	-0.0201	-0.27	0.674	-0.0541	-0.74	-0.7127	-0.9074	1967355	Cerep_002049	Fc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G12	compound treatment	0.796	0.0119	0.16	0.732	0.00393	0.05	0.1518	0.8942	1967356	Cerep_002050	CN(C1CCN(Cc2c(F)cccc2Cl)C1)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G13	compound treatment	0.78	-0.00406	-0.05	0.722	-0.00607	-0.08	-0.0972	-0.9799	1967357	Cerep_002051	CCN(Cc1ccncc1)S(=O)(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G14	compound treatment	0.817	0.0329	0.44	0.741	0.0129	0.18	0.4389	0.9181	1967358	Cerep_002052	CC(C)c1ccc(CN(Cc2ccco2)S(=O)(=O)c3ccc(NC(=O)C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G15	compound treatment	0.797	0.0129	0.17	0.721	-0.00707	-0.1	0.0553	0.2772	1967359	Cerep_002053	CC1CN(CC(C)O1)S(=O)(=O)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G16	compound treatment	0.779	-0.00506	-0.07	0.739	0.0109	0.15	0.0571	0.3485	1967360	Cerep_002054	OC1(Cc2ccccc2)CCN(CC1)S(=O)(=O)c3ccc(Cl)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G17	compound treatment	0.792	0.00794	0.11	0.751	0.0229	0.31	0.2969	0.8981	1421736	Cerep_002055	Brc1ccccc1S(=O)(=O)N2CCN(CC2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G18	compound treatment	0.807	0.0229	0.31	0.708	-0.0201	-0.27	0.0253	0.0613	1967361	Cerep_002056	Fc1ccc(cc1F)S(=O)(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G19	compound treatment	0.795	0.0109	0.15	0.72	-0.00807	-0.11	0.0266	0.1443	1967362	Cerep_002057	CN(CCc1c[nH]c2ccccc12)S(=O)(=O)c3c(C)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G20	compound treatment	0.805	0.0209	0.28	0.734	0.00593	0.08	0.2569	0.8744	1967363	Cerep_002058	CCOC(=O)CCC(NS(=O)(=O)c1ccc(Oc2cccc(Cl)c2C#N)cc1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G21	compound treatment	0.815	0.0309	0.42	0.756	0.0279	0.38	0.5645	0.999	1967364	Cerep_002059	Clc1ccc2[nH]cc(CCNS(=O)(=O)c3ccc(Br)s3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	G22	compound treatment	0.792	0.00794	0.11	0.746	0.0179	0.24	0.2486	0.9314	1967365	Cerep_002060	COc1ccc(CNS(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H03	compound treatment	0.774	-0.0101	-0.14	0.734	0.00593	0.08	-0.0388	-0.2454	1967366	Cerep_002061	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CC2)C(=O)c3ccc(F)cc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H04	compound treatment	0.747	-0.0371	-0.5	0.723	-0.00507	-0.07	-0.4024	-0.7973	1967367	Cerep_002062	[O-][N+](=O)c1cc(CN2CCCCC2COC(=O)NCc3ccc(cc3)c4csnn4)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H05	compound treatment	0.78	-0.00406	-0.05	0.735	0.00693	0.09	0.0281	0.2573	1967368	Cerep_002063	COc1ccc(CCN(C)C(=O)C(CC(=O)O)Cc2cccc(C)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H06	compound treatment	0.761	-0.0231	-0.31	0.725	-0.00307	-0.04	-0.2496	-0.7951	1967369	Cerep_002064	Cc1nc(sc1C(=O)NNC(=O)OCCNC(=O)OCc2ccccc2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H07	compound treatment	0.812	0.0279	0.38	0.762	0.0339	0.46	0.5937	0.9948	1967370	Cerep_002065	OC(=O)Cc1ccccc1C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H08	compound treatment	0.783	-0.00106	-0.01	0.705	-0.0231	-0.31	-0.2325	-0.7385	1967371	Cerep_002066	O=C(NCCC1=CCCCC1)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H09	compound treatment	0.791	0.00694	0.09	0.724	-0.00407	-0.06	0.027	0.2478	1967372	Cerep_002067	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H10	compound treatment	0.783	-0.00106	-0.01	0.741	0.0129	0.18	0.1146	0.6477	1967373	Cerep_002068	CN(C)c1ccc(CN2CCN(CCOC(=O)NCc3csc4ccccc34)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H11	compound treatment	0.776	-0.00806	-0.11	0.736	0.00793	0.11	-4.0E-4	-0.0027	1967374	Cerep_002069	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H12	compound treatment	0.767	-0.0171	-0.23	0.688	-0.0401	-0.55	-0.5491	-0.9261	1967375	Cerep_002070	Cc1ccc(cc1)N2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H13	compound treatment	0.768	-0.0161	-0.22	0.729	9.31E-4	0.01	-0.1442	-0.6645	1967376	Cerep_002071	OC(=O)/C=C\C(=O)N1CCCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H14	compound treatment	0.779	-0.00506	-0.07	0.716	-0.0121	-0.16	-0.1646	-0.9241	1967377	Cerep_002072	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCc3ccc(C)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H15	compound treatment	0.775	-0.00906	-0.12	0.707	-0.0211	-0.29	-0.2896	-0.9275	1967378	Cerep_002073	COc1cccc(c1)N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H16	compound treatment	0.764	-0.0201	-0.27	0.725	-0.00307	-0.04	-0.2209	-0.8069	1967379	Cerep_002074	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCC3CCN(O)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H17	compound treatment	0.77	-0.0141	-0.19	0.741	0.0129	0.18	-0.0094	-0.0364	1967380	Cerep_002075	COc1ccc(cc1)N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H18	compound treatment	0.757	-0.0271	-0.37	0.718	-0.0101	-0.14	-0.3552	-0.9108	1967381	Cerep_002076	O=C(NNC(=O)c1cccc2ccccc12)OCC3CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H19	compound treatment	0.812	0.0279	0.38	0.749	0.0209	0.29	0.4684	0.9906	1967382	Cerep_002077	OC(=O)CSCC(=O)N1CCN(CC1)C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H20	compound treatment	0.775	-0.00906	-0.12	0.697	-0.0311	-0.42	-0.386	-0.8754	1967383	Cerep_002078	Cc1cc(COC(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H21	compound treatment	0.791	0.00694	0.09	0.715	-0.0131	-0.18	-0.0598	-0.2971	1967384	Cerep_002079	OC(=O)CC1(CC(=O)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	H22	compound treatment	0.774	-0.0101	-0.14	0.71	-0.0181	-0.25	-0.2702	-0.9605	1967385	Cerep_002080	COc1cc(CN2CCN(CCOC(=O)NCC(C)c3ccccc3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I03	compound treatment	0.786	0.00194	0.03	0.749	0.0209	0.29	0.2203	0.7687	1244338	Cerep_002081	CCCc1ccc(cc1)S(=O)(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I04	compound treatment	0.762	-0.0221	-0.3	0.762	0.0339	0.46	0.1167	0.2122	1967386	Cerep_002082	COc1ccc(cc1OC)S(=O)(=O)N2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I05	compound treatment	0.783	-0.00106	-0.01	0.728	-6.9E-5	0.0	-0.0108	-0.752	1967387	Cerep_002083	FC(F)(F)c1cnc(N2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I06	compound treatment	0.764	-0.0201	-0.27	0.718	-0.0101	-0.14	-0.2884	-0.9505	1967388	Cerep_002084	FC(F)(F)Oc1ccccc1S(=O)(=O)NC2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I07	compound treatment	0.783	-0.00106	-0.01	0.725	-0.00307	-0.04	-0.0397	-0.8977	1967389	Cerep_002085	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)S(=O)(=O)c4ccc(Br)cc4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I08	compound treatment	0.814	0.0299	0.4	0.732	0.00393	0.05	0.3235	0.794	1967390	Cerep_002086	Cc1nn(c(C)c1CN2CCC(C2)NS(=O)(=O)c3cccc(Br)c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I09	compound treatment	0.765	-0.0191	-0.26	0.729	9.31E-4	0.01	-0.1728	-0.6714	1967391	Cerep_002087	CCCc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc4n(CC)c5ccccc5c4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I10	compound treatment	0.781	-0.00306	-0.04	0.722	-0.00607	-0.08	-0.0877	-0.9484	1967392	Cerep_002088	CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(COC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I11	compound treatment	0.781	-0.00306	-0.04	0.719	-0.00907	-0.12	-0.1166	-0.8946	1967393	Cerep_002089	COc1ccc(OC)c(CNS(=O)(=O)c2cccc(F)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I12	compound treatment	0.769	-0.0151	-0.2	0.716	-0.0121	-0.16	-0.26	-0.9945	1397754	Cerep_002090	COc1cc(CCNS(=O)(=O)c2ccc(NC(=O)C)cc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I13	compound treatment	0.754	-0.0301	-0.41	0.68	-0.0481	-0.66	-0.7502	-0.9734	1967394	Cerep_002091	COc1ccc(cc1OC)S(=O)(=O)NCCN2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I14	compound treatment	0.812	0.0279	0.38	0.748	0.0199	0.27	0.4587	0.9871	1967395	Cerep_002092	CC(NS(=O)(=O)c1ccc(NC(=O)C)cc1)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I15	compound treatment	0.781	-0.00306	-0.04	0.709	-0.0191	-0.26	-0.2131	-0.8092	1967396	Cerep_002093	Clc1cccc(c1Cl)S(=O)(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I16	compound treatment	0.785	9.4E-4	0.01	0.743	0.0149	0.2	0.1529	0.7497	1967397	Cerep_002094	OC1CCN(C1)S(=O)(=O)c2ccc(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I17	compound treatment	0.801	0.0169	0.23	0.74	0.0119	0.16	0.2766	0.9861	1967398	Cerep_002095	COc1ccc2ccccc2c1CN3CCN(CC3)S(=O)(=O)c4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I18	compound treatment	0.772	-0.0121	-0.16	0.726	-0.00207	-0.03	-0.135	-0.8175	1967399	Cerep_002096	CCN(CC)CCCC(C)NS(=O)(=O)c1ccc(C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I19	compound treatment	0.788	0.00394	0.05	0.734	0.00593	0.08	0.0948	0.9793	1967400	Cerep_002097	COCC(NS(=O)(=O)c1c(C)cccc1Cl)C(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I20	compound treatment	0.776	-0.00806	-0.11	0.741	0.0129	0.18	0.0478	0.2308	1967401	Cerep_002098	CN(CC(O)c1ccccc1)S(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I21	compound treatment	0.811	0.0269	0.36	0.728	-6.9E-5	0.0	0.2563	0.7053	1967402	Cerep_002099	CCOc1ccccc1CN(Cc2ccco2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	I22	compound treatment	0.82	0.0359	0.48	0.723	-0.00507	-0.07	0.294	0.6002	1967403	Cerep_002100	CC1CCCN(C1)S(=O)(=O)c2ccc3CCN(Cc3c2)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J03	compound treatment	0.805	0.0209	0.28	0.739	0.0109	0.15	0.3052	0.9554	1967404	Cerep_002101	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCC(=CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J04	compound treatment	0.771	-0.0131	-0.18	0.725	-0.00307	-0.04	-0.1542	-0.8514	1967405	Cerep_002102	COc1cc(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J05	compound treatment	0.757	-0.0271	-0.37	0.751	0.0229	0.31	-0.037	-0.077	1967406	Cerep_002103	Cc1cccc(CC(CC(=O)O)C(=O)N2CCN(C/C=C/c3ccccc3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J06	compound treatment	0.772	-0.0121	-0.16	0.739	0.0109	0.15	-0.0096	-0.0437	1967407	Cerep_002104	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCC3CC4CCC3C4)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J07	compound treatment	0.8	0.0159	0.22	0.752	0.0239	0.33	0.3828	0.9795	1967408	Cerep_002105	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)c4ccccc4CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J08	compound treatment	0.789	0.00494	0.07	0.732	0.00393	0.05	0.085	0.9942	1967409	Cerep_002106	CCC#CCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J09	compound treatment	0.766	-0.0181	-0.24	0.745	0.0169	0.23	-0.009	-0.0269	1967410	Cerep_002107	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)C(=O)C(CC(=O)O)Cc4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J10	compound treatment	0.754	-0.0301	-0.41	0.731	0.00293	0.04	-0.2585	-0.6343	1967411	Cerep_002108	COc1ccc(CN2CCCC(COC(=O)NC(C)c3cccc4OCCOc34)C2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J11	compound treatment	0.804	0.0199	0.27	0.732	0.00393	0.05	0.2281	0.8317	1967412	Cerep_002109	OC(=O)/C=C\C(=O)N1CCc2ccccc2C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J12	compound treatment	0.77	-0.0141	-0.19	0.72	-0.00807	-0.11	-0.2119	-0.9665	1967413	Cerep_002110	CCOC(=O)c1c(SC)nc2c(Cl)cccc2c1N(C)CCOC(=O)NC3CCN(Cc4ccc5n(CC)c6ccccc6c5c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J13	compound treatment	0.778	-0.00606	-0.08	0.738	0.00993	0.14	0.038	0.2399	1967414	Cerep_002111	OC(=O)/C=C/C(=O)N1CCCC1C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J14	compound treatment	0.78	-0.00406	-0.05	0.699	-0.0291	-0.4	-0.319	-0.7972	1967415	Cerep_002112	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J15	compound treatment	0.791	0.00694	0.09	0.735	0.00693	0.09	0.133	1.0	1967416	Cerep_002113	OC(=O)CCC(=O)N1CCN(CC1)c2ncccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J16	compound treatment	0.772	-0.0121	-0.16	0.699	-0.0291	-0.4	-0.3953	-0.9226	1967417	Cerep_002114	Cc1cccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J17	compound treatment	0.782	-0.00206	-0.03	0.693	-0.0351	-0.48	-0.3578	-0.7469	1967418	Cerep_002115	OC(=O)CCC(=O)N1CCN(CC1)c2ncnc3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J18	compound treatment	0.753	-0.0311	-0.42	0.685	-0.0431	-0.59	-0.7116	-0.9863	1967419	Cerep_002116	FC(F)(F)c1ccccc1CCOC(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J19	compound treatment	0.81	0.0259	0.35	0.745	0.0169	0.23	0.4107	0.9796	1478055	Cerep_002117	OC(=O)C1CC=CCC1C(=O)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J20	compound treatment	0.792	0.00794	0.11	0.677	-0.0511	-0.7	-0.4167	-0.5914	1967420	Cerep_002118	O=C(NNC(=O)c1cc(nc2ccccc12)c3ccccc3)OCc4ccc(C#Cc5ccccc5)s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J21	compound treatment	0.817	0.0329	0.44	0.778	0.0499	0.68	0.7957	0.9786	1967421	Cerep_002119	OC(=O)CC1(CC(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	J22	compound treatment	0.766	-0.0181	-0.24	0.725	-0.00307	-0.04	-0.2019	-0.8166	1967422	Cerep_002120	CN(C)c1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)C(=O)OCc4ccccc4)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K03	compound treatment	0.811	0.0269	0.36	0.716	-0.0121	-0.16	0.1406	0.3525	1967423	Cerep_002121	CCCc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(OC)cc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K04	compound treatment	0.802	0.0179	0.24	0.752	0.0239	0.33	0.4019	0.9892	1967424	Cerep_002122	COc1ccc(cc1OC)S(=O)(=O)N2CCN(Cc3cc(Br)c(OC)cc3OC)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K05	compound treatment	0.786	0.00194	0.03	0.742	0.0139	0.19	0.1528	0.797	1967425	Cerep_002123	CN(C1CCN(Cc2ccc(cc2)c3ccccc3)C1)S(=O)(=O)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K06	compound treatment	0.776	-0.00806	-0.11	0.72	-0.00807	-0.11	-0.1547	-1.0	1967426	Cerep_002124	FC(F)(F)Oc1ccccc1S(=O)(=O)NCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K07	compound treatment	0.79	0.00594	0.08	0.769	0.0409	0.56	0.4513	0.8004	1967427	Cerep_002125	Brc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3nccnc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K08	compound treatment	0.804	0.0199	0.27	0.757	0.0289	0.39	0.4692	0.9826	1967428	Cerep_002126	CC(C)c1ccc(CN2CCC(C2)N(C)S(=O)(=O)c3cccc(Br)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K09	compound treatment	0.765	-0.0191	-0.26	0.743	0.0149	0.2	-0.0378	-0.1154	1967429	Cerep_002127	CCCc1ccc(cc1)S(=O)(=O)N2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K10	compound treatment	0.81	0.0259	0.35	0.745	0.0169	0.23	0.4107	0.9796	1967430	Cerep_002128	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K11	compound treatment	0.766	-0.0181	-0.24	0.72	-0.00807	-0.11	-0.2501	-0.9355	1967431	Cerep_002129	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)S(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K12	compound treatment	0.797	0.0129	0.17	0.735	0.00693	0.09	0.1903	0.9585	1967432	Cerep_002130	CCOc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K13	compound treatment	0.786	0.00194	0.03	0.719	-0.00907	-0.12	-0.0689	-0.5453	1967433	Cerep_002131	CCOC(=O)CCC(NS(=O)(=O)c1ccc(OC)c(OC)c1)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K14	compound treatment	0.779	-0.00506	-0.07	0.727	-0.00107	-0.01	-0.0586	-0.8392	1478739	Cerep_002132	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc2ccc(cc2)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K15	compound treatment	0.787	0.00294	0.04	0.752	0.0239	0.33	0.2588	0.7873	1967434	Cerep_002133	FC(F)(F)c1cccnc1N2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K16	compound treatment	0.794	0.00994	0.13	0.764	0.0359	0.49	0.4413	0.8687	1967435	Cerep_002134	Clc1ccc(s1)S(=O)(=O)NCc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K17	compound treatment	0.8	0.0159	0.22	0.711	-0.0171	-0.23	-0.0125	-0.0395	1967436	Cerep_002135	Brc1ccccc1S(=O)(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K18	compound treatment	0.793	0.00894	0.12	0.718	-0.0101	-0.14	-0.0118	-0.0646	1570050	Cerep_002136	COc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(C)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K19	compound treatment	0.782	-0.00206	-0.03	0.742	0.0139	0.19	0.1147	0.5973	1967437	Cerep_002137	Cc1cccc(Cl)c1S(=O)(=O)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K20	compound treatment	0.802	0.0179	0.24	0.734	0.00593	0.08	0.2283	0.8948	1967438	Cerep_002138	CN1CCN(CC1)S(=O)(=O)c2ccc(Oc3cccc(Cl)c3C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K21	compound treatment	0.78	-0.00406	-0.05	0.723	-0.00507	-0.07	-0.0876	-0.9934	1967439	Cerep_002139	Brc1ccc(s1)S(=O)(=O)N(Cc2ccco2)Cc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	K22	compound treatment	0.791	0.00694	0.09	0.722	-0.00607	-0.08	0.0077	0.0615	1967440	Cerep_002140	CCN(CC)CCN(CC)S(=O)(=O)c1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L03	compound treatment	0.8	0.0159	0.22	0.737	0.00893	0.12	0.2382	0.9637	1967441	Cerep_002141	COc1ccc(cc1)N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L04	compound treatment	0.782	-0.00206	-0.03	0.711	-0.0171	-0.23	-0.1842	-0.7859	1967442	Cerep_002142	FC(F)(F)c1ccccc1CCOC(=O)NNC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L05	compound treatment	0.797	0.0129	0.17	0.723	-0.00507	-0.07	0.0746	0.3971	1967443	Cerep_002143	Cc1cccc(CC(CC(=O)O)C(=O)N2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L06	compound treatment	0.777	-0.00706	-0.1	0.722	-0.00607	-0.08	-0.1259	-0.9976	1967444	Cerep_002144	COc1ccc2[nH]cc(CCNC(=O)OCCC3=CCC4CC3C4(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L07	compound treatment	0.768	-0.0161	-0.22	0.724	-0.00407	-0.06	-0.1924	-0.8604	1967445	Cerep_002145	CC1N(CCc2cc(O)c(O)cc12)C(=O)c3ccccc3CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L08	compound treatment	0.762	-0.0221	-0.3	0.708	-0.0201	-0.27	-0.4039	-0.9991	1967446	Cerep_002146	CC(C)(C)c1ccc(COC(=O)NNC(=O)/C=C/c2ccc(F)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L09	compound treatment	0.765	-0.0191	-0.26	0.725	-0.00307	-0.04	-0.2114	-0.8115	1967447	Cerep_002147	CCc1ccccc1N2CCN(CC2)C(=O)c3ccccc3CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L10	compound treatment	0.763	-0.0211	-0.28	0.73	0.00193	0.03	-0.1823	-0.6388	1967448	Cerep_002148	Cc1csc(C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2)c1n5cccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L11	compound treatment	0.791	0.00694	0.09	0.737	0.00893	0.12	0.1523	0.9916	1967449	Cerep_002149	OC(=O)C1C(C2CCC1C=C2)C(=O)N3CCN(CC3)C(c4ccc(F)cc4)c5ccc(F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L12	compound treatment	0.767	-0.0171	-0.23	0.716	-0.0121	-0.16	-0.2791	-0.9865	1967450	Cerep_002150	CC(C)(C)OC(=O)N(CCOC(=O)N1CCC(O)(CC1)c2cccc(c2)C(F)(F)F)Cc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L13	compound treatment	0.8	0.0159	0.22	0.746	0.0179	0.24	0.325	0.998	1967451	Cerep_002151	OC(=O)/C=C\C(=O)N1CCN(CC1)C(=O)Cc2ccc(F)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L14	compound treatment	0.785	9.4E-4	0.01	0.713	-0.0151	-0.21	-0.1363	-0.6622	1967452	Cerep_002152	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCCCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L15	compound treatment	0.791	0.00694	0.09	0.734	0.00593	0.08	0.1234	0.9973	1967453	Cerep_002153	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L16	compound treatment	0.761	-0.0231	-0.31	0.711	-0.0171	-0.23	-0.3846	-0.9898	1967454	Cerep_002154	COc1ccccc1CNC(=O)OCCC2=CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L17	compound treatment	0.78	-0.00406	-0.05	0.732	0.00393	0.05	-8.0E-4	-0.0107	1967455	Cerep_002155	OC(=O)CCC(=O)N1CCN(CC1)C(=O)C2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L18	compound treatment	0.739	-0.0451	-0.61	0.686	-0.0421	-0.57	-0.8355	-0.9996	1967456	Cerep_002156	O=C(OCc1cccc(Oc2ccccc2)c1)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L19	compound treatment	0.79	0.00594	0.08	0.699	-0.0291	-0.4	-0.2236	-0.553	1617882	Cerep_002157	OC(=O)CC1(CC(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L20	compound treatment	0.776	-0.00806	-0.11	0.732	0.00393	0.05	-0.039	-0.3215	1967457	Cerep_002158	OC(C1CCN(CC1)C(=O)OCc2nccn2Cc3ccccc3)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L21	compound treatment	0.802	0.0179	0.24	0.729	9.31E-4	0.01	0.1801	0.7432	1967458	Cerep_002159	OC(=O)CC1(CC(=O)N2CCN(CC2)c3ccccc3C#N)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	L22	compound treatment	0.782	-0.00206	-0.03	0.71	-0.0181	-0.25	-0.1939	-0.7819	1967459	Cerep_002160	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCN3C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M03	compound treatment	0.798	0.0139	0.19	0.75	0.0219	0.3	0.3445	0.975	1967460	Cerep_002161	CCCCc1ccc(NS(=O)(=O)c2ccc(CCC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M04	compound treatment	0.816	0.0319	0.43	0.716	-0.0121	-0.16	0.1883	0.4083	1967461	Cerep_002162	COc1ccc(cc1OC)S(=O)(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M05	compound treatment	0.777	-0.00706	-0.1	0.727	-0.00107	-0.01	-0.0777	-0.8059	1967462	Cerep_002163	COc1cccc(c1)C(C)NS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M06	compound treatment	0.776	-0.00806	-0.11	0.731	0.00293	0.04	-0.0486	-0.4197	1967463	Cerep_002164	CCOc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M07	compound treatment	0.795	0.0109	0.15	0.776	0.0479	0.65	0.5665	0.8455	1418423	Cerep_002165	CCN(Cc1ccncc1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M08	compound treatment	0.797	0.0129	0.17	0.789	0.0609	0.83	0.711	0.8374	1967464	Cerep_002166	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)S(=O)(=O)c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M09	compound treatment	0.787	0.00294	0.04	0.74	0.0119	0.16	0.1431	0.8545	1967465	Cerep_002167	CCCc1ccc(cc1)S(=O)(=O)N2CCN(Cc3cc(Br)c(OC)cc3OC)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M10	compound treatment	0.811	0.0269	0.36	0.74	0.0119	0.16	0.372	0.9343	1967466	Cerep_002168	COCCNS(=O)(=O)c1ccc(NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M11	compound treatment	0.78	-0.00406	-0.05	0.727	-0.00107	-0.01	-0.049	-0.8652	1967467	Cerep_002169	Cc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M12	compound treatment	0.792	0.00794	0.11	0.73	0.00193	0.03	0.0944	0.8555	1967468	Cerep_002170	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3ccc(F)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M13	compound treatment	0.806	0.0219	0.3	0.723	-0.00507	-0.07	0.1604	0.5278	1967469	Cerep_002171	COc1ccc(cc1OC)S(=O)(=O)N(C)CC(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M14	compound treatment	0.811	0.0269	0.36	0.754	0.0259	0.35	0.507	0.9999	1967470	Cerep_002172	COc1cccc(OC)c1CNS(=O)(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M15	compound treatment	0.759	-0.0251	-0.34	0.736	0.00793	0.11	-0.1626	-0.458	1967471	Cerep_002173	COc1ccc(CCNS(=O)(=O)c2cccc(Cl)c2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M16	compound treatment	0.789	0.00494	0.07	0.718	-0.0101	-0.14	-0.05	-0.3273	1967472	Cerep_002174	Clc1ccc(s1)S(=O)(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M17	compound treatment	0.806	0.0219	0.3	0.745	0.0169	0.23	0.3726	0.9925	1967473	Cerep_002175	Brc1ccccc1S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M18	compound treatment	0.787	0.00294	0.04	0.732	0.00393	0.05	0.066	0.989	1499476	Cerep_002176	Cc1ccc(N2CCN(CC2)S(=O)(=O)c3ccc(C)c(Cl)c3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M19	compound treatment	0.778	-0.00606	-0.08	0.729	9.31E-4	0.01	-0.0488	-0.5902	1967474	Cerep_002177	Cc1cccc(Cl)c1S(=O)(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M20	compound treatment	0.81	0.0259	0.35	0.741	0.0129	0.18	0.3721	0.9497	1408127	Cerep_002178	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)N(CCC#N)CC3CCCO3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M21	compound treatment	0.811	0.0269	0.36	0.76	0.0319	0.44	0.5649	0.996	1234587	Cerep_002179	COc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	M22	compound treatment	0.808	0.0239	0.32	0.748	0.0199	0.27	0.4206	0.9963	1967475	Cerep_002180	FC(F)(F)C(=O)N1CCc2ccc(cc2C1)S(=O)(=O)N3CCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N03	compound treatment	0.806	0.0219	0.3	0.732	0.00393	0.05	0.2472	0.8218	1967476	Cerep_002181	CC1CN(CCN1c2cccc(C)c2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N04	compound treatment	0.796	0.0119	0.16	0.727	-0.00107	-0.01	0.1036	0.6405	1967477	Cerep_002182	CC1CC1COC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N05	compound treatment	0.817	0.0329	0.44	0.753	0.0249	0.34	0.5546	0.9913	1967478	Cerep_002183	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)C(CC(=O)O)Cc5cccc(C)c5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N06	compound treatment	0.788	0.00394	0.05	0.728	-6.9E-5	0.0	0.0369	0.6945	1967479	Cerep_002184	COc1ccc(cc1)C(=O)NNC(=O)OCC2C(C)C3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N07	compound treatment	0.764	-0.0201	-0.27	0.796	0.0679	0.93	0.4637	0.4805	1967480	Cerep_002185	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N08	compound treatment	0.764	-0.0201	-0.27	0.75	0.0219	0.3	0.0201	0.0499	1967481	Cerep_002186	COc1ccc(OCCNC(=O)OCCCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N09	compound treatment	0.792	0.00794	0.11	0.759	0.0309	0.42	0.374	0.8594	1967482	Cerep_002187	COc1ccccc1C2CCN(CC2)C(=O)c3ccccc3CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N10	compound treatment	0.765	-0.0191	-0.26	0.704	-0.0241	-0.33	-0.4139	-0.9927	1967483	Cerep_002188	COc1ccc(COC(=O)NNC(=O)Cc2ccsc2)c(Cl)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N11	compound treatment	0.795	0.0109	0.15	0.753	0.0249	0.34	0.3448	0.9302	1967484	Cerep_002189	OC(=O)/C=C\C(=O)N(CCc1ccccc1)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N12	compound treatment	0.767	-0.0171	-0.23	0.724	-0.00407	-0.06	-0.202	-0.8531	1967485	Cerep_002190	CC(=O)NCCNC(=O)OCCc1ccccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N13	compound treatment	0.812	0.0279	0.38	0.71	-0.0181	-0.25	0.0923	0.205	1967486	Cerep_002191	OC(=O)/C=C\C(=O)N1CCC(O)(CC1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N14	compound treatment	0.812	0.0279	0.38	0.738	0.00993	0.14	0.3623	0.9045	1967487	Cerep_002192	CC(CCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N15	compound treatment	0.739	-0.0451	-0.61	0.726	-0.00207	-0.03	-0.4498	-0.7391	1967488	Cerep_002193	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N16	compound treatment	0.79	0.00594	0.08	0.705	-0.0231	-0.31	-0.1658	-0.5107	1967489	Cerep_002194	Fc1ccc(cc1)C(=O)NNC(=O)OCC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N17	compound treatment	0.801	0.0169	0.23	0.71	-0.0181	-0.25	-0.0126	-0.0376	1967490	Cerep_002195	OC(=O)C1CC=CCC1C(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N18	compound treatment	0.771	-0.0131	-0.18	0.724	-0.00407	-0.06	-0.1638	-0.8869	1967491	Cerep_002196	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)OCCN3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N19	compound treatment	0.777	-0.00706	-0.1	0.704	-0.0241	-0.33	-0.2994	-0.8761	1967492	Cerep_002197	OC(=O)CC1(CC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N20	compound treatment	0.766	-0.0181	-0.24	0.743	0.0149	0.2	-0.0283	-0.0891	1967493	Cerep_002198	Clc1ccc(cc1)c2csc(COC(=O)NCCc3c[nH]cn3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N21	compound treatment	0.784	-5.96E-5	0.0	0.739	0.0109	0.15	0.1048	0.7033	1967494	Cerep_002199	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)CC3(CC(=O)O)CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	N22	compound treatment	0.762	-0.0221	-0.3	0.702	-0.0261	-0.36	-0.4618	-0.9961	1967495	Cerep_002200	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O03	compound treatment	0.779	-0.00506	-0.07	0.73	0.00193	0.03	-0.0296	-0.4052	1967496	Cerep_002201	CC(OCc1ccccc1)C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O04	compound treatment	0.771	-0.0131	-0.18	0.747	0.0189	0.26	0.058	0.1855	1967497	Cerep_002202	COc1ccc(cc1OC)S(=O)(=O)NC2CCN(Cc3c(F)cccc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O05	compound treatment	0.812	0.0279	0.38	0.74	0.0119	0.16	0.3816	0.9294	1967498	Cerep_002203	Fc1cccc(CCNS(=O)(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O06	compound treatment	0.817	0.0329	0.44	0.737	0.00893	0.12	0.4003	0.8689	1967499	Cerep_002204	COc1ccccc1C2CCN(CC2)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O07	compound treatment	0.812	0.0279	0.38	0.751	0.0229	0.31	0.4876	0.9957	1967500	Cerep_002205	COc1cc(OC)cc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O08	compound treatment	0.801	0.0169	0.23	0.75	0.0219	0.3	0.3731	0.9912	1967501	Cerep_002206	Cc1ccc(cc1)C(=O)N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O09	compound treatment	0.86	0.0759	1.02	0.787	0.0589	0.8	1.2927	0.9928	1967502	Cerep_002207	Fc1cccc(c1)S(=O)(=O)NCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O10	compound treatment	0.769	-0.0151	-0.2	0.728	-6.9E-5	0.0	-0.1443	-0.7104	1967503	Cerep_002208	CC(=O)Nc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O11	compound treatment	0.789	0.00494	0.07	0.74	0.0119	0.16	0.1622	0.9224	1327478	Cerep_002209	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O12	compound treatment	0.817	0.0329	0.44	0.762	0.0339	0.46	0.6414	0.9998	1967504	Cerep_002210	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCC(C)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O13	compound treatment	0.771	-0.0131	-0.18	0.722	-0.00607	-0.08	-0.1831	-0.9407	1967505	Cerep_002211	COc1cccc(c1)C2N(CCc3c2[nH]c4ccccc34)S(=O)(=O)c5cccc(Cl)c5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O14	compound treatment	0.791	0.00694	0.09	0.737	0.00893	0.12	0.1523	0.9916	1967506	Cerep_002212	CCOc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O15	compound treatment	0.787	0.00294	0.04	0.736	0.00793	0.11	0.1045	0.9074	1391958	Cerep_002213	Fc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O16	compound treatment	0.811	0.0269	0.36	0.756	0.0279	0.38	0.5263	0.9997	1967507	Cerep_002214	Clc1ccc(s1)S(=O)(=O)NCc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O17	compound treatment	0.774	-0.0101	-0.14	0.729	9.31E-4	0.01	-0.087	-0.6382	1967508	Cerep_002215	FC(F)(F)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O18	compound treatment	0.781	-0.00306	-0.04	0.728	-6.9E-5	0.0	-0.0299	-0.723	1967509	Cerep_002216	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O19	compound treatment	0.776	-0.00806	-0.11	0.755	0.0269	0.37	0.1828	0.4773	1967510	Cerep_002217	CN(C)CCN(Cc1ccccc1)S(=O)(=O)c2c(C)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O20	compound treatment	0.767	-0.0171	-0.23	0.725	-0.00307	-0.04	-0.1923	-0.8222	1967511	Cerep_002218	Clc1cccc(Oc2ccc(cc2)S(=O)(=O)N3CCN(CC3)C(=O)C4COc5ccccc5O4)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O21	compound treatment	0.793	0.00894	0.12	0.749	0.0209	0.29	0.2871	0.9266	1967512	Cerep_002219	Brc1ccc(s1)S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	O22	compound treatment	0.804	0.0199	0.27	0.744	0.0159	0.22	0.3438	0.9944	1424861	Cerep_002220	CN(CC(O)c1ccccc1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P03	compound treatment	0.797	0.0129	0.17	0.763	0.0349	0.48	0.4603	0.9072	1967513	Cerep_002221	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CC2)c3ncnc4sccc34)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P04	compound treatment	0.766	-0.0181	-0.24	0.71	-0.0181	-0.25	-0.3465	-1.0	1967514	Cerep_002222	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P05	compound treatment	0.772	-0.0121	-0.16	0.714	-0.0141	-0.19	-0.2507	-0.9966	1967515	Cerep_002223	CC1(C)C(CCC1(C)C(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P06	compound treatment	0.75	-0.0341	-0.46	0.72	-0.00807	-0.11	-0.4027	-0.8523	1967516	Cerep_002224	NS(=O)(=O)c1ccc(CNC(=O)OCCc2ccccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P07	compound treatment	0.782	-0.00206	-0.03	0.735	0.00693	0.09	0.0472	0.479	1967517	Cerep_002225	OC(=O)Cc1ccccc1C(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P08	compound treatment	0.761	-0.0231	-0.31	0.728	-6.9E-5	0.0	-0.2206	-0.7092	1967518	Cerep_002226	COc1ccc(CCCOC(=O)NNC(=O)c2sc(nc2C)c3ccc(cc3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P09	compound treatment	0.646	-0.138	-1.86	0.687	-0.0411	-0.56	-1.713	-0.8808	1967519	Cerep_002227	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)C(=O)c4ccccc4CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P10	compound treatment	0.037	-0.747	-10.08	0.077	-0.651	-8.88	-13.4043	-0.998	1967520	Cerep_002228	O=C(NCc1cccnc1)OCc2ccc(C#Cc3ccccc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P11	compound treatment	0.757	-0.0271	-0.37	0.733	0.00493	0.07	-0.2106	-0.5673	1967521	Cerep_002229	CCCN(Cc1ccc(cc1)[N+](=O)[O-])C(=O)/C=C\C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P12	compound treatment	0.746	-0.0381	-0.51	0.729	9.31E-4	0.01	-0.3541	-0.6894	1967522	Cerep_002230	CN(CCc1ccccn1)C(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P13	compound treatment	0.775	-0.00906	-0.12	0.751	0.0229	0.31	0.1347	0.4012	1967523	Cerep_002231	OC(=O)/C=C\C(=O)N1CCCN(CC1)c2nc3ccc(Cl)cc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P14	compound treatment	0.766	-0.0181	-0.24	0.705	-0.0231	-0.31	-0.3947	-0.992	1967524	Cerep_002232	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P15	compound treatment	0.785	9.4E-4	0.01	0.713	-0.0151	-0.21	-0.1363	-0.6622	1967525	Cerep_002233	CCOc1ccc(cc1)N2CCN(CC2)C(=O)CCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P16	compound treatment	0.764	-0.0201	-0.27	0.72	-0.00807	-0.11	-0.2692	-0.9214	1967526	Cerep_002234	Clc1ccc(cc1)c2csc(COC(=O)N3CCc4c(C3)[nH]c5ccccc45)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P17	compound treatment	0.77	-0.0141	-0.19	0.717	-0.0111	-0.15	-0.2409	-0.9936	1967527	Cerep_002235	OC(=O)C1CC=CCC1C(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P18	compound treatment	0.768	-0.0161	-0.22	0.7	-0.0281	-0.38	-0.4238	-0.9637	1967528	Cerep_002236	CC1CC1COC(=O)NNC(=O)CNS(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P19	compound treatment	0.788	0.00394	0.05	0.719	-0.00907	-0.12	-0.0499	-0.3704	1967529	Cerep_002237	OC(=O)CC1(CC(=O)N2CCC(=CC2)c3ccc(F)cc3)CCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P20	compound treatment	0.759	-0.0251	-0.34	0.713	-0.0151	-0.21	-0.3844	-0.9715	1967530	Cerep_002238	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)OCCN3CCCCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P21	compound treatment	0.771	-0.0131	-0.18	0.736	0.00793	0.11	-0.0481	-0.2327	1967531	Cerep_002239	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)CC3(CC(=O)O)CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.532	P22	compound treatment	0.733	-0.0511	-0.69	0.711	-0.0171	-0.23	-0.6517	-0.8963	1967532	Cerep_002240	COc1ccc(F)c(CN2CCCC(COC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A03	compound treatment	0.8	0.0163	0.22	0.737	0.00576	0.08	0.2108	0.904	1967533	Cerep_002241	Cc1cccc(CCCOCCOC(=O)NNC(=O)c2ccc(cc2)c3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A04	compound treatment	0.829	0.0453	0.61	0.756	0.0248	0.34	0.6707	0.9609	1967534	Cerep_002242	COc1ccc2[nH]cc(CCNC(=O)OCCCc3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A05	compound treatment	0.785	0.00128	0.02	0.747	0.0158	0.21	0.1642	0.7613	1967535	Cerep_002243	COc1ccc(CCNC(=O)OCCc2ccc(C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A06	compound treatment	0.811	0.0273	0.37	0.717	-0.0142	-0.19	0.1229	0.2954	1967536	Cerep_002244	O=C(NCCc1ccncc1)OCc2ccccc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A07	compound treatment	0.803	0.0193	0.26	0.743	0.0118	0.16	0.2973	0.973	1967537	Cerep_002245	Cc1cc([nH]n1)C(=O)NNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A08	compound treatment	0.794	0.0103	0.14	0.728	-0.00324	-0.04	0.0668	0.4591	1967538	Cerep_002246	CCOc1ccc(cc1)C(=O)NNC(=O)OCCN2CCN(Cc3cc4OCOc4c(OC)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A09	compound treatment	0.781	-0.00272	-0.04	0.716	-0.0152	-0.21	-0.1729	-0.8194	1967539	Cerep_002247	O=C(OCC1CCOC1)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A10	compound treatment	0.8	0.0163	0.22	0.736	0.00476	0.06	0.2012	0.8786	1967540	Cerep_002248	CCN(CCOC(=O)NC1CCN(Cc2ccccc2)C1)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A11	compound treatment	0.8	0.0163	0.22	0.731	-2.39E-4	0.0	0.153	0.6965	1967541	Cerep_002249	CCCCCC#CCOC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A12	compound treatment	1.544	0.76	10.26	0.744	0.0128	0.17	7.3756	0.719	1967542	Cerep_002250	Clc1ccc(COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A13	compound treatment	0.764	-0.0197	-0.27	0.738	0.00676	0.09	-0.123	-0.4366	1967543	Cerep_002251	Oc1ccc2[nH]cc(CCNC(=O)OCC3CCCN(Cc4ccc5ccccc5c4)C3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A14	compound treatment	0.779	-0.00472	-0.06	0.715	-0.0162	-0.22	-0.2016	-0.8751	1967544	Cerep_002252	COc1cccc(CCNC(=O)OCCc2ccccc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A15	compound treatment	0.775	-0.00872	-0.12	0.702	-0.0292	-0.4	-0.3651	-0.8784	1967545	Cerep_002253	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCC4CCCCN4Cc5cc6OCOc6cc5Cl)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A16	compound treatment	0.816	0.0323	0.44	0.732	7.61E-4	0.01	0.3152	0.7238	1967546	Cerep_002254	Cc1ccc(CCOC(=O)N2CCN(CC2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A17	compound treatment	0.783	-7.23E-4	-0.01	0.721	-0.0102	-0.14	-0.1056	-0.7547	1967547	Cerep_002255	CC1(C)OC2COC3(COC(=O)NNC(=O)c4ccccc4n5cccc5)OC(C)(C)OC3C2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A18	compound treatment	0.777	-0.00672	-0.09	0.717	-0.0142	-0.19	-0.2014	-0.9399	1967548	Cerep_002256	Fc1ccccc1CN2CCCCC2COC(=O)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A19	compound treatment	0.807	0.0233	0.31	0.719	-0.0122	-0.17	0.104	0.2925	1967549	Cerep_002257	CC(NC(=O)OCc1cccc(OCc2ccccc2)c1)c3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A20	compound treatment	0.802	0.0183	0.25	0.727	-0.00424	-0.06	0.1335	0.527	1967550	Cerep_002258	CCCC#CCCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A21	compound treatment	0.781	-0.00272	-0.04	0.733	0.00176	0.02	-0.009	-0.205	1967551	Cerep_002259	Cc1cc([nH]n1)C(=O)NNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	A22	compound treatment	0.798	0.0143	0.19	0.731	-2.39E-4	0.0	0.1339	0.695	1967552	Cerep_002260	CC(C)(C)c1cc([nH]n1)C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B03	compound treatment	0.803	0.0193	0.26	0.749	0.0178	0.24	0.3551	0.9994	1967553	Cerep_002261	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCc3ccc(OCc4ccccc4)c(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B04	compound treatment	0.765	-0.0187	-0.25	0.715	-0.0162	-0.22	-0.3352	-0.9978	1967554	Cerep_002262	O=C(N/N=C/c1cccc2OCOc21)/C=C/c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B05	compound treatment	0.801	0.0173	0.23	0.762	0.0308	0.42	0.4614	0.9615	1967555	Cerep_002263	CC(C)(C)c1ccc(COC(=O)NC2CCCC2OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B06	compound treatment	0.776	-0.00772	-0.1	0.714	-0.0172	-0.24	-0.2399	-0.933	1967556	Cerep_002264	Fc1cccc(c1)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B07	compound treatment	0.778	-0.00572	-0.08	0.715	-0.0162	-0.22	-0.2112	-0.9005	1967557	Cerep_002265	COc1ccc(cc1)C(=O)NNC(=O)OCC2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B08	compound treatment	0.757	-0.0267	-0.36	0.717	-0.0142	-0.19	-0.3922	-0.9579	1967558	Cerep_002266	[O-][N+](=O)c1cc(/C=N/NC(=O)c2ccccc2Oc3ccccc3)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B09	compound treatment	0.789	0.00528	0.07	0.732	7.61E-4	0.01	0.0577	0.8017	1967559	Cerep_002267	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCc3c(C)noc3c4cc(C)on4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B10	compound treatment	0.807	0.0233	0.31	0.72	-0.0112	-0.15	0.1137	0.3253	1967560	Cerep_002268	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B11	compound treatment	0.762	-0.0217	-0.29	0.74	0.00876	0.12	-0.1227	-0.3879	1967561	Cerep_002269	CN(C)c1ccc(CN2CCC(C2)NC(=O)OCc3ccc(/C=C/c4ccccc4)cc3)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B12	compound treatment	0.756	-0.0277	-0.37	0.699	-0.0322	-0.44	-0.5753	-0.9968	1967562	Cerep_002270	COc1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B13	compound treatment	0.76	-0.0237	-0.32	0.714	-0.0172	-0.24	-0.3925	-0.9885	1967563	Cerep_002271	COc1cc(ccc1CN2CCCC(COC(=O)NC(C)c3cccc4OCCOc34)C2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B14	compound treatment	0.768	-0.0157	-0.21	0.699	-0.0322	-0.44	-0.4609	-0.9441	1967564	Cerep_002272	COc1cccc(c1)C(=O)N/N=C/c2cn(C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B15	compound treatment	0.759	-0.0247	-0.33	0.745	0.0138	0.19	-0.1032	-0.2695	1967565	Cerep_002273	Cc1csc2c(SCC(=O)NNC(=O)OCCc3ccccc3Br)ncnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B16	compound treatment	0.787	0.00328	0.04	0.712	-0.0192	-0.26	-0.1543	-0.5798	1967566	Cerep_002274	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B17	compound treatment	0.792	0.00828	0.11	0.743	0.0118	0.16	0.1924	0.9843	1967567	Cerep_002275	Cn1c(=O)n(C)c2ncn(CCOC(=O)NC3CCN(Cc4c(F)cccc4Cl)C3)c2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B18	compound treatment	0.747	-0.0367	-0.5	0.677	-0.0542	-0.74	-0.8733	-0.981	1967568	Cerep_002276	O=C(Cc1c[nH]c2ccccc12)N/N=C/c3ccnc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B19	compound treatment	0.794	0.0103	0.14	0.747	0.0158	0.21	0.25	0.9775	1967569	Cerep_002277	COc1ccc(CN2CCCC(COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)C2)cc1OCc6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B20	compound treatment	0.784	2.77E-4	0.0	0.717	-0.0142	-0.19	-0.1347	-0.6934	1967570	Cerep_002278	O=C(Cn1cncn1)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B21	compound treatment	0.76	-0.0237	-0.32	0.73	-0.00124	-0.02	-0.2383	-0.7434	1967571	Cerep_002279	O=C(NNC(=O)/C=C/c1ccco1)OCC2CCC(=O)N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	B22	compound treatment	0.742	-0.0417	-0.56	0.687	-0.0442	-0.6	-0.8246	-0.9994	1967572	Cerep_002280	Fc1cc(ccc1/C=N/NC(=O)c2ccc[nH]2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C03	compound treatment	0.769	-0.0147	-0.2	0.752	0.0208	0.28	0.0597	0.1727	1967573	Cerep_002281	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cc5OCOc5cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C04	compound treatment	0.827	0.0433	0.58	0.797	0.0658	0.9	1.0469	0.9784	1967574	Cerep_002282	Fc1ccc(cc1)C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C05	compound treatment	0.793	0.00928	0.13	0.739	0.00776	0.11	0.1633	0.9965	1967575	Cerep_002283	CC(CCOC(=O)NC(CSCc1ccccc1)C(=O)Nc2ccc3ccccc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C06	compound treatment	0.781	-0.00272	-0.04	0.744	0.0128	0.17	0.0971	0.5458	1967576	Cerep_002284	CCN(CCOC(=O)NCCc1ccncc1)c2ccc(N=Nc3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C07	compound treatment	0.77	-0.0137	-0.19	0.734	0.00276	0.04	-0.1043	-0.552	1967577	Cerep_002285	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C08	compound treatment	0.798	0.0143	0.19	0.753	0.0218	0.3	0.346	0.9781	1967578	Cerep_002286	Fc1ccc(cc1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C09	compound treatment	0.774	-0.00972	-0.13	0.719	-0.0122	-0.17	-0.2108	-0.9929	1967579	Cerep_002287	CCOc1ccsc1C(=O)NNC(=O)OCC(Cc2ccccc2)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C10	compound treatment	0.783	-7.23E-4	-0.01	0.73	-0.00124	-0.02	-0.0188	-0.966	1967580	Cerep_002288	CC1(COC(=O)N2CCC(O)(Cc3ccccc3)CC2)COC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C11	compound treatment	0.77	-0.0137	-0.19	0.745	0.0138	0.19	0.0018	0.0067	1967581	Cerep_002289	Cc1ccc(N2CCN(CC2)C(=O)OCC#Cc3ccccc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C12	compound treatment	0.816	0.0323	0.44	0.725	-0.00624	-0.09	0.2477	0.5584	1967582	Cerep_002290	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3ccc([N+](=O)[O-])c(C)c3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C13	compound treatment	0.76	-0.0237	-0.32	0.717	-0.0142	-0.19	-0.3636	-0.9713	1967583	Cerep_002291	COc1cc(ccc1O)C(=O)NNC(=O)OCC2CCCN(Cc3cc(OC)c(OC)cc3Br)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C14	compound treatment	0.782	-0.00172	-0.02	0.729	-0.00224	-0.03	-0.038	-0.991	1967584	Cerep_002292	Clc1ccccc1CCOC(=O)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C15	compound treatment	0.764	-0.0197	-0.27	0.714	-0.0172	-0.24	-0.3544	-0.9981	1967585	Cerep_002293	O=C(NCc1csc2ccccc12)OCC3CCCCN3Cc4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C16	compound treatment	0.787	0.00328	0.04	0.766	0.0348	0.47	0.3664	0.7697	1967586	Cerep_002294	Clc1ccc2nc(sc2c1)N3CCCN(CC3)C(=O)OCCc4ccccc4Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C17	compound treatment	0.772	-0.0117	-0.16	0.732	7.61E-4	0.01	-0.1045	-0.6593	1967587	Cerep_002295	O=C(NNC(=O)c1ccc(cc1)c2ccccc2)OCC3CCOC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C18	compound treatment	0.792	0.00828	0.11	0.747	0.0158	0.21	0.2309	0.9535	1967588	Cerep_002296	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCCc3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C19	compound treatment	0.806	0.0223	0.3	0.719	-0.0122	-0.17	0.0945	0.2749	1967589	Cerep_002297	Cc1cccc(CN2CCN(CC2)C(=O)OCc3ccc(cc3)c4ccccc4)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C20	compound treatment	0.806	0.0223	0.3	0.751	0.0198	0.27	0.403	0.9985	1967590	Cerep_002298	Cc1cccc(C(=O)NNC(=O)OCC#Cc2ccccc2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C21	compound treatment	0.787	0.00328	0.04	0.736	0.00476	0.06	0.0772	0.9825	1967591	Cerep_002299	CC(C)(C)OC(=O)C(Cc1ccc(OC(C)(C)C)cc1)NC(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	C22	compound treatment	0.793	0.00928	0.13	0.739	0.00776	0.11	0.1633	0.9965	1967592	Cerep_002300	Fc1cccc(Cl)c1CCOC(=O)NNC(=O)c2ccccc2NC(=O)c3c(F)cccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D03	compound treatment	0.803	0.0193	0.26	0.736	0.00476	0.06	0.2298	0.8573	1967593	Cerep_002301	Cc1csc2c(SCC(=O)NNC(=O)OCc3cccc(OCc4ccccc4)c3)ncnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D04	compound treatment	0.789	0.00528	0.07	0.732	7.61E-4	0.01	0.0577	0.8017	1967594	Cerep_002302	O=C(N/N=C/c1cc2ccccc2o1)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D05	compound treatment	0.782	-0.00172	-0.02	0.738	0.00676	0.09	0.0488	0.5128	1967595	Cerep_002303	COc1ccc(CNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D06	compound treatment	0.745	-0.0387	-0.52	0.716	-0.0152	-0.21	-0.5163	-0.9184	1967596	Cerep_002304	[O-][N+](=O)c1cc(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D07	compound treatment	0.785	0.00128	0.02	0.733	0.00176	0.02	0.0292	0.9867	1967597	Cerep_002305	COc1ccc(cc1)C(=O)NNC(=O)OCCc2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D08	compound treatment	0.774	-0.00972	-0.13	0.71	-0.0212	-0.29	-0.2975	-0.9359	1967598	Cerep_002306	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D09	compound treatment	0.768	-0.0157	-0.21	0.706	-0.0252	-0.34	-0.3934	-0.973	1967599	Cerep_002307	COc1ccc(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D10	compound treatment	0.771	-0.0127	-0.17	0.713	-0.0182	-0.25	-0.2972	-0.9836	1967600	Cerep_002308	COc1ccc(/C=N/NC(=O)c2ccccc2OC(F)(F)F)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D11	compound treatment	0.785	0.00128	0.02	0.685	-0.0462	-0.63	-0.4337	-0.6875	1967601	Cerep_002309	CCCOCCOC(=O)NNC(=O)CNS(=O)(=O)c1cccc2nsnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D12	compound treatment	0.774	-0.00972	-0.13	0.702	-0.0292	-0.4	-0.3747	-0.8927	1967602	Cerep_002310	Cc1nc(cs1)C(=O)N/N=C/c2cn(C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D13	compound treatment	0.784	2.77E-4	0.0	0.728	-0.00324	-0.04	-0.0286	-0.645	1967603	Cerep_002311	COc1cc(Br)c(CN2CCCC(COC(=O)NCC(C)(C)CN(C)C)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D14	compound treatment	0.769	-0.0147	-0.2	0.696	-0.0352	-0.48	-0.4802	-0.9236	1967604	Cerep_002312	O=C(N/N=C/c1c[nH]c2cnc(OCc3ccccc3)cc12)c4csc(CS(=O)(=O)Cc5ccco5)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D15	compound treatment	0.796	0.0123	0.17	0.739	0.00776	0.11	0.1919	0.9766	1967605	Cerep_002313	CC(COC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D16	compound treatment	0.785	0.00128	0.02	0.712	-0.0192	-0.26	-0.1733	-0.6593	1967606	Cerep_002314	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D17	compound treatment	0.798	0.0143	0.19	0.73	-0.00124	-0.02	0.1242	0.6426	1967607	Cerep_002315	COc1cccc(c1)N2CCN(CC2)C(=O)OCc3c(C)noc3c4cc(C)on4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D18	compound treatment	0.783	-7.23E-4	-0.01	0.707	-0.0242	-0.33	-0.2406	-0.7277	1967608	Cerep_002316	[O-][N+](=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D19	compound treatment	0.776	-0.00772	-0.1	0.723	-0.00824	-0.11	-0.1531	-0.9993	1967609	Cerep_002317	COc1cc(COC(=O)N2CCN(CC2)c3cc(nc4cc(nn34)C(C)(C)C)C(F)(F)F)ccc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D20	compound treatment	0.761	-0.0227	-0.31	0.735	0.00376	0.05	-0.1805	-0.5807	1967610	Cerep_002318	[O-][N+](=O)c1ccccc1C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D21	compound treatment	0.782	-0.00172	-0.02	0.724	-0.00724	-0.1	-0.0862	-0.8504	1967611	Cerep_002319	O=C(NNC(=O)/C=C/c1ccco1)OCCN2CNC(=S)NC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	D22	compound treatment	0.779	-0.00472	-0.06	0.717	-0.0142	-0.19	-0.1824	-0.8923	1967612	Cerep_002320	COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E03	compound treatment	0.79	0.00628	0.08	0.738	0.00676	0.09	0.1251	0.9991	1967613	Cerep_002321	COc1ccccc1CCOC(=O)NNC(=O)c2cc(C)n[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E04	compound treatment	0.772	-0.0117	-0.16	0.737	0.00576	0.08	-0.0563	-0.3187	1967614	Cerep_002322	CSc1nnc(SC)n1CCNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E05	compound treatment	0.794	0.0103	0.14	0.729	-0.00224	-0.03	0.0764	0.5385	1967615	Cerep_002323	Clc1ccc(CNC(=O)OCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E06	compound treatment	0.821	0.0373	0.5	0.717	-0.0142	-0.19	0.2183	0.405	1967616	Cerep_002324	CC1(COC(=O)NNC(=O)/C=C/c2ccco2)COC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E07	compound treatment	0.789	0.00528	0.07	0.737	0.00576	0.08	0.1059	0.9988	1967617	Cerep_002325	O=C(NNC(=O)/C=C/c1ccco1)OCC2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E08	compound treatment	0.815	0.0313	0.42	0.738	0.00676	0.09	0.3636	0.8418	1967618	Cerep_002326	COc1cccc(CN2CCC(COC(=O)NCc3ccc(cc3)c4csnn4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E09	compound treatment	0.782	-0.00172	-0.02	0.743	0.0118	0.16	0.097	0.5984	1967619	Cerep_002327	Cc1nc(sc1C(=O)NNC(=O)OCCSc2ccc(cn2)C(F)(F)F)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E10	compound treatment	0.768	-0.0157	-0.21	0.761	0.0298	0.41	0.137	0.2991	1967620	Cerep_002328	Clc1ccc(cc1)C(N2CCN(CCOCCOC(=O)NNC(=O)CC3Sc4ccccc4NC3=O)CC2)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E11	compound treatment	0.748	-0.0357	-0.48	0.686	-0.0452	-0.62	-0.777	-0.9925	1967621	Cerep_002329	O=C(NCc1ccc2OCCc2c1)OCC3CCCCN3Cc4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E12	compound treatment	0.791	0.00728	0.1	0.757	0.0258	0.35	0.3178	0.8713	1967622	Cerep_002330	COc1cc(COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E13	compound treatment	0.819	0.0353	0.48	0.739	0.00776	0.11	0.4114	0.8437	1967623	Cerep_002331	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(cc5F)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E14	compound treatment	0.777	-0.00672	-0.09	0.726	-0.00524	-0.07	-0.1147	-0.993	1967624	Cerep_002332	COC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E15	compound treatment	0.773	-0.0107	-0.14	0.748	0.0168	0.23	0.0593	0.2193	1967625	Cerep_002333	CC(C)(C)c1ccc(O)c(NC(=O)OCCn2cccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E16	compound treatment	0.778	-0.00572	-0.08	0.722	-0.00924	-0.13	-0.1437	-0.9724	1967626	Cerep_002334	Clc1ccccc1N2CCN(CC2)C(=O)OCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E17	compound treatment	0.783	-7.23E-4	-0.01	0.715	-0.0162	-0.22	-0.1635	-0.7375	1967627	Cerep_002335	OC1(CCN(CC1)C(=O)OCCSc2ccc(cn2)C(F)(F)F)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E18	compound treatment	0.782	-0.00172	-0.02	0.722	-0.00924	-0.13	-0.1055	-0.8237	1967628	Cerep_002336	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(OC)c(F)c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E19	compound treatment	0.786	0.00228	0.03	0.753	0.0218	0.3	0.2315	0.7761	1967629	Cerep_002337	Fc1cccc(Cl)c1COC(=O)NNC(=O)CSCc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E20	compound treatment	0.795	0.0113	0.15	0.74	0.00876	0.12	0.192	0.9928	1967630	Cerep_002338	CCCCCCC#CCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E21	compound treatment	0.824	0.0403	0.54	0.743	0.0118	0.16	0.4976	0.8784	1967631	Cerep_002339	COc1cccc(OC)c1CNC(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	E22	compound treatment	0.796	0.0123	0.17	0.762	0.0308	0.42	0.4137	0.9174	1967632	Cerep_002340	CCN(CCOC(=O)NNC(=O)CNS(=O)(=O)c1cccc2nsnc12)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F03	compound treatment	0.797	0.0133	0.18	0.75	0.0188	0.26	0.3076	0.9848	1967633	Cerep_002341	CCOc1ccccc1CNC(=O)OCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F04	compound treatment	0.767	-0.0167	-0.23	0.719	-0.0122	-0.17	-0.2775	-0.989	1967634	Cerep_002342	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F05	compound treatment	0.783	-7.23E-4	-0.01	0.733	0.00176	0.02	0.0101	0.3889	1967635	Cerep_002343	CSc1ncc(C(=O)NNC(=O)OCCc2c(C)cc(C)cc2C)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F06	compound treatment	0.755	-0.0287	-0.39	0.714	-0.0172	-0.24	-0.4402	-0.9713	1967636	Cerep_002344	[O-][N+](=O)c1cc(/C=N/NC(=O)c2cc3ccccc3s2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F07	compound treatment	0.785	0.00128	0.02	0.729	-0.00224	-0.03	-0.0094	-0.2684	1967637	Cerep_002345	Cc1ccccc1N2CCN(CC2)C(=O)OCC3CC4CC3C=C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F08	compound treatment	0.783	-7.23E-4	-0.01	0.714	-0.0172	-0.24	-0.1731	-0.7358	1967638	Cerep_002346	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F09	compound treatment	0.773	-0.0107	-0.14	0.725	-0.00624	-0.09	-0.1625	-0.968	1967639	Cerep_002347	CN(C)c1ccc(CN2CCCCC2COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F10	compound treatment	0.788	0.00428	0.06	0.709	-0.0222	-0.3	-0.1736	-0.5625	1967640	Cerep_002348	COc1ccc(/C=N/NC(=O)Cc2ccsc2)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F11	compound treatment	0.795	0.0113	0.15	0.728	-0.00324	-0.04	0.0763	0.4819	1967641	Cerep_002349	CCCCCCCCCCOCCOCCOC(=O)NNC(=O)CNS(=O)(=O)c1cccc2nsnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F12	compound treatment	0.779	-0.00472	-0.06	0.711	-0.0202	-0.28	-0.2402	-0.8481	1967642	Cerep_002350	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2cn(C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F13	compound treatment	0.794	0.0103	0.14	0.72	-0.0112	-0.15	-0.0103	-0.05	1967643	Cerep_002351	COc1ccc(CN2CCCC(COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)C2)cc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F14	compound treatment	0.773	-0.0107	-0.14	0.715	-0.0162	-0.22	-0.2589	-0.9787	1967644	Cerep_002352	Oc1cc2ccccc2cc1C(=O)N/N=C/c3c[nH]c4cnc(OCc5ccccc5)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F15	compound treatment	0.81	0.0263	0.35	0.734	0.00276	0.04	0.2773	0.7778	1967645	Cerep_002353	COc1cscc1C(=O)NNC(=O)OCc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F16	compound treatment	0.786	0.00228	0.03	0.725	-0.00624	-0.09	-0.0384	-0.425	1967646	Cerep_002354	Fc1cccc(F)c1C(=O)N/N=C/c2cccc3OCOc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F17	compound treatment	0.765	-0.0187	-0.25	0.731	-2.39E-4	0.0	-0.1809	-0.7162	1967647	Cerep_002355	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccc(OC)c(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F18	compound treatment	0.795	0.0113	0.15	0.723	-0.00824	-0.11	0.0281	0.1487	1967648	Cerep_002356	O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F19	compound treatment	0.793	0.00928	0.13	0.739	0.00776	0.11	0.1633	0.9965	1967649	Cerep_002357	O=C(OCc1cccc(OCc2ccccc2)c1)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F20	compound treatment	0.757	-0.0267	-0.36	0.699	-0.0322	-0.44	-0.5658	-0.9951	1967650	Cerep_002358	COc1ccccc1C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F21	compound treatment	0.775	-0.00872	-0.12	0.757	0.0258	0.35	0.1652	0.4459	1967651	Cerep_002359	O=C(CNS(=O)(=O)c1cccc2nsnc12)NNC(=O)OCCSc3ncc4ccccn34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	F22	compound treatment	0.781	-0.00272	-0.04	0.728	-0.00324	-0.04	-0.0572	-0.9958	1967652	Cerep_002360	COc1cc(/C=N/NC(=O)c2cccc(Cl)c2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G03	compound treatment	0.786	0.00228	0.03	0.729	-0.00224	-0.03	1.0E-4	0.003	1967653	Cerep_002361	Clc1cccc(CCOC(=O)NNC(=O)c2csc(n2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G04	compound treatment	0.807	0.0233	0.31	0.75	0.0188	0.26	0.4029	0.9948	1967654	Cerep_002362	CC(NC(=O)OCCc1ccccc1Br)c2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G05	compound treatment	0.792	0.00828	0.11	0.738	0.00676	0.09	0.1441	0.9955	1967655	Cerep_002363	COc1ccc(CCCOC(=O)NCc2ccc(OC)cc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G06	compound treatment	0.793	0.00928	0.13	0.711	-0.0202	-0.28	-0.1067	-0.352	1967656	Cerep_002364	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCOCCN3CCN(CC3)C(c4ccccc4)c5ccc(Cl)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G07	compound treatment	0.777	-0.00672	-0.09	0.768	0.0368	0.5	0.2903	0.5699	1967657	Cerep_002365	O=C(NNC(=O)c1ccccc1n2cccc2)OCC3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G08	compound treatment	0.775	-0.00872	-0.12	0.727	-0.00424	-0.06	-0.1241	-0.9464	1967658	Cerep_002366	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc5ccccc5c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G09	compound treatment	0.784	2.77E-4	0.0	0.728	-0.00324	-0.04	-0.0286	-0.645	1967659	Cerep_002367	CN(C)c1ccc(CN2CCC(C2)NC(=O)OCc3ccc(C#Cc4ccccc4)s3)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G10	compound treatment	0.771	-0.0127	-0.17	0.733	0.00176	0.02	-0.1044	-0.6023	1967660	Cerep_002368	CC1(C)COC(CCOC(=O)NNC(=O)CC2Sc3ccccc3NC2=O)OC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G11	compound treatment	0.723	-0.0607	-0.82	0.694	-0.0372	-0.51	-0.9383	-0.9736	1967661	Cerep_002369	Cc1nn(c(C)c1CN2CCCCC2COC(=O)NCc3ccc4OCCc4c3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G12	compound treatment	0.783	-7.23E-4	-0.01	0.756	0.0248	0.34	0.2319	0.6864	1967662	Cerep_002370	COc1ccc2ccccc2c1CN3CCCC(COC(=O)N4CCN(Cc5ccccc5OCc6ccccc6)CC4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G13	compound treatment	0.775	-0.00872	-0.12	0.724	-0.00724	-0.1	-0.153	-0.9962	1967663	Cerep_002371	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(c(F)c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G14	compound treatment	0.81	0.0263	0.35	0.731	-2.39E-4	0.0	0.2484	0.7006	1967664	Cerep_002372	Clc1cccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G15	compound treatment	0.786	0.00228	0.03	0.761	0.0298	0.41	0.3087	0.7585	1967665	Cerep_002373	Cc1nc(sc1C(=O)NNC(=O)OCC2=CCC3CC2C3(C)C)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G16	compound treatment	0.791	0.00728	0.1	0.737	0.00576	0.08	0.125	0.9939	1967666	Cerep_002374	FC(F)(F)Oc1ccccc1COC(=O)NCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G17	compound treatment	0.791	0.00728	0.1	0.761	0.0298	0.41	0.3564	0.8535	1967667	Cerep_002375	O=C(Cc1csc(n1)c2ccccc2)NNC(=O)OCc3ccc(C#Cc4ccccc4)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G18	compound treatment	0.827	0.0433	0.58	0.72	-0.0112	-0.15	0.3045	0.5044	1967668	Cerep_002376	COc1ccc(CCCOC(=O)NCCc2c[nH]c3ccc(OC)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G19	compound treatment	0.809	0.0253	0.34	0.745	0.0138	0.19	0.3738	0.9604	1967669	Cerep_002377	Oc1ccc2[nH]cc(CCNC(=O)OCc3ccccc3CCc4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G20	compound treatment	0.795	0.0113	0.15	0.731	-2.39E-4	0.0	0.1053	0.6918	1967670	Cerep_002378	Cc1ccccc1CCOC(=O)NNC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G21	compound treatment	0.797	0.0133	0.18	0.761	0.0298	0.41	0.4136	0.9324	1967671	Cerep_002379	COc1ccc(CCCOC(=O)NCC(C)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	G22	compound treatment	0.805	0.0213	0.29	0.729	-0.00224	-0.03	0.1814	0.6283	1967672	Cerep_002380	CCCCCC#CCCOC(=O)NNC(=O)Cc1ccc(OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H03	compound treatment	0.795	0.0113	0.15	0.733	0.00176	0.02	0.1246	0.8087	1967673	Cerep_002381	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H04	compound treatment	0.77	-0.0137	-0.19	0.72	-0.0112	-0.15	-0.2393	-0.9956	1967674	Cerep_002382	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3cc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H05	compound treatment	0.786	0.00228	0.03	0.738	0.00676	0.09	0.0869	0.8944	1967675	Cerep_002383	COCCCCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H06	compound treatment	0.743	-0.0407	-0.55	0.729	-0.00224	-0.03	-0.4101	-0.7453	1967676	Cerep_002384	Cc1ccc(s1)C(=O)N/N=C/c2csc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H07	compound treatment	0.802	0.0183	0.25	0.737	0.00576	0.08	0.2299	0.8884	1967677	Cerep_002385	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCC3CC3(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H08	compound treatment	0.771	-0.0127	-0.17	0.684	-0.0472	-0.64	-0.5769	-0.8653	1967678	Cerep_002386	C/C(=C\c1ccccc1)/C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H09	compound treatment	0.781	-0.00272	-0.04	0.727	-0.00424	-0.06	-0.0669	-0.9761	1967679	Cerep_002387	COc1cc(CN2CCN(CCOC(=O)NCc3ccc(F)cc3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H10	compound treatment	0.78	-0.00372	-0.05	0.734	0.00276	0.04	-0.0089	-0.1417	1967680	Cerep_002388	COc1ccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H11	compound treatment	0.784	2.77E-4	0.0	0.739	0.00776	0.11	0.0775	0.7316	1967681	Cerep_002389	CN(C)c1ccc(CN2CCCCC2COC(=O)N3CCN(CC3)C(=O)OCc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H12	compound treatment	0.765	-0.0187	-0.25	0.69	-0.0412	-0.56	-0.5763	-0.9348	1967682	Cerep_002390	Cn1cc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H13	compound treatment	0.784	2.77E-4	0.0	0.737	0.00576	0.08	0.0582	0.7399	1967683	Cerep_002391	Clc1ccccc1N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H14	compound treatment	0.769	-0.0147	-0.2	0.72	-0.0112	-0.15	-0.2488	-0.9918	1967684	Cerep_002392	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3c[nH]c4cnc(OCc5ccccc5)cc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H15	compound treatment	0.808	0.0243	0.33	0.71	-0.0212	-0.29	0.0268	0.0613	1967685	Cerep_002393	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCCN3CNC(=S)NC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H16	compound treatment	0.759	-0.0247	-0.33	0.829	0.0978	1.33	0.7068	0.5143	1967686	Cerep_002394	O=C(CC1Sc2ccccc2NC1=O)N/N=C/c3cccc4OCOc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H17	compound treatment	0.764	-0.0197	-0.27	0.757	0.0258	0.35	0.0603	0.1367	1967687	Cerep_002395	COc1cc(CN2CCN(CCOC(=O)NCc3ccc(cc3)c4csnn4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H18	compound treatment	0.742	-0.0417	-0.56	0.719	-0.0122	-0.17	-0.516	-0.8789	1967688	Cerep_002396	Clc1cccc(c1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H19	compound treatment	0.804	0.0203	0.27	0.749	0.0178	0.24	0.3647	0.9982	1967689	Cerep_002397	O=C(OCc1cccc(Oc2ccccc2)c1)N3CCN(CC3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H20	compound treatment	0.784	2.77E-4	0.0	0.709	-0.0222	-0.3	-0.2118	-0.6983	1967690	Cerep_002398	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H21	compound treatment	0.793	0.00928	0.13	0.716	-0.0152	-0.21	-0.0584	-0.2409	1967691	Cerep_002399	COc1cccc(CCOC(=O)N2CCC(C2)NC(=O)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	H22	compound treatment	0.785	0.00128	0.02	0.715	-0.0162	-0.22	-0.1444	-0.6501	1967692	Cerep_002400	COc1cc(/C=N/NC(=O)COc2ccc(F)cc2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I03	compound treatment	0.792	0.00828	0.11	0.744	0.0128	0.17	0.202	0.977	1967693	Cerep_002401	COc1cccc(CCOC(=O)Nc2ccc(NC(=O)C)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I04	compound treatment	0.75	-0.0337	-0.45	0.732	7.61E-4	0.01	-0.3144	-0.6908	1967694	Cerep_002402	CC(COC(=O)N1CCN(CC1)c2ncnc3sccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I05	compound treatment	0.788	0.00428	0.06	0.73	-0.00124	-0.02	0.0289	0.4799	1967695	Cerep_002403	Fc1ccc(/C=C/C(=O)NNC(=O)OCCCCc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I06	compound treatment	0.784	2.77E-4	0.0	0.729	-0.00224	-0.03	-0.0189	-0.6161	1967696	Cerep_002404	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCC3OCC(C)(C)CO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I07	compound treatment	0.767	-0.0167	-0.23	0.72	-0.0112	-0.15	-0.2679	-0.9823	1967697	Cerep_002405	O=C(NNC(=O)c1cccnc1)OCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I08	compound treatment	0.802	0.0183	0.25	0.781	0.0498	0.68	0.6542	0.9061	1967698	Cerep_002406	COc1cc(Br)c(CN2CCCC(COC(=O)NCc3csc4ccccc34)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I09	compound treatment	0.787	0.00328	0.04	0.734	0.00276	0.04	0.0579	0.9968	1967699	Cerep_002407	CC(C)(O)C#Cc1ccc(COC(=O)NNC(=O)c2ccc3nonc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I10	compound treatment	0.802	0.0183	0.25	0.753	0.0218	0.3	0.3842	0.9958	1967700	Cerep_002408	Cc1csc(C(=O)NNC(=O)OCCSCc2ccc3nonc3c2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I11	compound treatment	0.777	-0.00672	-0.09	0.718	-0.0132	-0.18	-0.1918	-0.9493	1967701	Cerep_002409	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(C)ccc4C)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I12	compound treatment	0.808	0.0243	0.33	0.756	0.0248	0.34	0.4703	0.9999	1967702	Cerep_002410	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3cccc(SC(F)(F)F)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I13	compound treatment	0.778	-0.00572	-0.08	0.724	-0.00724	-0.1	-0.1244	-0.9926	1967703	Cerep_002411	Cc1ncsc1CCOC(=O)NCCc2c[nH]c3ccc(O)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I14	compound treatment	0.813	0.0293	0.39	0.737	0.00576	0.08	0.3348	0.8315	1967704	Cerep_002412	COc1cccc(CCOC(=O)NCC(C)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I15	compound treatment	0.777	-0.00672	-0.09	0.71	-0.0212	-0.29	-0.2689	-0.8861	1967705	Cerep_002413	CCOc1ccsc1C(=O)NNC(=O)OCC2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I16	compound treatment	0.78	-0.00372	-0.05	0.728	-0.00324	-0.04	-0.0667	-0.9979	1967706	Cerep_002414	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCc3ccc(C#CC(C)(C)O)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I17	compound treatment	0.808	0.0243	0.33	0.778	0.0468	0.64	0.6825	0.9521	1967707	Cerep_002415	CC(C)(O)C#Cc1ccc(COC(=O)NCCc2ccccn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I18	compound treatment	0.795	0.0113	0.15	0.75	0.0188	0.26	0.2885	0.9692	1967708	Cerep_002416	Clc1ccc(Cl)c(c1)C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I19	compound treatment	0.798	0.0143	0.19	0.742	0.0108	0.15	0.24	0.991	1967709	Cerep_002417	Cc1cc(C)cc(COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I20	compound treatment	0.767	-0.0167	-0.23	0.74	0.00876	0.12	-0.0751	-0.294	1967710	Cerep_002418	COc1cc(CCNC(=O)OCCCc2ccncc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I21	compound treatment	0.825	0.0413	0.56	0.734	0.00276	0.04	0.4204	0.7532	1967711	Cerep_002419	COc1ccc2[nH]cc(CCNC(=O)OCCCCCc3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	I22	compound treatment	0.816	0.0323	0.44	0.736	0.00476	0.06	0.3538	0.8037	1967712	Cerep_002420	Fc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J03	compound treatment	0.788	0.00428	0.06	0.736	0.00476	0.06	0.0867	0.9983	1967713	Cerep_002421	ON1CCCC(COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J04	compound treatment	0.789	0.00528	0.07	0.741	0.00976	0.13	0.1445	0.957	1967714	Cerep_002422	C/C(=C\c1ccccc1)/C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J05	compound treatment	0.776	-0.00772	-0.1	0.764	0.0328	0.45	0.2422	0.528	1967715	Cerep_002423	COc1ccc2[nH]cc(CCNC(=O)OCC#Cc3ccccc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J06	compound treatment	0.749	-0.0347	-0.47	0.724	-0.00724	-0.1	-0.401	-0.8377	1967716	Cerep_002424	[O-][N+](=O)c1cc(/C=N/NC(=O)\C=C\c2ccco2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J07	compound treatment	0.768	-0.0157	-0.21	0.738	0.00676	0.09	-0.0848	-0.3666	1967717	Cerep_002425	CN1CCCC1CCOC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J08	compound treatment	0.788	0.00428	0.06	0.728	-0.00324	-0.04	0.0096	0.1316	1967718	Cerep_002426	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J09	compound treatment	0.776	-0.00772	-0.1	0.75	0.0188	0.26	0.1072	0.3882	1967719	Cerep_002427	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCC4CC4(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J10	compound treatment	0.761	-0.0227	-0.31	0.712	-0.0192	-0.26	-0.4023	-0.997	1967720	Cerep_002428	COc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J11	compound treatment	0.799	0.0153	0.21	0.74	0.00876	0.12	0.2302	0.9664	1967721	Cerep_002429	COc1cc(CN2CCN(CCOC(=O)NCc3cccc(c3)[N+](=O)[O-])CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J12	compound treatment	0.756	-0.0277	-0.37	0.703	-0.0282	-0.39	-0.5368	-0.9999	1967722	Cerep_002430	Cn1cc(/C=N/NC(=O)C(Cc2c[nH]cn2)NC(=O)OC(C)(C)C)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J13	compound treatment	0.765	-0.0187	-0.25	0.715	-0.0162	-0.22	-0.3352	-0.9978	1967723	Cerep_002431	O=C(OC/C=C/COCc1ccccc1)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J14	compound treatment	0.77	-0.0137	-0.19	0.718	-0.0132	-0.18	-0.2586	-0.9999	1967724	Cerep_002432	C/C(=C\c1ccccc1)/C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J15	compound treatment	0.781	-0.00272	-0.04	0.749	0.0178	0.24	0.1453	0.5931	1967725	Cerep_002433	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)OCCSc3ncc4ccccn34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J16	compound treatment	0.766	-0.0177	-0.24	0.713	-0.0182	-0.25	-0.3449	-0.9998	1967726	Cerep_002434	O=C(N/N=C/c1cccc2OCOc21)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J17	compound treatment	0.78	-0.00372	-0.05	0.724	-0.00724	-0.1	-0.1053	-0.9509	1967727	Cerep_002435	CCN(Cc1ccncc1)C(=O)C(COC(=O)N2CCN(CC2)c3cccc4[nH]ccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J18	compound treatment	0.769	-0.0147	-0.2	0.698	-0.0332	-0.45	-0.461	-0.9315	1967728	Cerep_002436	Fc1ccc(OCC(=O)N/N=C/c2ccc(Oc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J19	compound treatment	0.812	0.0283	0.38	0.749	0.0178	0.24	0.441	0.976	1967729	Cerep_002437	O=C(NNC(=O)/C=C/c1ccco1)OCCN2C(=O)c3ccccc3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J20	compound treatment	0.796	0.0123	0.17	0.681	-0.0502	-0.69	-0.3673	-0.5211	1967730	Cerep_002438	CCN(CC)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J21	compound treatment	0.798	0.0143	0.19	0.737	0.00576	0.08	0.1917	0.9218	1967731	Cerep_002439	Cc1cccc(CCOC(=O)N2CCCC(O)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	J22	compound treatment	0.754	-0.0297	-0.4	0.731	-2.39E-4	0.0	-0.2858	-0.7128	1967732	Cerep_002440	COc1cc(/C=N/NC(=O)C(C)Oc2ccc(Cl)cc2C)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K03	compound treatment	0.818	0.0343	0.46	0.734	0.00276	0.04	0.3536	0.7622	1967733	Cerep_002441	Cc1cc([nH]n1)C(=O)NNC(=O)OCCc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K04	compound treatment	0.789	0.00528	0.07	0.741	0.00976	0.13	0.1445	0.957	1967734	Cerep_002442	CSc1ncc(C(=O)NNC(=O)OCCc2ccc(Cl)cc2Cl)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K05	compound treatment	0.779	-0.00472	-0.06	0.723	-0.00824	-0.11	-0.1245	-0.9639	1967735	Cerep_002443	Clc1ccccc1N2CCN(CC2)C(=O)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K06	compound treatment	0.784	2.77E-4	0.0	0.729	-0.00224	-0.03	-0.0189	-0.6161	1967736	Cerep_002444	CC(COC(=O)NNC(=O)c1noc(C)c1c2csc(C)n2)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K07	compound treatment	0.756	-0.0277	-0.37	0.734	0.00276	0.04	-0.2378	-0.6327	1967737	Cerep_002445	OC(C1CCN(CC1)C(=O)OCC2COc3ccccc3O2)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K08	compound treatment	0.793	0.00928	0.13	0.747	0.0158	0.21	0.2405	0.9669	1967738	Cerep_002446	O=C(OCCc1cccc2ccccc12)N3CCN(CC3)c4nccnc4C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K09	compound treatment	0.768	-0.0157	-0.21	0.737	0.00576	0.08	-0.0944	-0.4175	1967739	Cerep_002447	Cc1nc(sc1C(=O)NNC(=O)OCc2nc(cs2)c3ccc(Cl)cc3)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K10	compound treatment	0.799	0.0153	0.21	0.752	0.0208	0.28	0.3459	0.9878	1967740	Cerep_002448	CN(C1CCN(Cc2cc3ccccc3o2)C1)C(=O)OCc4ccc(cc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K11	compound treatment	0.785	0.00128	0.02	0.722	-0.00924	-0.13	-0.0769	-0.6048	1967741	Cerep_002449	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCN4CCN(Cc5cc6OCOc6cc5Cl)CC4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K12	compound treatment	0.801	0.0173	0.23	0.739	0.00776	0.11	0.2396	0.9362	1967742	Cerep_002450	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K13	compound treatment	0.78	-0.00372	-0.05	0.724	-0.00724	-0.1	-0.1053	-0.9509	1967743	Cerep_002451	CC(C)(C)OC(=O)N(CCOC(=O)N1CCCC1C(=O)OCc2ccc(cc2)[N+](=O)[O-])C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K14	compound treatment	0.783	-7.23E-4	-0.01	0.731	-2.39E-4	0.0	-0.0092	-0.8947	1967744	Cerep_002452	Cc1cccc(CCOC(=O)NC2CCCC2OCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K15	compound treatment	0.806	0.0223	0.3	0.769	0.0378	0.51	0.5766	0.9671	1967745	Cerep_002453	CCC(COC(=O)NNC(=O)c1sc(nc1C)c2ccc(cc2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K16	compound treatment	0.798	0.0143	0.19	0.746	0.0148	0.2	0.2785	0.9998	1967746	Cerep_002454	CCOc1ccsc1C(=O)NNC(=O)OCCc2ccc(OCC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K17	compound treatment	0.797	0.0133	0.18	0.722	-0.00924	-0.13	0.0376	0.1715	1967747	Cerep_002455	CN(CCOC(=O)N1CCC(O)(CC1)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K18	compound treatment	0.823	0.0393	0.53	0.743	0.0118	0.16	0.4881	0.8816	1967748	Cerep_002456	CC(C)(C)c1ccc(COC(=O)N2CCC(CC2)N3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K19	compound treatment	0.769	-0.0147	-0.2	0.744	0.0128	0.17	-0.0174	-0.0659	1967749	Cerep_002457	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K20	compound treatment	0.807	0.0233	0.31	0.746	0.0148	0.2	0.3644	0.9769	1967750	Cerep_002458	COc1cc(ccc1O)C(=O)NNC(=O)OCC2(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K21	compound treatment	0.769	-0.0147	-0.2	0.737	0.00576	0.08	-0.0849	-0.3975	1967751	Cerep_002459	COc1ccc(CC(=O)NNC(=O)OCCCc2cccnc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	K22	compound treatment	0.796	0.0123	0.17	0.748	0.0168	0.23	0.2787	0.9875	1967752	Cerep_002460	CC(C)(C)c1ccc(COC(=O)NC(CCCNC(=O)OCc2ccccc2)C(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L03	compound treatment	0.802	0.0183	0.25	0.735	0.00376	0.05	0.2106	0.8363	1967753	Cerep_002461	[O-][N+](=O)c1cccc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L04	compound treatment	0.766	-0.0177	-0.24	0.713	-0.0182	-0.25	-0.3449	-0.9998	1967754	Cerep_002462	Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c2cc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L05	compound treatment	0.798	0.0143	0.19	0.734	0.00276	0.04	0.1628	0.8296	1967755	Cerep_002463	Fc1cccc(F)c1C(=O)Nc2ccccc2C(=O)NNC(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L06	compound treatment	0.765	-0.0187	-0.25	0.715	-0.0162	-0.22	-0.3352	-0.9978	1967756	Cerep_002464	OCCCC(=O)N/N=C/c1csc(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L07	compound treatment	0.779	-0.00472	-0.06	0.736	0.00476	0.06	9.0E-4	0.0094	1967757	Cerep_002465	COc1ccc(COC(=O)NNC(=O)c2scc(C)c2Cl)c(Cl)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L08	compound treatment	0.759	-0.0247	-0.33	0.713	-0.0182	-0.25	-0.4117	-0.9896	1967758	Cerep_002466	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)/C=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L09	compound treatment	0.763	-0.0207	-0.28	0.723	-0.00824	-0.11	-0.2771	-0.9198	1967759	Cerep_002467	CN1CCCC1CCOC(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L10	compound treatment	0.758	-0.0257	-0.35	0.718	-0.0132	-0.18	-0.373	-0.9536	1967760	Cerep_002468	COc1ccc(/C=N/NC(=O)OC(C)(C)C)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L11	compound treatment	0.78	-0.00372	-0.05	0.72	-0.0112	-0.15	-0.1439	-0.8922	1967761	Cerep_002469	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L12	compound treatment	0.796	0.0123	0.17	0.722	-0.00924	-0.13	0.028	0.1347	1967762	Cerep_002470	Cn1cc(/C=N/NC(=O)c2ccc(Cn3cnc(Cl)c3Cl)o2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L13	compound treatment	0.807	0.0233	0.31	0.746	0.0148	0.2	0.3644	0.9769	1967763	Cerep_002471	COc1ccc2c(CCNC(=O)OCCc3cccc(F)c3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L14	compound treatment	0.777	-0.00672	-0.09	0.709	-0.0222	-0.3	-0.2786	-0.8801	1967764	Cerep_002472	O=C(N/N=C/c1c[nH]c2cnc(OCc3ccccc3)cc12)/C=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L15	compound treatment	0.793	0.00928	0.13	0.732	7.61E-4	0.01	0.0958	0.7631	1967765	Cerep_002473	COc1ccc(COC(=O)NNC(=O)c2ccncc2)c(Cl)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L16	compound treatment	0.764	-0.0197	-0.27	0.722	-0.00924	-0.13	-0.2772	-0.9417	1967766	Cerep_002474	CSc1ncc(C(=O)N/N=C/c2ccnc3ccccc23)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L17	compound treatment	0.783	-7.23E-4	-0.01	0.74	0.00876	0.12	0.0776	0.6472	1967767	Cerep_002475	COc1cscc1C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L18	compound treatment	0.752	-0.0317	-0.43	0.726	-0.00524	-0.07	-0.3531	-0.8139	1967768	Cerep_002476	CC(Oc1ccc(Cl)cc1C)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L19	compound treatment	0.797	0.0133	0.18	0.732	7.61E-4	0.01	0.134	0.7468	1967769	Cerep_002477	CCN(CCOC(=O)NCc1csc2ccccc12)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L20	compound treatment	0.779	-0.00472	-0.06	0.729	-0.00224	-0.03	-0.0666	-0.9432	1967770	Cerep_002478	CC(C)(C)C(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L21	compound treatment	0.825	0.0413	0.56	0.737	0.00576	0.08	0.4493	0.799	1967771	Cerep_002479	Brc1ccc(CCOC(=O)NC(CCCNC(=O)OCc2ccccc2)C(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	L22	compound treatment	0.791	0.00728	0.1	0.721	-0.0102	-0.14	-0.0293	-0.1717	1967772	Cerep_002480	COc1cc(/C=N/NC(=O)C2C3CCCCC23)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M03	compound treatment	0.779	-0.00472	-0.06	0.75	0.0188	0.26	0.1358	0.5152	1967773	Cerep_002481	Brc1ccc(CCOC(=O)N2CCN(CCC3CCCCC3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M04	compound treatment	0.799	0.0153	0.21	0.742	0.0108	0.15	0.2495	0.9861	1967774	Cerep_002482	Cc1csc2c(SCC(=O)NNC(=O)OCCc3c(F)cccc3Cl)ncnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M05	compound treatment	0.787	0.00328	0.04	0.735	0.00376	0.05	0.0675	0.9973	1967775	Cerep_002483	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M06	compound treatment	0.781	-0.00272	-0.04	0.732	7.61E-4	0.01	-0.0186	-0.4883	1967776	Cerep_002484	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCSCc3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M07	compound treatment	0.792	0.00828	0.11	0.748	0.0168	0.23	0.2406	0.9457	1967777	Cerep_002485	COC(=O)c1ccc(COC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M08	compound treatment	0.786	0.00228	0.03	0.774	0.0428	0.58	0.434	0.7433	1967778	Cerep_002486	O=C(NC1CCN(Cc2ccccc2)C1)OCc3ccccc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M09	compound treatment	0.785	0.00128	0.02	0.735	0.00376	0.05	0.0484	0.8954	1967779	Cerep_002487	CN(CCOC(=O)NNC(=O)c1sc(nc1C)c2ccc(cc2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M10	compound treatment	0.804	0.0203	0.27	0.735	0.00376	0.05	0.2297	0.8253	1967780	Cerep_002488	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M11	compound treatment	0.783	-7.23E-4	-0.01	0.732	7.61E-4	0.01	4.0E-4	0.0308	1967781	Cerep_002489	CCN(CC)CCCNC(=O)OCCN1CCN(Cc2cc3ccccc3o2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M12	compound treatment	0.801	0.0173	0.23	0.739	0.00776	0.11	0.2396	0.9362	1967782	Cerep_002490	CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(CC1)c2nccnc2C#N)C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M13	compound treatment	0.803	0.0193	0.26	0.742	0.0108	0.15	0.2876	0.9633	1967783	Cerep_002491	COc1cc(Cl)c(COC(=O)N2CCCC2C(=O)Nc3ccc4ccccc4c3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M14	compound treatment	0.822	0.0383	0.52	0.757	0.0258	0.35	0.6135	0.9824	1967784	Cerep_002492	Clc1ccccc1CCNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M15	compound treatment	0.752	-0.0317	-0.43	0.728	-0.00324	-0.04	-0.3339	-0.776	1967785	Cerep_002493	O=C(OCC1CCCCO1)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M16	compound treatment	0.799	0.0153	0.21	0.722	-0.00924	-0.13	0.0566	0.2345	1967786	Cerep_002494	O=C(CC1Sc2ccccc2NC1=O)NNC(=O)OCCN(CCC#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M17	compound treatment	0.798	0.0143	0.19	0.734	0.00276	0.04	0.1628	0.8296	1967787	Cerep_002495	FC(F)(F)c1ccc2Sc3ccccc3N(CCCN4CCN(CCOC(=O)N5CCN(CC5)C(=O)Cc6ccc(Br)cc6)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M18	compound treatment	0.794	0.0103	0.14	0.734	0.00276	0.04	0.1247	0.8677	1967788	Cerep_002496	[O-][N+](=O)c1ccc(CCCCOC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M19	compound treatment	0.788	0.00428	0.06	0.746	0.0148	0.2	0.1831	0.8746	1967789	Cerep_002497	CC(=O)Nc1ccc(NC(=O)OCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M20	compound treatment	0.817	0.0333	0.45	0.75	0.0188	0.26	0.4983	0.9645	1967790	Cerep_002498	[O-][N+](=O)c1cccc(CNC(=O)OCCc2ccccc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M21	compound treatment	0.807	0.0233	0.31	0.756	0.0248	0.34	0.4608	0.9993	1967791	Cerep_002499	CCCCCC#CCOC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	M22	compound treatment	0.809	0.0253	0.34	0.746	0.0148	0.2	0.3835	0.9684	1967792	Cerep_002500	CN1CCCC1CCNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N03	compound treatment	0.812	0.0283	0.38	0.737	0.00576	0.08	0.3253	0.8352	1967793	Cerep_002501	Fc1ccc(COC(=O)N2CCN(Cc3ccc(Oc4ccccc4)cc3)CC2)cc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N04	compound treatment	0.785	0.00128	0.02	0.715	-0.0162	-0.22	-0.1444	-0.6501	1967794	Cerep_002502	O=C(N/N=C/c1cc2ccccc2o1)/C=C/c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N05	compound treatment	0.794	0.0103	0.14	0.735	0.00376	0.05	0.1343	0.9085	1967795	Cerep_002503	Oc1ccc(cc1)C(=O)NNC(=O)OCCc2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N06	compound treatment	0.767	-0.0167	-0.23	0.714	-0.0172	-0.24	-0.3258	-0.9998	1967796	Cerep_002504	[O-][N+](=O)c1cc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N07	compound treatment	0.762	-0.0217	-0.29	0.78	0.0488	0.66	0.2629	0.3619	1967797	Cerep_002505	Clc1ccc(cc1)c2csc(COC(=O)NCCCn3ccnc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N08	compound treatment	0.742	-0.0417	-0.56	0.722	-0.00924	-0.13	-0.4871	-0.8445	1967798	Cerep_002506	Fc1ccc(cc1)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N09	compound treatment	0.754	-0.0297	-0.4	0.702	-0.0292	-0.4	-0.5655	-1.0	1967799	Cerep_002507	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCCN3C(=O)c4ccccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N10	compound treatment	0.767	-0.0167	-0.23	0.686	-0.0452	-0.62	-0.5957	-0.907	1967800	Cerep_002508	COc1ccc(/C=N/NC(=O)COc2ccc(cc2)[N+](=O)[O-])c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N11	compound treatment	0.779	-0.00472	-0.06	0.735	0.00376	0.05	-0.0088	-0.1075	1967801	Cerep_002509	CC(C)Oc1ccc(CN2CCN(CCOC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N12	compound treatment	0.788	0.00428	0.06	0.732	7.61E-4	0.01	0.0481	0.8211	1967802	Cerep_002510	Cn1cc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N13	compound treatment	0.811	0.0273	0.37	0.718	-0.0132	-0.18	0.1325	0.3234	1967803	Cerep_002511	CCC/C=C/COC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N14	compound treatment	0.808	0.0243	0.33	0.753	0.0218	0.3	0.4414	0.9988	1967804	Cerep_002512	Fc1ccc(cc1)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N15	compound treatment	0.723	-0.0607	-0.82	0.723	-0.00824	-0.11	-0.6587	-0.7966	1967805	Cerep_002513	[O-][N+](=O)c1ccc(CN2CCN(CCOC(=O)NNC(=O)CNS(=O)(=O)c3cccc4nsnc34)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N16	compound treatment	0.789	0.00528	0.07	0.726	-0.00524	-0.07	-2.0E-4	-0.0018	1967806	Cerep_002514	CN(C)c1ccc(cc1)C(=O)N/N=C/c2ccnc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N17	compound treatment	0.813	0.0293	0.39	0.718	-0.0132	-0.18	0.1516	0.3492	1967807	Cerep_002515	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc(OC)c(F)c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N18	compound treatment	0.788	0.00428	0.06	0.715	-0.0162	-0.22	-0.1158	-0.506	1967808	Cerep_002516	O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)C3C4CCCCC34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N19	compound treatment	0.76	-0.0237	-0.32	0.708	-0.0232	-0.32	-0.4504	-1.0	1967809	Cerep_002517	COc1cc(OC)c(CN2CCC(C2)NC(=O)OCc3ccc(/C=C/c4ccccc4)cc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N20	compound treatment	0.78	-0.00372	-0.05	0.725	-0.00624	-0.09	-0.0957	-0.9684	1967810	Cerep_002518	Cn1cccc1C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N21	compound treatment	0.801	0.0173	0.23	0.758	0.0268	0.36	0.4228	0.9765	1967811	Cerep_002519	CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)OCCc1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	N22	compound treatment	0.761	-0.0227	-0.31	0.693	-0.0382	-0.52	-0.5855	-0.9679	1967812	Cerep_002520	COc1cc(/C=N/NC(=O)c2cccnc2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O03	compound treatment	0.779	-0.00472	-0.06	0.744	0.0128	0.17	0.078	0.4209	1967813	Cerep_002521	Clc1ccc(CCOC(=O)NC(Cc2ccccc2)C(=O)NNC(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O04	compound treatment	0.774	-0.00972	-0.13	0.754	0.0228	0.31	0.1267	0.3761	1967814	Cerep_002522	OC(C1CCN(CC1)C(=O)OCCc2ccc(F)cc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O05	compound treatment	0.798	0.0143	0.19	0.74	0.00876	0.12	0.2207	0.9736	1967815	Cerep_002523	CC(Cl)COC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O06	compound treatment	0.81	0.0263	0.35	0.745	0.0138	0.19	0.3834	0.9558	1967816	Cerep_002524	FC(F)(F)Oc1ccccc1COC(=O)NC2CCN(Cc3ccccc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O07	compound treatment	0.781	-0.00272	-0.04	0.747	0.0158	0.21	0.126	0.5779	1967817	Cerep_002525	CC(COC(=O)N1CCC(O)(CC1)c2ccc(Cl)cc2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O08	compound treatment	0.812	0.0283	0.38	0.756	0.0248	0.34	0.5085	0.9981	1967818	Cerep_002526	O=C(NNC(=O)c1ccc2nsnc2c1)OCCc3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O09	compound treatment	0.86	0.0763	1.03	0.776	0.0448	0.61	1.1592	0.9689	1967819	Cerep_002527	Cc1cccc(CCCOCCOC(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O10	compound treatment	0.777	-0.00672	-0.09	0.716	-0.0152	-0.21	-0.2111	-0.9309	1967820	Cerep_002528	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5cc(Br)ccc5OC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O11	compound treatment	0.795	0.0113	0.15	0.734	0.00276	0.04	0.1342	0.8563	1967821	Cerep_002529	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(Oc5ccccc5)cc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O12	compound treatment	0.796	0.0123	0.17	0.756	0.0248	0.34	0.3559	0.9462	1967822	Cerep_002530	COc1ccc(cc1)C(=O)NNC(=O)OCCC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O13	compound treatment	0.783	-7.23E-4	-0.01	0.728	-0.00324	-0.04	-0.0381	-0.843	1967823	Cerep_002531	CC(=O)NC1CCN(C1)C(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O14	compound treatment	0.788	0.00428	0.06	0.746	0.0148	0.2	0.1831	0.8746	1967824	Cerep_002532	CC(C)(C)c1ccc(O)c(NC(=O)OCCc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O15	compound treatment	0.796	0.0123	0.17	0.758	0.0268	0.36	0.3752	0.9361	1967825	Cerep_002533	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCc3ccc(cc3)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O16	compound treatment	0.798	0.0143	0.19	0.736	0.00476	0.06	0.1821	0.8959	1967826	Cerep_002534	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCN3C(=O)c4ccccc4OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O17	compound treatment	0.773	-0.0107	-0.14	0.736	0.00476	0.06	-0.0564	-0.3556	1967827	Cerep_002535	Cc1ccc2[nH]cc(CCNC(=O)OCCCNC(=O)OC(C)(C)C)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O18	compound treatment	0.795	0.0113	0.15	0.998	0.267	3.64	2.6798	0.736	1967828	Cerep_002536	Cc1cc(C)c(CCOC(=O)NCc2ccccc2Br)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O19	compound treatment	0.809	0.0253	0.34	0.729	-0.00224	-0.03	0.2195	0.6412	1967829	Cerep_002537	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O20	compound treatment	0.769	-0.0147	-0.2	0.735	0.00376	0.05	-0.1042	-0.5079	1967830	Cerep_002538	CC(COC(=O)N1CCCN(CC1)c2nc3ccc(Cl)cc3s2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O21	compound treatment	0.802	0.0183	0.25	0.773	0.0418	0.57	0.577	0.9298	1967831	Cerep_002539	Cc1cccc(c1)N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	O22	compound treatment	0.797	0.0133	0.18	0.744	0.0128	0.17	0.2497	0.9999	1967832	Cerep_002540	Cc1cc(C)c(CCOC(=O)N2CCN(CC2)c3ccccc3F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P03	compound treatment	0.782	-0.00172	-0.02	0.739	0.00776	0.11	0.0584	0.5389	1967833	Cerep_002541	O=C(NC1CCCC1OCc2ccccc2)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P04	compound treatment	0.756	-0.0277	-0.37	0.715	-0.0162	-0.22	-0.421	-0.9687	1967834	Cerep_002542	Fc1ccc(cc1)C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P05	compound treatment	0.782	-0.00172	-0.02	0.738	0.00676	0.09	0.0488	0.5128	1967835	Cerep_002543	CCC/C=C/COC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P06	compound treatment	0.744	-0.0397	-0.54	0.708	-0.0232	-0.32	-0.603	-0.9686	1967836	Cerep_002544	COc1ccc(CC(=O)N/N=C/c2csc(c2)[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P07	compound treatment	0.756	-0.0277	-0.37	0.713	-0.0182	-0.25	-0.4403	-0.9804	1967837	Cerep_002545	OC(C1CCN(CC1)C(=O)OCCC2CCCC2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P08	compound treatment	0.76	-0.0237	-0.32	0.722	-0.00924	-0.13	-0.3154	-0.917	1967838	Cerep_002546	Fc1cccc(c1)C(=O)N/N=C/c2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P09	compound treatment	0.685	-0.0987	-1.33	0.65	-0.0812	-1.11	-1.7251	-0.9958	1967839	Cerep_002547	CCN(CCOC(=O)N1CCN(CC1)c2cc(ccn2)C(F)(F)F)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P10	compound treatment	0.075	-0.709	-9.56	0.083	-0.648	-8.84	-13.0113	-0.9992	1967840	Cerep_002548	COc1ccc(/C=N/NC(=O)c2ccccc2Br)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P11	compound treatment	0.768	-0.0157	-0.21	0.735	0.00376	0.05	-0.1137	-0.5211	1967841	Cerep_002549	CC(Sc1ccc(Cl)cc1)C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P12	compound treatment	0.766	-0.0177	-0.24	0.72	-0.0112	-0.15	-0.2774	-0.9769	1967842	Cerep_002550	Cn1cc(/C=N/NC(=O)c2ccc3nonc3c2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P13	compound treatment	0.763	-0.0207	-0.28	0.735	0.00376	0.05	-0.1614	-0.5679	1967843	Cerep_002551	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCC(C)Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P14	compound treatment	0.779	-0.00472	-0.06	0.728	-0.00324	-0.04	-0.0763	-0.984	1967844	Cerep_002552	Fc1cccc(c1)C(=O)N/N=C/c2c[nH]c3cnc(OCc4ccccc4)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P15	compound treatment	0.789	0.00528	0.07	0.734	0.00276	0.04	0.077	0.9557	1967845	Cerep_002553	Cc1nc(sc1C(=O)NNC(=O)OCCOc2ccc3ccccc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P16	compound treatment	0.754	-0.0297	-0.4	0.726	-0.00524	-0.07	-0.3341	-0.8202	1967846	Cerep_002554	O=C(N/N=C/c1ccnc2ccccc12)c3cc(nc4ccccc34)C5CC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P17	compound treatment	0.766	-0.0177	-0.24	0.734	0.00276	0.04	-0.1424	-0.5885	1967847	Cerep_002555	COc1cc(Br)c(CN2CCCC(COC(=O)NCCc3ccc(F)cc3)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P18	compound treatment	0.751	-0.0327	-0.44	0.693	-0.0382	-0.52	-0.6809	-0.9966	1967848	Cerep_002556	O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P19	compound treatment	0.774	-0.00972	-0.13	0.725	-0.00624	-0.09	-0.1529	-0.978	1967849	Cerep_002557	COC(COC(=O)N1CCC(O)(Cc2ccccc2)CC1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P20	compound treatment	0.747	-0.0367	-0.5	0.692	-0.0392	-0.54	-0.7287	-0.9993	1967850	Cerep_002558	COc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P21	compound treatment	0.758	-0.0257	-0.35	0.73	-0.00124	-0.02	-0.2573	-0.7407	1967851	Cerep_002559	CN(C)CCN1CCN(CC1)C(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.533	P22	compound treatment	0.739	-0.0447	-0.6	0.758	0.0268	0.36	-0.1686	-0.2391	1967852	Cerep_002560	COc1cc(/C=N/NC(=O)Cn2cncn2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A03	compound treatment	0.79	-0.00157	-0.02	0.733	-0.011	-0.15	-0.1209	-0.7994	1967853	Cerep_002561	COc1cc(/C=N/NC(=O)Nc2ccccc2)ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A04	compound treatment	0.831	0.0394	0.53	0.747	0.00302	0.04	0.4052	0.7596	1967854	Cerep_002562	Cc1c(F)cccc1/C=N/NC(=O)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A05	compound treatment	0.807	0.0154	0.21	0.729	-0.015	-0.2	0.0027	0.0093	1967855	Cerep_002563	COc1cc(O)c(/C=N/NC(=O)c2ccco2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A06	compound treatment	0.822	0.0304	0.41	0.73	-0.014	-0.19	0.1554	0.3434	1967856	Cerep_002564	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A07	compound treatment	0.752	-0.0396	-0.53	0.733	-0.011	-0.15	-0.4834	-0.8718	1967857	Cerep_002565	Cc1cc(/C=N/NC(=O)c2ccc[nH]2)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A08	compound treatment	0.807	0.0154	0.21	0.761	0.017	0.23	0.3113	0.9985	1967858	Cerep_002566	CCCc1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A09	compound treatment	0.739	-0.0526	-0.71	0.719	-0.025	-0.34	-0.7424	-0.9435	1967859	Cerep_002567	Cc1nn(c(C)c1/C=N/NC(=O)c2ccc3nonc3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A10	compound treatment	0.81	0.0184	0.25	0.739	-0.00498	-0.07	0.1277	0.4957	1967860	Cerep_002568	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2cccc(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A11	compound treatment	0.805	0.0134	0.18	0.719	-0.025	-0.34	-0.1128	-0.2924	1967861	Cerep_002569	Cc1nn(c(C)c1/C=N/NC(=O)Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A12	compound treatment	0.812	0.0204	0.28	0.769	0.025	0.34	0.4361	0.9944	1967862	Cerep_002570	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2ccsc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A13	compound treatment	0.782	-0.00957	-0.13	0.693	-0.051	-0.7	-0.5829	-0.8244	1967863	Cerep_002571	COc1cc(O)c(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A14	compound treatment	0.802	0.0104	0.14	0.748	0.00402	0.05	0.1382	0.9156	1967864	Cerep_002572	Oc1cc2ccccc2cc1C(=O)N/N=C/c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A15	compound treatment	0.805	0.0134	0.18	0.726	-0.018	-0.25	-0.0453	-0.1486	1967865	Cerep_002573	Fc1cc(ccc1/C=N/NC(=O)c2ccccc2Br)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A16	compound treatment	0.826	0.0344	0.46	0.743	-9.81E-4	-0.01	0.3189	0.6865	1967866	Cerep_002574	CC(C)(C)c1ccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A17	compound treatment	0.803	0.0114	0.15	0.763	0.019	0.26	0.2924	0.9691	1967867	Cerep_002575	COc1cccc(c1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A18	compound treatment	0.798	0.00643	0.09	0.765	0.021	0.29	0.264	0.8815	1967868	Cerep_002576	Cc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A19	compound treatment	0.808	0.0164	0.22	0.763	0.019	0.26	0.3401	0.9969	1967869	Cerep_002577	O=C(N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A20	compound treatment	0.821	0.0294	0.4	0.727	-0.017	-0.23	0.117	0.2545	1967870	Cerep_002578	COc1cccc(c1)C(=O)N/N=C/c2ccsc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A21	compound treatment	0.794	0.00243	0.03	0.762	0.018	0.25	0.1969	0.7943	1967871	Cerep_002579	Cn1cccc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	A22	compound treatment	0.812	0.0204	0.28	0.764	0.02	0.27	0.3879	1.0	1967872	Cerep_002580	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B03	compound treatment	0.836	0.0444	0.6	0.77	0.026	0.35	0.6747	0.9687	1967873	Cerep_002581	CN(C1CCN(Cc2c(F)cccc2Cl)C1)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B04	compound treatment	0.768	-0.0236	-0.32	0.729	-0.015	-0.2	-0.3693	-0.9771	1967874	Cerep_002582	CN(C1CCN(Cc2ccc(cc2)C(F)(F)F)C1)S(=O)(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B05	compound treatment	0.806	0.0144	0.19	0.773	0.029	0.4	0.4174	0.9466	1967875	Cerep_002583	COc1ccc(C)cc1S(=O)(=O)N2CCc3cc(OC)c(OC)cc3C2CC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B06	compound treatment	0.796	0.00443	0.06	0.734	-0.00998	-0.14	-0.054	-0.3634	1967876	Cerep_002584	Cc1ccc(F)cc1S(=O)(=O)N2CCCC2C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B07	compound treatment	0.821	0.0294	0.4	0.748	0.00402	0.05	0.3195	0.7972	1967877	Cerep_002585	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(C)ccc3OC)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B08	compound treatment	0.766	-0.0256	-0.35	0.731	-0.013	-0.18	-0.3691	-0.9519	1967878	Cerep_002586	OCC(Cc1ccc(O)cc1)NS(=O)(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B09	compound treatment	0.811	0.0194	0.26	0.742	-0.00198	-0.03	0.1662	0.6309	1636554	Cerep_002587	CCc1cc(Br)ccc1S(=O)(=O)N(C)Cc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B10	compound treatment	0.829	0.0374	0.5	0.743	-9.81E-4	-0.01	0.3476	0.6881	1967879	Cerep_002588	Cc1nn(c(C)c1CN2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B11	compound treatment	0.783	-0.00857	-0.12	0.758	0.014	0.19	0.0534	0.2389	1967880	Cerep_002589	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B12	compound treatment	0.782	-0.00957	-0.13	0.751	0.00702	0.1	-0.0236	-0.1471	1967881	Cerep_002590	Clc1sc(cc1Br)S(=O)(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B13	compound treatment	0.783	-0.00857	-0.12	0.749	0.00502	0.07	-0.0334	-0.2485	1967882	Cerep_002591	COc1ccc(C)cc1S(=O)(=O)NC2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B14	compound treatment	0.807	0.0154	0.21	0.728	-0.016	-0.22	-0.0069	-0.023	1967883	Cerep_002592	Clc1ccc2[nH]cc(CCNS(=O)(=O)c3cccc(Br)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B15	compound treatment	0.793	0.00143	0.02	0.768	0.024	0.33	0.2452	0.7474	1967884	Cerep_002593	Cc1ccc(cc1Cl)S(=O)(=O)NC2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B16	compound treatment	0.804	0.0124	0.17	0.741	-0.00298	-0.04	0.0898	0.5205	1967885	Cerep_002594	CC(C)N1CCN(CC1)S(=O)(=O)c2cc(Br)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B17	compound treatment	0.819	0.0274	0.37	0.751	0.00702	0.1	0.3293	0.8617	1967886	Cerep_002595	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B18	compound treatment	0.77	-0.0216	-0.29	0.7	-0.044	-0.6	-0.6299	-0.9449	1967887	Cerep_002596	CN(C1CCN(Cc2ccc(cc2)C(F)(F)F)C1)S(=O)(=O)c3ccc(C)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B19	compound treatment	0.828	0.0364	0.49	0.76	0.016	0.22	0.5019	0.9334	1967888	Cerep_002597	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B20	compound treatment	0.802	0.0104	0.14	0.735	-0.00898	-0.12	0.0129	0.069	1967889	Cerep_002598	CCc1cc(Br)ccc1S(=O)(=O)NC2CCN(Cc3ccc(OC(C)C)cc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B21	compound treatment	0.812	0.0204	0.28	0.754	0.01	0.14	0.2915	0.9476	1967890	Cerep_002599	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(CC2)(C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	B22	compound treatment	0.772	-0.0196	-0.26	0.696	-0.048	-0.65	-0.6494	-0.9204	1967891	Cerep_002600	CN(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C03	compound treatment	0.817	0.0254	0.34	0.763	0.019	0.26	0.4259	0.9905	1967892	Cerep_002601	COc1cc(O)c(/C=N/NC(=O)c2ccccc2Oc3ccccc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C04	compound treatment	0.814	0.0224	0.3	0.751	0.00702	0.1	0.2816	0.8875	1967893	Cerep_002602	Fc1cccc(F)c1/C=N/NC(=O)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C05	compound treatment	0.823	0.0314	0.42	0.754	0.01	0.14	0.3964	0.8899	1967894	Cerep_002603	Cc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C06	compound treatment	0.81	0.0184	0.25	0.763	0.019	0.26	0.3592	0.9998	1967895	Cerep_002604	OC(=O)c1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C07	compound treatment	0.795	0.00343	0.05	0.765	0.021	0.29	0.2354	0.8107	1967896	Cerep_002605	Cn1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C08	compound treatment	0.819	0.0274	0.37	0.757	0.013	0.18	0.3872	0.9434	1967897	Cerep_002606	CC(C)c1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C09	compound treatment	0.794	0.00243	0.03	0.744	1.88E-5	0.0	0.0233	0.7126	1967898	Cerep_002607	COc1cccc(c1)C(=O)N/N=C/c2c(C)nn(c2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C10	compound treatment	0.799	0.00743	0.1	0.741	-0.00298	-0.04	0.0421	0.3893	1967899	Cerep_002608	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2cccnc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C11	compound treatment	0.795	0.00343	0.05	0.765	0.021	0.29	0.2354	0.8107	1967900	Cerep_002609	COc1cc(O)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C12	compound treatment	0.825	0.0334	0.45	0.748	0.00402	0.05	0.3576	0.7872	1967901	Cerep_002610	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C13	compound treatment	0.789	-0.00257	-0.03	0.722	-0.022	-0.3	-0.2365	-0.7838	1967902	Cerep_002611	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C14	compound treatment	0.785	-0.00657	-0.09	0.736	-0.00798	-0.11	-0.1397	-0.9948	1967903	Cerep_002612	COCCCNS(=O)(=O)c1cc(Cl)sc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C15	compound treatment	0.784	-0.00757	-0.1	0.725	-0.019	-0.26	-0.2553	-0.9173	1967904	Cerep_002613	Cc1nc(cs1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C16	compound treatment	0.786	-0.00557	-0.08	0.756	0.012	0.16	0.0627	0.3478	1967905	Cerep_002614	COc1cccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C17	compound treatment	0.769	-0.0226	-0.3	0.759	0.015	0.2	-0.0705	-0.1922	1967906	Cerep_002615	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C18	compound treatment	0.804	0.0124	0.17	0.76	0.016	0.22	0.273	0.9915	1967907	Cerep_002616	Fc1cc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C19	compound treatment	0.81	0.0184	0.25	0.72	-0.024	-0.33	-0.0555	-0.135	1967908	Cerep_002617	COc1ccc(/C=N/NC(=O)c2cc(n[nH]2)C(C)(C)C)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C20	compound treatment	0.8	0.00843	0.11	0.773	0.029	0.4	0.3602	0.8749	1967909	Cerep_002618	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(Cl)cc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C21	compound treatment	0.794	0.00243	0.03	0.773	0.029	0.4	0.303	0.763	1967910	Cerep_002619	Cc1cc(/C=N/NC(=O)COc2ccc(cc2)[N+](=O)[O-])c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	C22	compound treatment	0.792	4.26E-4	0.01	0.762	0.018	0.25	0.1778	0.7235	1967911	Cerep_002620	CCOc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D03	compound treatment	0.815	0.0234	0.32	0.774	0.03	0.41	0.5129	0.9918	1967912	Cerep_002621	CCOc1ccc(CCNS(=O)(=O)c2ccccc2OC(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D04	compound treatment	0.78	-0.0116	-0.16	0.725	-0.019	-0.26	-0.2934	-0.9707	1967913	Cerep_002622	CN(C1CCN(Cc2cc3OCOc3cc2Cl)C1)S(=O)(=O)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D05	compound treatment	0.805	0.0134	0.18	0.753	0.00902	0.12	0.215	0.9822	1967914	Cerep_002623	COc1ccc(C)cc1S(=O)(=O)N2CCN(CC2)C(c3ccc(Cl)cc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D06	compound treatment	0.782	-0.00957	-0.13	0.747	0.00302	0.04	-0.0622	-0.459	1967915	Cerep_002624	Cc1ccc(F)cc1S(=O)(=O)NC2CCN(Cc3ccnc4ccccc34)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D07	compound treatment	0.784	-0.00757	-0.1	0.741	-0.00298	-0.04	-0.101	-0.9184	1967916	Cerep_002625	CCOC(=O)N1CCC(CC1)NS(=O)(=O)c2cc(C)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D08	compound treatment	0.783	-0.00857	-0.12	0.717	-0.027	-0.37	-0.342	-0.8866	1967917	Cerep_002626	Clc1ccc(c(Cl)c1)S(=O)(=O)N2CCN(Cc3ccc4ccccc4n3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D09	compound treatment	0.789	-0.00257	-0.03	0.726	-0.018	-0.25	-0.1979	-0.7993	1967918	Cerep_002627	CCc1cc(Br)ccc1S(=O)(=O)N(C)C2CCN(Cc3ccccc3C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D10	compound treatment	0.817	0.0254	0.34	0.733	-0.011	-0.15	0.1367	0.3651	1967919	Cerep_002628	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br)cc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D11	compound treatment	0.795	0.00343	0.05	0.736	-0.00798	-0.11	-0.0443	-0.3744	1967920	Cerep_002629	CN(C1CCN(Cc2cccc(Cl)c2)C1)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D12	compound treatment	0.805	0.0134	0.18	0.708	-0.036	-0.49	-0.2189	-0.4185	1967921	Cerep_002630	Clc1sc(cc1Br)S(=O)(=O)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D13	compound treatment	0.795	0.00343	0.05	0.754	0.01	0.14	0.1293	0.8964	1967922	Cerep_002631	CCN(CC)CCNS(=O)(=O)c1cc(C)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D14	compound treatment	0.772	-0.0196	-0.26	0.722	-0.022	-0.3	-0.3987	-0.998	1967923	Cerep_002632	Brc1cccc(c1)S(=O)(=O)N(Cc2ccco2)Cc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D15	compound treatment	0.797	0.00543	0.07	0.754	0.01	0.14	0.1484	0.9572	1967924	Cerep_002633	Cc1ccc(cc1Cl)S(=O)(=O)NC(CO)Cc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D16	compound treatment	0.77	-0.0216	-0.29	0.736	-0.00798	-0.11	-0.2828	-0.91	1967925	Cerep_002634	COc1cc(OC)c(CN2CCN(CC2)S(=O)(=O)c3cc(Br)c(Cl)s3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D17	compound treatment	0.807	0.0154	0.21	0.747	0.00302	0.04	0.1763	0.8309	1967926	Cerep_002635	CN(C1CCN(Cc2cccc(Cl)c2)C1)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D18	compound treatment	0.793	0.00143	0.02	0.736	-0.00798	-0.11	-0.0634	-0.5732	1967927	Cerep_002636	CN(C1CCN(Cc2cc3OCOc3cc2Cl)C1)S(=O)(=O)c4ccc(C)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D19	compound treatment	0.793	0.00143	0.02	0.741	-0.00298	-0.04	-0.0151	-0.3366	1967928	Cerep_002637	Cc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D20	compound treatment	0.768	-0.0236	-0.32	0.751	0.00702	0.1	-0.1572	-0.4733	1967929	Cerep_002638	CCc1cc(Br)ccc1S(=O)(=O)NC2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D21	compound treatment	0.807	0.0154	0.21	0.771	0.027	0.37	0.4077	0.9634	1967930	Cerep_002639	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	D22	compound treatment	0.784	-0.00757	-0.1	0.736	-0.00798	-0.11	-0.1492	-0.9995	1967931	Cerep_002640	Fc1ccc(cc1)C(CCCN2CCN(CC2)S(=O)(=O)c3ccccc3Cl)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E03	compound treatment	0.788	-0.00357	-0.05	0.751	0.00702	0.1	0.0336	0.3134	1967932	Cerep_002641	CCOC(=O)CC(=O)N/N=C/c1c(O)cc(OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E04	compound treatment	0.776	-0.0156	-0.21	0.73	-0.014	-0.19	-0.2834	-0.9988	1967933	Cerep_002642	O=C(N/N=C/c1ccsc1)c2ccccc2CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E05	compound treatment	0.802	0.0104	0.14	0.712	-0.032	-0.44	-0.2089	-0.4559	1967934	Cerep_002643	Cc1cc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E06	compound treatment	0.797	0.00543	0.07	0.722	-0.022	-0.3	-0.1602	-0.5192	1967935	Cerep_002644	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E07	compound treatment	0.803	0.0114	0.15	0.743	-9.81E-4	-0.01	0.0995	0.6433	1967936	Cerep_002645	Cn1cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E08	compound treatment	0.848	0.0564	0.76	0.752	0.00802	0.11	0.6156	0.8005	1967937	Cerep_002646	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E09	compound treatment	0.79	-0.00157	-0.02	0.748	0.00402	0.05	0.0237	0.4039	1967938	Cerep_002647	Cc1nn(c(C)c1/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E10	compound treatment	0.778	-0.0136	-0.18	0.78	0.036	0.49	0.2178	0.4155	1967939	Cerep_002648	Cc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E11	compound treatment	0.768	-0.0236	-0.32	0.747	0.00302	0.04	-0.1958	-0.6105	1967940	Cerep_002649	COc1cc(O)c(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E12	compound treatment	0.786	-0.00557	-0.08	0.726	-0.018	-0.25	-0.2266	-0.8833	1967941	Cerep_002650	CC(=O)Nc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E13	compound treatment	0.776	-0.0156	-0.21	0.731	-0.013	-0.18	-0.2737	-0.9964	1967942	Cerep_002651	Fc1cc(ccc1/C=N/NC(=O)c2ccccc2OC(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E14	compound treatment	0.785	-0.00657	-0.09	0.752	0.00802	0.11	0.0146	0.1038	1967943	Cerep_002652	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E15	compound treatment	0.785	-0.00657	-0.09	0.747	0.00302	0.04	-0.0336	-0.3437	1967944	Cerep_002653	CCOc1cccc(c1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E16	compound treatment	0.78	-0.0116	-0.16	0.722	-0.022	-0.3	-0.3224	-0.9538	1967945	Cerep_002654	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E17	compound treatment	0.794	0.00243	0.03	0.758	0.014	0.19	0.1583	0.8163	1967946	Cerep_002655	COc1ccc(cc1OC)C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E18	compound treatment	0.794	0.00243	0.03	0.742	-0.00198	-0.03	0.004	0.0952	1967947	Cerep_002656	CCC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E19	compound treatment	0.79	-0.00157	-0.02	0.764	0.02	0.27	0.178	0.6502	1967948	Cerep_002657	COc1ccc(/C=N/NC(=O)c2cncc(Br)c2)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E20	compound treatment	0.799	0.00743	0.1	0.77	0.026	0.35	0.3217	0.8727	1967949	Cerep_002658	Cc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E21	compound treatment	0.8	0.00843	0.11	0.746	0.00202	0.03	0.0998	0.8537	1967950	Cerep_002659	COc1cc(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])ccc1OC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	E22	compound treatment	0.791	-5.74E-4	-0.01	0.756	0.012	0.16	0.1104	0.673	1967951	Cerep_002660	CCN(CC)c1ccc(/C=N/NC(=O)c2ccc3nonc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F03	compound treatment	0.805	0.0134	0.18	0.759	0.015	0.2	0.2729	0.9981	1967952	Cerep_002661	Fc1ccc(C(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3OC(F)(F)F)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F04	compound treatment	0.772	-0.0196	-0.26	0.726	-0.018	-0.25	-0.3601	-0.9993	1967953	Cerep_002662	Clc1ccc(c(Cl)c1)S(=O)(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F05	compound treatment	0.793	0.00143	0.02	0.759	0.015	0.2	0.1584	0.7702	1967954	Cerep_002663	COc1ccc(C)cc1S(=O)(=O)N2CCCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F06	compound treatment	0.788	-0.00357	-0.05	0.727	-0.017	-0.23	-0.1978	-0.8364	1967955	Cerep_002664	CC(C)Oc1ccc(CN2CCC(C2)NS(=O)(=O)c3cc(F)ccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F07	compound treatment	0.788	-0.00357	-0.05	0.741	-0.00298	-0.04	-0.0628	-0.9964	1967956	Cerep_002665	COc1ccc(C)cc1S(=O)(=O)NC2CCN(Cc3ccc(cc3OC)N(C)C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F08	compound treatment	0.791	-5.74E-4	-0.01	0.719	-0.025	-0.34	-0.2464	-0.723	1967957	Cerep_002666	COc1cc(CN2CCC(C2)NS(=O)(=O)c3ccc(Cl)cc3Cl)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F09	compound treatment	0.81	0.0184	0.25	0.746	0.00202	0.03	0.1952	0.7806	1967958	Cerep_002667	CCOc1ccccc1CN2CCC(C2)N(C)S(=O)(=O)c3ccc(Br)cc3CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F10	compound treatment	0.777	-0.0146	-0.2	0.715	-0.029	-0.4	-0.4185	-0.948	1967959	Cerep_002668	Clc1ccc(Sc2ccccc2CN3CCC(C3)NS(=O)(=O)c4cc(Br)ccc4Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F11	compound treatment	0.796	0.00443	0.06	0.742	-0.00198	-0.03	0.0231	0.3528	1967960	Cerep_002669	CN(C1CCN(Cc2c(F)cccc2Cl)C1)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F12	compound treatment	0.769	-0.0226	-0.3	0.707	-0.037	-0.5	-0.5719	-0.9708	1967961	Cerep_002670	Clc1sc(cc1Br)S(=O)(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F13	compound treatment	0.809	0.0174	0.24	0.748	0.00402	0.05	0.205	0.8492	1967962	Cerep_002671	COc1ccc(C)cc1S(=O)(=O)N2CCCC2C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F14	compound treatment	0.77	-0.0216	-0.29	0.728	-0.016	-0.22	-0.3599	-0.9898	1523617	Cerep_002672	COc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F15	compound treatment	0.812	0.0204	0.28	0.776	0.032	0.44	0.5036	0.9754	1967963	Cerep_002673	Cc1ccc(cc1Cl)S(=O)(=O)N2CCN(Cc3ccc4ccccc4n3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F16	compound treatment	0.79	-0.00157	-0.02	0.745	0.00102	0.01	-0.0052	-0.2045	1967964	Cerep_002674	Clc1sc(cc1Br)S(=O)(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F17	compound treatment	0.773	-0.0186	-0.25	0.754	0.01	0.14	-0.0806	-0.2823	1967965	Cerep_002675	CN(C1CCN(Cc2c(F)cccc2Cl)C1)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F18	compound treatment	0.79	-0.00157	-0.02	0.746	0.00202	0.03	0.0045	0.1281	1967966	Cerep_002676	Cc1ccc(cc1Cl)S(=O)(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F19	compound treatment	0.811	0.0194	0.26	0.759	0.015	0.2	0.3301	0.9926	1967967	Cerep_002677	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NCCc2c[nH]c3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F20	compound treatment	0.792	4.26E-4	0.01	0.717	-0.027	-0.37	-0.2561	-0.696	1967968	Cerep_002678	CCc1cc(Br)ccc1S(=O)(=O)NC(COC)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F21	compound treatment	0.788	-0.00357	-0.05	0.784	0.04	0.55	0.3518	0.6421	1967969	Cerep_002679	CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCN(Cc3ccnc4ccccc34)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	F22	compound treatment	0.785	-0.00657	-0.09	0.745	0.00102	0.01	-0.0529	-0.5891	1967970	Cerep_002680	Clc1ccccc1S(=O)(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G03	compound treatment	0.803	0.0114	0.15	0.736	-0.00798	-0.11	0.032	0.1698	1967971	Cerep_002681	COc1cc(O)c(/C=N/NC(=O)COc2ccccc2Cl)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G04	compound treatment	0.784	-0.00757	-0.1	0.746	0.00202	0.03	-0.0528	-0.4988	1967972	Cerep_002682	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G05	compound treatment	0.779	-0.0126	-0.17	0.735	-0.00898	-0.12	-0.2065	-0.9872	1967973	Cerep_002683	Cc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2C)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G06	compound treatment	0.806	0.0144	0.19	0.743	-9.81E-4	-0.01	0.1282	0.6569	1913722	Cerep_002684	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G07	compound treatment	0.79	-0.00157	-0.02	0.742	-0.00198	-0.03	-0.0341	-0.9929	1967974	Cerep_002685	Cc1nc(cs1)C(=O)N/N=C/c2c(C)nn(c2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G08	compound treatment	0.788	-0.00357	-0.05	0.723	-0.021	-0.29	-0.2364	-0.8148	1967975	Cerep_002686	COc1ccc(cc1OC)C(=O)N/N=C/c2cccc(OC)c2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G09	compound treatment	0.793	0.00143	0.02	0.741	-0.00298	-0.04	-0.0151	-0.3366	1967976	Cerep_002687	Cc1nn(c(C)c1/C=N/NC(=O)c2ccncc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G10	compound treatment	0.793	0.00143	0.02	0.74	-0.00398	-0.05	-0.0248	-0.4303	1967977	Cerep_002688	Fc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G11	compound treatment	0.787	-0.00457	-0.06	0.758	0.014	0.19	0.0915	0.4557	1967978	Cerep_002689	COc1cc(O)c(/C=N/NC(=O)c2cc3ccccc3s2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G12	compound treatment	0.806	0.0144	0.19	0.741	-0.00298	-0.04	0.1089	0.5476	1967979	Cerep_002690	COc1cccc(c1)C(=O)N/N=C/c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G13	compound treatment	0.772	-0.0196	-0.26	0.717	-0.027	-0.37	-0.4469	-0.9868	1967980	Cerep_002691	Fc1cc(ccc1/C=N/NC(=O)Cc2ccsc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G14	compound treatment	0.806	0.0144	0.19	0.738	-0.00598	-0.08	0.0799	0.3788	1967981	Cerep_002692	CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G15	compound treatment	0.782	-0.00957	-0.13	0.741	-0.00298	-0.04	-0.1201	-0.8868	1967982	Cerep_002693	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G16	compound treatment	0.785	-0.00657	-0.09	0.734	-0.00998	-0.14	-0.159	-0.9785	1967983	Cerep_002694	COc1cccc(c1)C(=O)N/N=C/c2cccc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G17	compound treatment	0.797	0.00543	0.07	0.776	0.032	0.44	0.3605	0.8143	1967984	Cerep_002695	O=C(N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12)c4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G18	compound treatment	0.806	0.0144	0.19	0.732	-0.012	-0.16	0.0221	0.0869	1967985	Cerep_002696	CC(=O)Oc1cccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G19	compound treatment	0.796	0.00443	0.06	0.771	0.027	0.37	0.3028	0.8111	1967986	Cerep_002697	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(OC)c(C)c2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G20	compound treatment	0.802	0.0104	0.14	0.729	-0.015	-0.2	-0.045	-0.1814	1967987	Cerep_002698	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc3ccccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G21	compound treatment	0.798	0.00643	0.09	0.756	0.012	0.16	0.1772	0.9557	1967988	Cerep_002699	Cc1cc(/C=N/NC(=O)c2ccccc2Br)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	G22	compound treatment	0.806	0.0144	0.19	0.75	0.00602	0.08	0.1957	0.9263	1967989	Cerep_002700	O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)C3CC3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H03	compound treatment	0.789	-0.00257	-0.03	0.74	-0.00398	-0.05	-0.0629	-0.9767	1967990	Cerep_002701	CCN(CC)CCCNS(=O)(=O)c1ccccc1OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H04	compound treatment	0.774	-0.0176	-0.24	0.743	-9.81E-4	-0.01	-0.1771	-0.7458	1967991	Cerep_002702	Fc1ccc(CC(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H05	compound treatment	0.797	0.00543	0.07	0.753	0.00902	0.12	0.1387	0.9693	1967992	Cerep_002703	COc1ccc(C)cc1S(=O)(=O)N(C)C2CCN(Cc3cc4ccccc4o3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H06	compound treatment	0.753	-0.0386	-0.52	0.727	-0.017	-0.23	-0.5317	-0.9335	1967993	Cerep_002704	Cc1ccc(F)cc1S(=O)(=O)NC2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H07	compound treatment	0.816	0.0244	0.33	0.772	0.028	0.38	0.5032	0.9973	1967994	Cerep_002705	COc1cc(CN2CCC(C2)NS(=O)(=O)c3cc(C)ccc3OC)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H08	compound treatment	0.802	0.0104	0.14	0.713	-0.031	-0.42	-0.1993	-0.4475	1967995	Cerep_002706	Fc1ccc(cc1)C(=O)C2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H09	compound treatment	0.798	0.00643	0.09	0.733	-0.011	-0.15	-0.0446	-0.2577	1967996	Cerep_002707	CCc1cc(Br)ccc1S(=O)(=O)NCCCN2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H10	compound treatment	0.802	0.0104	0.14	0.752	0.00802	0.11	0.1768	0.9922	1967997	Cerep_002708	Brc1ccc(Br)c(c1)S(=O)(=O)NCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H11	compound treatment	0.79	-0.00157	-0.02	0.756	0.012	0.16	0.1009	0.6104	1967998	Cerep_002709	Fc1ccc(C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(F)c(F)c3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H12	compound treatment	0.787	-0.00457	-0.06	0.71	-0.034	-0.46	-0.3713	-0.7943	1967999	Cerep_002710	COc1cccc(c1)C(C)NS(=O)(=O)c2cc(Br)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H13	compound treatment	0.793	0.00143	0.02	0.767	0.023	0.31	0.2356	0.749	1968000	Cerep_002711	COc1ccc(C)cc1S(=O)(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H14	compound treatment	0.775	-0.0166	-0.22	0.735	-0.00898	-0.12	-0.2447	-0.9599	1968001	Cerep_002712	Brc1cccc(c1)S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H15	compound treatment	0.78	-0.0116	-0.16	0.727	-0.017	-0.23	-0.2741	-0.9816	1968002	Cerep_002713	COc1cc(CN2CCC(C2)NS(=O)(=O)c3ccc(C)c(Cl)c3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H16	compound treatment	0.765	-0.0266	-0.36	0.738	-0.00598	-0.08	-0.3112	-0.8464	1968003	Cerep_002714	CN(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(Br)c(Cl)s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H17	compound treatment	0.788	-0.00357	-0.05	0.789	0.045	0.61	0.4	0.6496	1968004	Cerep_002715	CCOc1ccc(CCNS(=O)(=O)c2cc(Br)ccc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H18	compound treatment	0.757	-0.0346	-0.47	0.745	0.00102	0.01	-0.32	-0.6857	1968005	Cerep_002716	Cc1ccc(cc1Cl)S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H19	compound treatment	0.808	0.0164	0.22	0.776	0.032	0.44	0.4654	0.9506	1968006	Cerep_002717	CCOc1ccccc1CN(Cc2ccco2)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H20	compound treatment	0.802	0.0104	0.14	0.713	-0.031	-0.42	-0.1993	-0.4475	1968007	Cerep_002718	Clc1cc(c(Cl)s1)S(=O)(=O)N2CCN(Cc3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H21	compound treatment	0.797	0.00543	0.07	0.735	-0.00898	-0.12	-0.0348	-0.2442	1968008	Cerep_002719	CC(C)Oc1ccc(CN2CCC(C2)NS(=O)(=O)c3ccc(cc3)C(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	H22	compound treatment	0.785	-0.00657	-0.09	0.719	-0.025	-0.34	-0.3036	-0.8624	1968009	Cerep_002720	COc1ccc2ccccc2c1CN3CCC(C3)NS(=O)(=O)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I03	compound treatment	0.803	0.0114	0.15	0.775	0.031	0.42	0.4081	0.9065	1968010	Cerep_002721	COc1cc(O)c(/C=N/NC(=O)c2ccccc2CCc3ccccc3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I04	compound treatment	0.769	-0.0226	-0.3	0.764	0.02	0.27	-0.0223	-0.0545	1968011	Cerep_002722	CC(=O)Nc1ccc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I05	compound treatment	0.782	-0.00957	-0.13	0.742	-0.00198	-0.03	-0.1104	-0.8369	1968012	Cerep_002723	CCN(CC)c1ccc(cc1)C(=O)N/N=C/c2cc(C)n(c2C)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I06	compound treatment	0.781	-0.0106	-0.14	0.718	-0.026	-0.35	-0.3514	-0.92	1913813	Cerep_002724	COc1ccc(cc1OC)C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I07	compound treatment	0.792	4.26E-4	0.01	0.725	-0.019	-0.26	-0.179	-0.6912	1968013	Cerep_002725	CCOc1cccc(c1)C(=O)N/N=C/c2c(C)nn(c2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I08	compound treatment	0.837	0.0454	0.61	0.75	0.00602	0.08	0.4914	0.7947	1968014	Cerep_002726	Brc1cccc(c1)S(=O)(=O)N2CCN(Cc3ccc(Oc4ccccc4)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I09	compound treatment	0.774	-0.0176	-0.24	0.724	-0.02	-0.27	-0.3603	-0.9976	1968015	Cerep_002727	Cc1nn(c(C)c1/C=N/NC(=O)c2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I10	compound treatment	0.809	0.0174	0.24	0.74	-0.00398	-0.05	0.1278	0.5299	1968016	Cerep_002728	COc1ccc(cc1OC)C(=O)N/N=C/c2cccc(OC(=O)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I11	compound treatment	0.796	0.00443	0.06	0.729	-0.015	-0.2	-0.1022	-0.4803	1968017	Cerep_002729	COc1cc(O)c(/C=N/NC(=O)c2ccc(C)s2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I12	compound treatment	0.781	-0.0106	-0.14	0.729	-0.015	-0.2	-0.2453	-0.9846	1968018	Cerep_002730	[O-][N+](=O)c1ccccc1/C=N\NC(=O)c2ccc(OC(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I13	compound treatment	0.762	-0.0296	-0.4	0.725	-0.019	-0.26	-0.4651	-0.9781	1968019	Cerep_002731	Fc1cc(ccc1/C=N/NC(=O)Cc2csc(n2)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I14	compound treatment	0.811	0.0194	0.26	0.738	-0.00598	-0.08	0.1276	0.465	1968020	Cerep_002732	COc1cccc(c1)C(=O)N/N=C/c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I15	compound treatment	0.783	-0.00857	-0.12	0.724	-0.02	-0.27	-0.2745	-0.9272	1968021	Cerep_002733	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I16	compound treatment	0.776	-0.0156	-0.21	0.734	-0.00998	-0.14	-0.2448	-0.9779	1968022	Cerep_002734	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I17	compound treatment	0.794	0.00243	0.03	0.754	0.01	0.14	0.1198	0.8524	1968023	Cerep_002735	O=C(N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12)c4ccccc4Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I18	compound treatment	0.79	-0.00157	-0.02	0.748	0.00402	0.05	0.0237	0.4039	1968024	Cerep_002736	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I19	compound treatment	0.788	-0.00357	-0.05	0.759	0.015	0.2	0.1107	0.5263	1968025	Cerep_002737	COc1cscc1C(=O)N/N=C/c2cc3ccccc3o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I20	compound treatment	0.769	-0.0226	-0.3	0.752	0.00802	0.11	-0.138	-0.4265	1968026	Cerep_002738	COc1ccc(cc1)C(=O)N/N=C/c2cc(Cl)ccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I21	compound treatment	0.786	-0.00557	-0.08	0.732	-0.012	-0.16	-0.1687	-0.938	1968027	Cerep_002739	FC(F)(F)Oc1ccccc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	I22	compound treatment	0.825	0.0334	0.45	0.736	-0.00798	-0.11	0.2419	0.5215	1968028	Cerep_002740	Cc1cc(/C=N/NC(=O)c2ccc3nonc3c2)cc(C)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J03	compound treatment	0.792	4.26E-4	0.01	0.738	-0.00598	-0.08	-0.0536	-0.6556	1968029	Cerep_002741	FC(F)(F)Oc1ccccc1S(=O)(=O)NCCC2=CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J04	compound treatment	0.794	0.00243	0.03	0.75	0.00602	0.08	0.0812	0.9187	1248854	Cerep_002742	CCOc1ccccc1CNS(=O)(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J05	compound treatment	0.767	-0.0246	-0.33	0.668	-0.076	-1.04	-0.9671	-0.889	1968030	Cerep_002743	COc1ccc(C)cc1S(=O)(=O)N(C)C2CCN(Cc3ccc(cc3)C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J06	compound treatment	0.78	-0.0116	-0.16	0.746	0.00202	0.03	-0.0909	-0.5736	1968031	Cerep_002744	COCC(Cc1ccccc1)NS(=O)(=O)c2cc(F)ccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J07	compound treatment	0.801	0.00943	0.13	0.758	0.014	0.19	0.2251	0.9804	1968032	Cerep_002745	COc1ccc(C)cc1S(=O)(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J08	compound treatment	0.797	0.00543	0.07	0.728	-0.016	-0.22	-0.1023	-0.4451	1968033	Cerep_002746	NC(=O)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J09	compound treatment	0.776	-0.0156	-0.21	0.753	0.00902	0.12	-0.0616	-0.253	1968034	Cerep_002747	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J10	compound treatment	0.767	-0.0246	-0.33	0.744	1.88E-5	0.0	-0.2342	-0.7066	1968035	Cerep_002748	CCOc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J11	compound treatment	0.81	0.0184	0.25	0.744	1.88E-5	0.0	0.176	0.7078	1968036	Cerep_002749	CCN(CC)CCCNS(=O)(=O)c1ccc(F)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J12	compound treatment	0.777	-0.0146	-0.2	0.722	-0.022	-0.3	-0.351	-0.9791	1968037	Cerep_002750	FC(F)(F)c1cnc(N2CCN(CC2)S(=O)(=O)c3cc(Br)c(Cl)s3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J13	compound treatment	0.78	-0.0116	-0.16	0.752	0.00802	0.11	-0.0331	-0.1736	1968038	Cerep_002751	COc1ccc(C)cc1S(=O)(=O)NC(CO)Cc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J14	compound treatment	0.797	0.00543	0.07	0.744	1.88E-5	0.0	0.0519	0.7096	1968039	Cerep_002752	CC(Cc1ccc(Cl)cc1)NS(=O)(=O)c2cccc(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J15	compound treatment	0.789	-0.00257	-0.03	0.76	0.016	0.22	0.1299	0.5873	1968040	Cerep_002753	Cc1ccc(cc1Cl)S(=O)(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J16	compound treatment	0.758	-0.0336	-0.45	0.698	-0.046	-0.63	-0.7636	-0.9873	1968041	Cerep_002754	Fc1ccc(cc1)C(CCCN2CCN(CC2)S(=O)(=O)c3cc(Br)c(Cl)s3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J17	compound treatment	0.787	-0.00457	-0.06	0.731	-0.013	-0.18	-0.1688	-0.9004	1968042	Cerep_002755	Fc1ccc(C(=O)N2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J18	compound treatment	0.788	-0.00357	-0.05	0.712	-0.032	-0.44	-0.3425	-0.7805	1570994	Cerep_002756	CCOc1ccccc1CNS(=O)(=O)c2ccc(C)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J19	compound treatment	0.82	0.0284	0.38	0.769	0.025	0.34	0.5124	0.9983	1968043	Cerep_002757	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N(Cc2ccco2)Cc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J20	compound treatment	0.797	0.00543	0.07	0.683	-0.061	-0.83	-0.5362	-0.6424	1968044	Cerep_002758	COc1cccc(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J21	compound treatment	0.809	0.0174	0.24	0.759	0.015	0.2	0.3111	0.9976	1968045	Cerep_002759	CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	J22	compound treatment	0.764	-0.0276	-0.37	0.737	-0.00698	-0.1	-0.3303	-0.8603	1968046	Cerep_002760	Clc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3ccccc3Cl)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K03	compound treatment	0.833	0.0414	0.56	0.759	0.015	0.2	0.54	0.9072	1968047	Cerep_002761	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(O)cc(OC)cc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K04	compound treatment	0.807	0.0154	0.21	0.763	0.019	0.26	0.3305	0.994	1968048	Cerep_002762	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2cccc(Cl)c2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K05	compound treatment	0.786	-0.00557	-0.08	0.748	0.00402	0.05	-0.0144	-0.155	1968049	Cerep_002763	Cc1cc(/C=N/NC(=O)c2cccc(NC(=O)C(C)(C)C)c2)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K06	compound treatment	0.783	-0.00857	-0.12	0.731	-0.013	-0.18	-0.207	-0.9787	1968050	Cerep_002764	CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K07	compound treatment	0.769	-0.0226	-0.3	0.78	0.036	0.49	0.132	0.2284	1968051	Cerep_002765	Cc1nn(c(C)c1/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K08	compound treatment	0.812	0.0204	0.28	0.754	0.01	0.14	0.2915	0.9476	1968052	Cerep_002766	Cc1cccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K09	compound treatment	0.778	-0.0136	-0.18	0.76	0.016	0.22	0.025	0.0876	1968053	Cerep_002767	CC(Oc1ccc(Cl)cc1C)C(=O)N/N=C/c2c(C)nn(c2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K10	compound treatment	0.818	0.0264	0.36	0.754	0.01	0.14	0.3487	0.9133	1968054	Cerep_002768	O=C(N/N=C/c1ccoc1)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K11	compound treatment	0.786	-0.00557	-0.08	0.749	0.00502	0.07	-0.0048	-0.047	1968055	Cerep_002769	COc1cc(O)c(/C=N/NC(=O)\C=C\c2ccco2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K12	compound treatment	0.794	0.00243	0.03	0.745	0.00102	0.01	0.033	0.9272	1968056	Cerep_002770	COC(=O)c1ccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K13	compound treatment	0.775	-0.0166	-0.22	0.731	-0.013	-0.18	-0.2833	-0.9933	1968057	Cerep_002771	Fc1cc(ccc1/C=N/NC(=O)CC2OC(=O)c3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K14	compound treatment	0.792	4.26E-4	0.01	0.737	-0.00698	-0.1	-0.0632	-0.6632	1968058	Cerep_002772	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K15	compound treatment	0.786	-0.00557	-0.08	0.776	0.032	0.44	0.2556	0.5768	1968059	Cerep_002773	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K16	compound treatment	0.798	0.00643	0.09	0.766	0.022	0.3	0.2736	0.8755	1968060	Cerep_002774	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccc(OC(F)(F)F)cc4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K17	compound treatment	0.796	0.00443	0.06	0.753	0.00902	0.12	0.1292	0.9449	1968061	Cerep_002775	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K18	compound treatment	0.791	-5.74E-4	-0.01	0.736	-0.00798	-0.11	-0.0824	-0.7555	1968062	Cerep_002776	COc1cccc(c1)C(=O)N/N=C/c2cc(C)cc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K19	compound treatment	0.79	-0.00157	-0.02	0.764	0.02	0.27	0.178	0.6502	1968063	Cerep_002777	O=C(N/N=C/c1cc2ccccc2o1)c3nc(no3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K20	compound treatment	0.813	0.0214	0.29	0.745	0.00102	0.01	0.2142	0.7402	1968064	Cerep_002778	Clc1ccccc1OCC(=O)N/N=C/c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K21	compound treatment	0.778	-0.0136	-0.18	0.737	-0.00698	-0.1	-0.1968	-0.9536	1968065	Cerep_002779	O=C(Cc1ccsc1)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	K22	compound treatment	0.8	0.00843	0.11	0.743	-9.81E-4	-0.01	0.0709	0.6196	1968066	Cerep_002780	COc1cc(OC)cc(/C=N/NC(=O)c2ccc3nonc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L03	compound treatment	0.81	0.0184	0.25	0.749	0.00502	0.07	0.2242	0.8694	1968067	Cerep_002781	FC(F)(F)Oc1ccccc1S(=O)(=O)NC2CCCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L04	compound treatment	0.771	-0.0206	-0.28	0.721	-0.023	-0.31	-0.4179	-0.9982	1968068	Cerep_002782	CCN(CC)CCCC(C)NS(=O)(=O)c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L05	compound treatment	0.793	0.00143	0.02	0.722	-0.022	-0.3	-0.1983	-0.6604	1968069	Cerep_002783	COc1ccc(C)cc1S(=O)(=O)N(C)C2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L06	compound treatment	0.76	-0.0316	-0.43	0.724	-0.02	-0.27	-0.4939	-0.9767	1968070	Cerep_002784	Cc1ccc(F)cc1S(=O)(=O)NC(c2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L07	compound treatment	0.788	-0.00357	-0.05	0.742	-0.00198	-0.03	-0.0532	-0.9625	1968071	Cerep_002785	COc1ccc(CN(Cc2ccco2)S(=O)(=O)c3cc(C)ccc3OC)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L08	compound treatment	0.766	-0.0256	-0.35	0.718	-0.026	-0.35	-0.4945	-0.9999	1968072	Cerep_002786	Clc1ccc(cc1)C(N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L09	compound treatment	0.779	-0.0126	-0.17	0.733	-0.011	-0.15	-0.2258	-0.9981	1968073	Cerep_002787	CCc1cc(Br)ccc1S(=O)(=O)NCC2CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L10	compound treatment	0.773	-0.0186	-0.25	0.729	-0.015	-0.2	-0.3216	-0.9949	1968074	Cerep_002788	COc1ccccc1C2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L11	compound treatment	0.782	-0.00957	-0.13	0.754	0.01	0.14	0.0053	0.0281	1369918	Cerep_002789	Fc1ccc(cc1F)S(=O)(=O)NCCC2=CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L12	compound treatment	0.767	-0.0246	-0.33	0.719	-0.025	-0.34	-0.4753	-0.9999	1968075	Cerep_002790	COC(=O)c1csc2c(cc(nc12)N3CCN(CC3)S(=O)(=O)c4cc(Br)c(Cl)s4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L13	compound treatment	0.797	0.00543	0.07	0.752	0.00802	0.11	0.1291	0.981	1968076	Cerep_002791	COc1ccc(C)cc1S(=O)(=O)NCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L14	compound treatment	0.785	-0.00657	-0.09	0.722	-0.022	-0.3	-0.2747	-0.8787	1530449	Cerep_002792	Clc1sc(cc1Br)S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L15	compound treatment	0.788	-0.00357	-0.05	0.747	0.00302	0.04	-0.005	-0.0786	1968077	Cerep_002793	Cc1ccc(cc1Cl)S(=O)(=O)N(Cc2ccco2)Cc3cccc(Oc4ccc(Cl)cc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L16	compound treatment	0.758	-0.0336	-0.45	0.722	-0.022	-0.3	-0.5322	-0.9799	1968078	Cerep_002794	Cc1ccc(cc1Cl)S(=O)(=O)N2CCN(CC2)C(c3ccc(Cl)cc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L17	compound treatment	0.78	-0.0116	-0.16	0.757	0.013	0.18	0.0151	0.064	1968079	Cerep_002795	CCN(CC)CCCNS(=O)(=O)c1cc(Br)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L18	compound treatment	0.752	-0.0396	-0.53	0.715	-0.029	-0.4	-0.657	-0.989	1704654	Cerep_002796	CCc1cc(Br)ccc1S(=O)(=O)N2CCC(CC2)(C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L19	compound treatment	0.785	-0.00657	-0.09	0.72	-0.024	-0.33	-0.2939	-0.8675	1968080	Cerep_002797	COc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L20	compound treatment	0.794	0.00243	0.03	0.764	0.02	0.27	0.2162	0.7863	1968081	Cerep_002798	CC(=O)c1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L21	compound treatment	0.816	0.0244	0.33	0.758	0.014	0.19	0.3682	0.9665	1968082	Cerep_002799	CC(=O)c1ccc(cc1)S(=O)(=O)N(Cc2ccco2)Cc3ccccc3OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	L22	compound treatment	0.788	-0.00357	-0.05	0.725	-0.019	-0.26	-0.2171	-0.8246	1968083	Cerep_002800	Clc1ccccc1S(=O)(=O)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M03	compound treatment	0.8	0.00843	0.11	0.754	0.01	0.14	0.177	0.9958	1968084	Cerep_002801	COc1cc(O)c(/C=N/NC(=O)c2c(F)cccc2F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M04	compound treatment	0.84	0.0484	0.65	0.74	-0.00398	-0.05	0.4236	0.6461	1968085	Cerep_002802	[O-][N+](=O)c1ccccc1/C=N\NC(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M05	compound treatment	0.791	-5.74E-4	-0.01	0.74	-0.00398	-0.05	-0.0439	-0.7998	1968086	Cerep_002803	Cc1cc(/C=N/NC(=O)c2cccn2C)c(C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M06	compound treatment	0.791	-5.74E-4	-0.01	0.745	0.00102	0.01	0.0044	0.2736	1968087	Cerep_002804	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2cccc(F)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M07	compound treatment	0.789	-0.00257	-0.03	0.769	0.025	0.34	0.2167	0.6319	1968088	Cerep_002805	Cc1nn(c(C)c1/C=N/NC(=O)C(Cc2c[nH]cn2)NC(=O)OC(C)(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M08	compound treatment	0.803	0.0114	0.15	0.816	0.072	0.98	0.8034	0.8082	1968089	Cerep_002806	COc1ccc(cc1OC)C(=O)N/N=C/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M09	compound treatment	0.801	0.00943	0.13	0.751	0.00702	0.1	0.1576	0.9902	1968090	Cerep_002807	Cc1nn(c(C)c1/C=N/NC(=O)c2cccnc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M10	compound treatment	0.816	0.0244	0.33	0.742	-0.00198	-0.03	0.2139	0.647	1968091	Cerep_002808	Cc1c(F)cccc1/C=N/NC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M11	compound treatment	0.793	0.00143	0.02	0.739	-0.00498	-0.07	-0.0344	-0.4876	1968092	Cerep_002809	COc1cc(O)c(/C=N/NC(=O)CCCO)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M12	compound treatment	0.798	0.00643	0.09	0.74	-0.00398	-0.05	0.0229	0.224	1968093	Cerep_002810	[O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M13	compound treatment	0.768	-0.0236	-0.32	0.746	0.00202	0.03	-0.2054	-0.6435	1968094	Cerep_002811	COc1ccc(Cl)cc1C(=O)N/N=C/c2ccc(cc2F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M14	compound treatment	0.828	0.0364	0.49	0.774	0.03	0.41	0.6369	0.9959	1968095	Cerep_002812	CCCc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M15	compound treatment	0.751	-0.0406	-0.55	0.765	0.021	0.29	-0.1844	-0.2984	1968096	Cerep_002813	Clc1ncn(Cc2ccc(o2)C(=O)N/N=C/c3ccc(Oc4ccccc4)cc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M16	compound treatment	0.806	0.0144	0.19	0.746	0.00202	0.03	0.1571	0.7992	1968097	Cerep_002814	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccc(C#N)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M17	compound treatment	0.789	-0.00257	-0.03	0.768	0.024	0.33	0.207	0.6286	1968098	Cerep_002815	O=C(COc1ccccc1)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M18	compound treatment	0.8	0.00843	0.11	0.759	0.015	0.2	0.2252	0.9614	1968099	Cerep_002816	Cc1c(F)cccc1/C=N/NC(=O)c2cc3ccccc3cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M19	compound treatment	0.785	-0.00657	-0.09	0.739	-0.00498	-0.07	-0.1107	-0.9913	1968100	Cerep_002817	O=C(Nc1ccccc1C(=O)N/N=C/c2cc3ccccc3o2)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M20	compound treatment	0.795	0.00343	0.05	0.751	0.00702	0.1	0.1004	0.9443	1968101	Cerep_002818	Fc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M21	compound treatment	0.809	0.0174	0.24	0.774	0.03	0.41	0.4557	0.9653	1968102	Cerep_002819	O=C(Cc1csc(n1)c2ccccc2)N/N=C/c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	M22	compound treatment	0.826	0.0344	0.46	0.756	0.012	0.16	0.4443	0.9021	1968103	Cerep_002820	COc1ccc(OC)c(/C=N/NC(=O)c2cc(Cl)ccc2OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N03	compound treatment	0.805	0.0134	0.18	0.736	-0.00798	-0.11	0.0511	0.2419	1968104	Cerep_002821	Cc1ccc(C)c(c1)N2CCN(CC2)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N04	compound treatment	0.812	0.0204	0.28	0.727	-0.017	-0.23	0.0311	0.0864	1968105	Cerep_002822	COCC(C)NS(=O)(=O)c1ccc(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N05	compound treatment	0.816	0.0244	0.33	0.753	0.00902	0.12	0.32	0.9097	1968106	Cerep_002823	COc1ccc(C)cc1S(=O)(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N06	compound treatment	0.793	0.00143	0.02	0.73	-0.014	-0.19	-0.1212	-0.6325	1968107	Cerep_002824	Cc1ccc(F)cc1S(=O)(=O)N2CCN(CCN3CCOCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N07	compound treatment	0.768	-0.0236	-0.32	0.798	0.054	0.74	0.296	0.3689	1386438	Cerep_002825	COc1ccc(C)cc1S(=O)(=O)NCC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N08	compound treatment	0.758	-0.0336	-0.45	0.745	0.00102	0.01	-0.3104	-0.6851	1968108	Cerep_002826	FC(F)(F)c1cnc(N2CCCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N09	compound treatment	0.79	-0.00157	-0.02	0.754	0.01	0.14	0.0816	0.5901	1968109	Cerep_002827	CCc1cc(Br)ccc1S(=O)(=O)NCC(C)(C)CN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N10	compound treatment	0.788	-0.00357	-0.05	0.707	-0.037	-0.5	-0.3907	-0.7712	1968110	Cerep_002828	Clc1sc(cc1Br)S(=O)(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N11	compound treatment	0.803	0.0114	0.15	0.764	0.02	0.27	0.302	0.9634	1968111	Cerep_002829	Fc1ccc(cc1F)S(=O)(=O)NC2CCCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N12	compound treatment	0.777	-0.0146	-0.2	0.735	-0.00898	-0.12	-0.2256	-0.9741	1968112	Cerep_002830	OC1(CCN(CC1)S(=O)(=O)c2cccc(Br)c2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N13	compound treatment	0.81	0.0184	0.25	0.719	-0.025	-0.34	-0.0651	-0.1544	1968113	Cerep_002831	COc1ccc(C)cc1S(=O)(=O)N2CCC(CC2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N14	compound treatment	0.817	0.0254	0.34	0.754	0.01	0.14	0.3392	0.9186	1968114	Cerep_002832	Clc1sc(cc1Br)S(=O)(=O)N2CCN(CC2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N15	compound treatment	0.753	-0.0386	-0.52	0.765	0.021	0.29	-0.1653	-0.2782	1968115	Cerep_002833	COc1ccc(CN(Cc2ccco2)S(=O)(=O)c3ccc(C)c(Cl)c3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N16	compound treatment	0.793	0.00143	0.02	0.731	-0.013	-0.18	-0.1116	-0.6266	1968116	Cerep_002834	Cc1ccc(cc1Cl)S(=O)(=O)N2CCCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N17	compound treatment	0.813	0.0214	0.29	0.752	0.00802	0.11	0.2817	0.9116	1968117	Cerep_002835	Brc1ccc(Br)c(c1)S(=O)(=O)NCCC2=CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N18	compound treatment	0.777	-0.0146	-0.2	0.738	-0.00598	-0.08	-0.1967	-0.9241	1968118	Cerep_002836	CCc1cc(Br)ccc1S(=O)(=O)N2CCCC2C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N19	compound treatment	0.776	-0.0156	-0.21	0.718	-0.026	-0.35	-0.3991	-0.9689	1968119	Cerep_002837	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N20	compound treatment	0.763	-0.0286	-0.39	0.756	0.012	0.16	-0.1567	-0.3741	1968120	Cerep_002838	CC1(C)OCC(NS(=O)(=O)c2cc(Cl)sc2Cl)C(O1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N21	compound treatment	0.786	-0.00557	-0.08	0.753	0.00902	0.12	0.0338	0.2344	1968121	Cerep_002839	COCC(Cc1ccccc1)NS(=O)(=O)c2ccc(cc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	N22	compound treatment	0.778	-0.0136	-0.18	0.747	0.00302	0.04	-0.1004	-0.5348	1260902	Cerep_002840	Clc1ccccc1S(=O)(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O03	compound treatment	0.801	0.00943	0.13	0.752	0.00802	0.11	0.1672	0.9972	1968122	Cerep_002841	COc1cc(O)c(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O04	compound treatment	0.775	-0.0166	-0.22	0.75	0.00602	0.08	-0.1001	-0.4201	1968123	Cerep_002842	COC(=O)c1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O05	compound treatment	0.788	-0.00357	-0.05	0.749	0.00502	0.07	0.0143	0.1709	1968124	Cerep_002843	COc1ccc(cc1)C(=O)N/N=C/c2cc(C)n(c2C)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O06	compound treatment	0.811	0.0194	0.26	0.749	0.00502	0.07	0.2337	0.8628	1968125	Cerep_002844	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O07	compound treatment	0.812	0.0204	0.28	0.774	0.03	0.41	0.4843	0.9815	1968126	Cerep_002845	Cc1nn(c(C)c1/C=N/NC(=O)c2ccc(Cn3cnc(Cl)c3Cl)o2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O08	compound treatment	0.812	0.0204	0.28	0.751	0.00702	0.1	0.2625	0.9	1968127	Cerep_002846	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccc5ccccc5c4)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O09	compound treatment	0.881	0.0894	1.21	0.802	0.058	0.79	1.4125	0.9791	1968128	Cerep_002847	Cc1nn(c(C)c1/C=N/NC(=O)Cn2cncn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O10	compound treatment	0.774	-0.0176	-0.24	0.726	-0.018	-0.25	-0.341	-0.9999	1968129	Cerep_002848	Fc1cccc(F)c1/C=N/NC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O11	compound treatment	0.799	0.00743	0.1	0.744	1.88E-5	0.0	0.071	0.7089	1968130	Cerep_002849	COc1cc(O)c(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O12	compound treatment	0.827	0.0354	0.48	0.774	0.03	0.41	0.6274	0.997	1968131	Cerep_002850	COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O13	compound treatment	0.784	-0.00757	-0.1	0.735	-0.00898	-0.12	-0.1588	-0.9959	1968132	Cerep_002851	CC(C)(C)OC(=O)N/N=C/c1ccc(cc1F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O14	compound treatment	0.804	0.0124	0.17	0.771	0.027	0.37	0.3791	0.9365	1968133	Cerep_002852	CC(C)c1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O15	compound treatment	0.793	0.00143	0.02	0.746	0.00202	0.03	0.0331	0.9847	1968134	Cerep_002853	O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)c3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O16	compound treatment	0.812	0.0204	0.28	0.77	0.026	0.35	0.4457	0.9922	1968135	Cerep_002854	COc1cccc(c1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O17	compound treatment	0.783	-0.00857	-0.12	0.781	0.037	0.5	0.2752	0.5313	1968136	Cerep_002855	O=C(CC#N)N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O18	compound treatment	0.779	-0.0126	-0.17	0.778	0.034	0.46	0.2081	0.4213	1968137	Cerep_002856	Oc1cc2ccccc2cc1C(=O)N/N=C/c3c(F)cccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O19	compound treatment	0.787	-0.00457	-0.06	0.761	0.017	0.23	0.1205	0.5017	1968138	Cerep_002857	CC(C)(C)C(=O)Nc1cccc(c1)C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O20	compound treatment	0.77	-0.0216	-0.29	0.782	0.038	0.52	0.1608	0.2704	1968139	Cerep_002858	Clc1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O21	compound treatment	0.796	0.00443	0.06	0.791	0.047	0.64	0.4956	0.7696	1968140	Cerep_002859	O=C(CC1OC(=O)c2ccccc12)N/N=C/c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	O22	compound treatment	0.817	0.0254	0.34	0.748	0.00402	0.05	0.2813	0.8098	1968141	Cerep_002860	Clc1ccccc1OCC(=O)N/N=C/c2ccc(cc2)N(CCC#N)CCC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P03	compound treatment	0.81	0.0184	0.25	0.771	0.027	0.37	0.4363	0.9817	1968142	Cerep_002861	CC1CN(CCN1c2cccc(C)c2)S(=O)(=O)c3ccccc3OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P04	compound treatment	0.773	-0.0186	-0.25	0.729	-0.015	-0.2	-0.3216	-0.9949	1968143	Cerep_002862	Cc1ccc(F)cc1S(=O)(=O)N2CCC(CC2)(C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P05	compound treatment	0.776	-0.0156	-0.21	0.724	-0.02	-0.27	-0.3412	-0.9918	1968144	Cerep_002863	COc1ccc(C)cc1S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P06	compound treatment	0.737	-0.0546	-0.74	0.716	-0.028	-0.38	-0.7904	-0.9532	1968145	Cerep_002864	Clc1ccc(c(Cl)c1)S(=O)(=O)NC2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P07	compound treatment	0.784	-0.00757	-0.1	0.74	-0.00398	-0.05	-0.1106	-0.9562	1968146	Cerep_002865	COc1ccc(C)cc1S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P08	compound treatment	0.759	-0.0326	-0.44	0.718	-0.026	-0.35	-0.5613	-0.9943	1968147	Cerep_002866	OC1CCCN(C1)S(=O)(=O)c2cc(Br)ccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P09	compound treatment	0.67	-0.122	-1.64	0.687	-0.057	-0.78	-1.7092	-0.9418	1489236	Cerep_002867	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)c3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P10	compound treatment	0.074	-0.718	-9.68	0.107	-0.637	-8.69	-12.9872	-0.9985	1968148	Cerep_002868	COc1ccc2ccccc2c1CN3CCC(C3)NS(=O)(=O)c4cc(Br)c(Cl)s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P11	compound treatment	0.764	-0.0276	-0.37	0.736	-0.00798	-0.11	-0.34	-0.8772	1592908	Cerep_002869	Cc1ccc(C)c(c1)N2CCN(CC2)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P12	compound treatment	0.751	-0.0406	-0.55	0.732	-0.012	-0.16	-0.5026	-0.8798	1968149	Cerep_002870	Cc1cccc(CN2CCN(CC2)S(=O)(=O)c3cccc(Br)c3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P13	compound treatment	0.787	-0.00457	-0.06	0.758	0.014	0.19	0.0915	0.4557	1968150	Cerep_002871	COc1ccc(C)cc1S(=O)(=O)N2CCN(Cc3ccc4ccccc4n3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P14	compound treatment	0.778	-0.0136	-0.18	0.72	-0.024	-0.33	-0.3607	-0.9624	1968151	Cerep_002872	CN(C)CCN1CCN(CC1)S(=O)(=O)c2cc(Br)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P15	compound treatment	0.79	-0.00157	-0.02	0.732	-0.012	-0.16	-0.1305	-0.7923	1968152	Cerep_002873	Cc1ccc(cc1Cl)S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P16	compound treatment	0.763	-0.0286	-0.39	0.724	-0.02	-0.27	-0.4652	-0.9856	1968153	Cerep_002874	CN(C1CCN(Cc2cc3ccccc3o2)C1)S(=O)(=O)c4ccc(C)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P17	compound treatment	0.764	-0.0276	-0.37	0.739	-0.00498	-0.07	-0.3111	-0.8226	1968154	Cerep_002875	Brc1ccc(Br)c(c1)S(=O)(=O)NC2CCCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P18	compound treatment	0.774	-0.0176	-0.24	0.723	-0.021	-0.29	-0.37	-0.9956	1968155	Cerep_002876	CCc1cc(Br)ccc1S(=O)(=O)NC2CCN(Cc3ccnc4ccccc34)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P19	compound treatment	0.788	-0.00357	-0.05	0.736	-0.00798	-0.11	-0.111	-0.9329	1968156	Cerep_002877	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P20	compound treatment	0.761	-0.0306	-0.41	0.73	-0.014	-0.19	-0.4265	-0.9385	1968157	Cerep_002878	Clc1cc(c(Cl)s1)S(=O)(=O)NC2CCN(Cc3ccc4OCCOc4c3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P21	compound treatment	0.768	-0.0236	-0.32	0.744	1.88E-5	0.0	-0.2247	-0.7065	1968158	Cerep_002879	CC(=O)c1ccc(cc1)S(=O)(=O)NC(c2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.534	P22	compound treatment	0.745	-0.0466	-0.63	0.75	0.00602	0.08	-0.3862	-0.6096	1968159	Cerep_002880	CCCN(CC1CC1)S(=O)(=O)c2cc(Cl)sc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A03	compound treatment	0.785	0.00233	0.03	0.726	-0.0138	-0.19	-0.1104	-0.5807	1968160	Cerep_002881	COc1cc(Br)c(CN2CCCC(COC(=O)N3CCN(C(C)C3)c4cccc(C)c4)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A04	compound treatment	0.835	0.0523	0.71	0.758	0.0182	0.25	0.6751	0.902	1968161	Cerep_002882	CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(Cc2ccc(OCC=C)cc2)CC1)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A05	compound treatment	0.803	0.0203	0.27	0.735	-0.00475	-0.06	0.1481	0.5255	1968162	Cerep_002883	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccc(c(F)c5F)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A06	compound treatment	0.828	0.0453	0.61	0.725	-0.0148	-0.2	0.2901	0.4507	1968163	Cerep_002884	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(Cc5ccc(cc5)N(C)C)CC4)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A07	compound treatment	0.79	0.00733	0.1	0.744	0.00425	0.06	0.1108	0.9676	1968164	Cerep_002885	Cc1cccc(CCOC(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A08	compound treatment	0.794	0.0113	0.15	0.737	-0.00275	-0.04	0.0815	0.518	1968165	Cerep_002886	[O-][N+](=O)c1ccc(CN2CCN(CCOC(=O)NNC(=O)CC3Sc4ccccc4NC3=O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A09	compound treatment	0.794	0.0113	0.15	0.724	-0.0158	-0.21	-0.0438	-0.1663	1968166	Cerep_002887	COc1ccc(cc1)C(=O)NNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A10	compound treatment	0.789	0.00633	0.09	0.731	-0.00875	-0.12	-0.024	-0.1639	1968167	Cerep_002888	COc1cc(CCNC(=O)OCC2CCC=CC2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A11	compound treatment	0.74	-0.0427	-0.58	0.717	-0.0228	-0.31	-0.6265	-0.9579	1968168	Cerep_002889	CC(=CCC(COC(=O)NC(c1ccccc1)c2ccc(Cl)cc2)C(=C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A12	compound treatment	0.805	0.0223	0.3	0.744	0.00425	0.06	0.2539	0.8279	1968169	Cerep_002890	COc1ccc(CCCOC(=O)N2CCC(CC2)C(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A13	compound treatment	0.756	-0.0267	-0.36	0.723	-0.0168	-0.23	-0.416	-0.9759	1968170	Cerep_002891	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC(Cc3ccccc3)NC(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A14	compound treatment	0.786	0.00333	0.04	0.711	-0.0288	-0.39	-0.2455	-0.6221	1968171	Cerep_002892	Cc1ncc([N+](=O)[O-])n1CCOC(=O)NNC(=O)c2ccccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A15	compound treatment	0.784	0.00133	0.02	0.705	-0.0348	-0.47	-0.3224	-0.6799	1968172	Cerep_002893	COc1ccc(OC)c(CN2CCCCC2COC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A16	compound treatment	0.796	0.0133	0.18	0.739	-7.52E-4	-0.01	0.1199	0.6657	1968173	Cerep_002894	Cc1ccc2[nH]cc(CCNC(=O)OCC3CCCN(Cc4ccccc4SC(C)(C)C)C3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A17	compound treatment	0.777	-0.00567	-0.08	0.733	-0.00675	-0.09	-0.1192	-0.9958	1968174	Cerep_002895	O=C(OCc1ccc(cc1)c2ccccc2)N3CCN(Cc4cccnc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A18	compound treatment	0.793	0.0103	0.14	0.726	-0.0138	-0.19	-0.0341	-0.146	1968175	Cerep_002896	OC1(CCN(CC1)C(=O)OCc2ccc(F)c(c2)C(F)(F)F)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A19	compound treatment	0.775	-0.00767	-0.1	0.734	-0.00575	-0.08	-0.1287	-0.9906	1968176	Cerep_002897	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)OCCn5nc(cc5c6ccccc6)c7ccccc7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A20	compound treatment	0.802	0.0193	0.26	0.725	-0.0148	-0.2	0.0421	0.1279	1968177	Cerep_002898	CC(CCOC(=O)NCCNc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A21	compound treatment	0.806	0.0233	0.31	0.747	0.00725	0.1	0.2924	0.8865	1968178	Cerep_002899	Cc1cccc(CCOC(=O)N2CCC(CC2)C(=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	A22	compound treatment	0.843	0.0603	0.81	0.771	0.0312	0.43	0.8768	0.9544	1968179	Cerep_002900	CCCCCCCCCCOCCOCCOC(=O)NNC(=O)CC1Sc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B03	compound treatment	0.817	0.0343	0.46	0.758	0.0182	0.25	0.5034	0.9576	1968180	Cerep_002901	COc1cccc(c1)N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc(OC)c(OCc5ccccc5)c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B04	compound treatment	0.755	-0.0277	-0.37	0.728	-0.0118	-0.16	-0.3773	-0.9287	1968181	Cerep_002902	CC(C)c1nc2ccccc2c3C(=O)N(NC(=O)c4sccc4N(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B05	compound treatment	0.795	0.0123	0.17	0.767	0.0272	0.37	0.3803	0.9343	1968182	Cerep_002903	COc1cc(ccc1O)C(=O)NNC(=O)OCc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B06	compound treatment	0.786	0.00333	0.04	0.715	-0.0248	-0.34	-0.2069	-0.6078	1968183	Cerep_002904	CC(C)c1nc2ccccc2c3C(=O)N(CCC4CCCN4C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B07	compound treatment	0.806	0.0233	0.31	0.743	0.00325	0.04	0.2538	0.7987	1968184	Cerep_002905	COc1cc(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B08	compound treatment	0.759	-0.0237	-0.32	0.728	-0.0118	-0.16	-0.3392	-0.9491	1968185	Cerep_002906	COc1cc(OC)c(CN2C(=O)c3c(C2=O)c4ccccc4nc3C(C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B09	compound treatment	0.795	0.0123	0.17	0.746	0.00625	0.09	0.1778	0.9517	1968186	Cerep_002907	CC(Cl)COC(=O)NC1CCN(Cc2ccc(Cl)c(c2)[N+](=O)[O-])C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B10	compound treatment	0.807	0.0243	0.33	0.738	-0.00175	-0.02	0.2152	0.6539	1968187	Cerep_002908	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccc(Cl)cc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B11	compound treatment	0.763	-0.0197	-0.27	0.746	0.00625	0.09	-0.1274	-0.4572	1968188	Cerep_002909	Brc1cncc(c1)C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B12	compound treatment	0.756	-0.0267	-0.36	0.719	-0.0208	-0.28	-0.4546	-0.9929	1968189	Cerep_002910	CCc1nc2ccccc2c3C(=O)N(CCc4c[nH]cn4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B13	compound treatment	0.76	-0.0227	-0.31	0.732	-0.00775	-0.11	-0.291	-0.8993	1968190	Cerep_002911	Cc1ccc(CCOC(=O)N2CCC(C2)NC(=O)OC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B14	compound treatment	0.762	-0.0207	-0.28	0.712	-0.0278	-0.38	-0.4648	-0.9887	1968191	Cerep_002912	CCCc1nc2ccccc2c3C(=O)N(Cc4ccc(cc4)c5csnn5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B15	compound treatment	0.77	-0.0127	-0.17	0.748	0.00825	0.11	-0.0414	-0.2022	1968192	Cerep_002913	Cc1cc([nH]n1)C(=O)NNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B16	compound treatment	0.772	-0.0107	-0.14	0.728	-0.0118	-0.16	-0.2151	-0.9986	1968193	Cerep_002914	COCc1nc2ccccc2c3C(=O)N(CCc4cc(OC)cc(OC)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B17	compound treatment	0.783	3.26E-4	0.0	0.734	-0.00575	-0.08	-0.0524	-0.6664	1968194	Cerep_002915	CCCCCCCCCCOCCOCCOC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B18	compound treatment	0.749	-0.0337	-0.45	0.698	-0.0418	-0.57	-0.7238	-0.9937	1968195	Cerep_002916	CCc1nc2ccccc2c3C(=O)N(CCSCc4c(Cl)cccc4Cl)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B19	compound treatment	0.783	3.26E-4	0.0	0.74	2.48E-4	0.0	0.0055	0.9915	1968196	Cerep_002917	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccc(F)c(c5)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B20	compound treatment	0.76	-0.0227	-0.31	0.723	-0.0168	-0.23	-0.3778	-0.9897	1968197	Cerep_002918	CCCc1nc2ccccc2c3C(=O)N(Cc4ccccc4OCC)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B21	compound treatment	0.775	-0.00767	-0.1	0.728	-0.0118	-0.16	-0.1865	-0.9776	1968198	Cerep_002919	FC(F)(F)c1ccccc1COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	B22	compound treatment	0.748	-0.0347	-0.47	0.698	-0.0418	-0.57	-0.7334	-0.9952	1968199	Cerep_002920	CCCc1nc2ccccc2c3C(=O)N(NC(=O)CSc4c(C)[nH]c5ccccc45)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C03	compound treatment	0.786	0.00333	0.04	0.776	0.0362	0.49	0.3812	0.7681	1968200	Cerep_002921	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCN(Cc4c(Cl)cccc4Cl)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C04	compound treatment	0.821	0.0383	0.52	0.755	0.0152	0.21	0.5126	0.9199	1968201	Cerep_002922	O=C(NNC(=O)c1snnc1c2ccccc2)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C05	compound treatment	0.783	3.26E-4	0.0	0.741	0.00125	0.02	0.0151	0.8616	1968202	Cerep_002923	COc1ccccc1C2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C06	compound treatment	0.801	0.0183	0.25	0.758	0.0182	0.25	0.3508	1.0	1968203	Cerep_002924	CC(C)(C)OC(=O)N(CCOC(=O)NC(c1ccccc1)c2ccccn2)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C07	compound treatment	0.774	-0.00867	-0.12	0.716	-0.0238	-0.32	-0.3118	-0.9053	1968204	Cerep_002925	CC(=O)NCCNC(=O)OCCc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C08	compound treatment	0.8	0.0173	0.23	0.748	0.00825	0.11	0.2448	0.9438	1968205	Cerep_002926	Fc1ccc(cc1)C(CCCN2CCN(CC2)C(=O)OCCOc3ccc4ccccc4c3)c5ccc(F)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C09	compound treatment	0.78	-0.00267	-0.04	0.742	0.00225	0.03	-0.0038	-0.081	1968206	Cerep_002927	Cc1cc(C)c(CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C10	compound treatment	0.78	-0.00267	-0.04	0.743	0.00325	0.04	0.0058	0.1017	1968207	Cerep_002928	CC(=CC1C(CNC(=O)OCCc2ccccc2Cl)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C11	compound treatment	0.764	-0.0187	-0.25	0.761	0.0212	0.29	0.0267	0.0696	1968208	Cerep_002929	CC1(C)C2CC1C(=CC2)COC(=O)NNC(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C12	compound treatment	0.805	0.0223	0.3	0.741	0.00125	0.02	0.225	0.7459	1968209	Cerep_002930	CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)OCCCCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C13	compound treatment	0.793	0.0103	0.14	0.744	0.00425	0.06	0.1395	0.9244	1968210	Cerep_002931	Cc1cc(COC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C14	compound treatment	0.781	-0.00167	-0.02	0.746	0.00625	0.09	0.0443	0.5023	1968211	Cerep_002932	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5c(C)noc5c6cc(C)on6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C15	compound treatment	0.765	-0.0177	-0.24	0.723	-0.0168	-0.23	-0.3301	-0.9998	1968212	Cerep_002933	C=CCOc1ccc(CN2CCCCC2COC(=O)N3CCCC3C(=O)OCc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C16	compound treatment	0.785	0.00233	0.03	0.762	0.0222	0.3	0.2367	0.7761	1968213	Cerep_002934	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)OCCSCCNC(=O)c5sc6ccccc6c5Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C17	compound treatment	0.766	-0.0167	-0.22	0.741	0.00125	0.02	-0.147	-0.6518	1968214	Cerep_002935	CCOc1ccc(cc1)C(=O)NNC(=O)OCc2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C18	compound treatment	0.796	0.0133	0.18	0.767	0.0272	0.37	0.3899	0.9445	1968215	Cerep_002936	Cc1ccc2[nH]cc(CCNC(=O)OCc3ccc4ccccc4c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C19	compound treatment	0.8	0.0173	0.23	0.713	-0.0268	-0.36	-0.0927	-0.2139	1968216	Cerep_002937	CC(C)(C)OC(=O)N(CCOC(=O)NCCc1c[nH]c2ccc(O)cc12)Cc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C20	compound treatment	0.796	0.0133	0.18	0.759	0.0192	0.26	0.3127	0.983	1968217	Cerep_002938	Clc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C21	compound treatment	0.817	0.0343	0.46	0.759	0.0192	0.26	0.513	0.9638	1968218	Cerep_002939	Fc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	C22	compound treatment	0.781	-0.00167	-0.02	0.744	0.00425	0.06	0.025	0.4019	1968219	Cerep_002940	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCc3c(C)onc3c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D03	compound treatment	0.82	0.0373	0.5	0.758	0.0182	0.25	0.532	0.9472	1968220	Cerep_002941	O=C(Nc1ccc2ccccc2c1)C3CCCN3C(=O)OCc4ccccc4Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D04	compound treatment	0.78	-0.00267	-0.04	0.73	-0.00975	-0.13	-0.1195	-0.8676	1968221	Cerep_002942	CC(C)c1nc2ccccc2c3C(=O)N(NC(=O)c4csc(C)n4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D05	compound treatment	0.792	0.00933	0.13	0.743	0.00325	0.04	0.1203	0.9018	1968222	Cerep_002943	CCN(CC)CCCCCCOC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D06	compound treatment	0.775	-0.00767	-0.1	0.744	0.00425	0.06	-0.0322	-0.2718	1968223	Cerep_002944	CC(C)c1nc2ccccc2c3C(=O)N(NC(=O)C4(CCC4)c5ccc(Cl)cc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D07	compound treatment	0.785	0.00233	0.03	0.739	-7.52E-4	-0.01	0.0149	0.4524	1968224	Cerep_002945	CCc1ccc(COC(=O)N2CCN(Cc3c(OC)ccc4ccccc34)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D08	compound treatment	0.767	-0.0157	-0.21	0.73	-0.00975	-0.13	-0.2436	-0.975	1968225	Cerep_002946	CC(C)c1nc2ccccc2c3C(=O)N(CC4CCCO4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D09	compound treatment	0.781	-0.00167	-0.02	0.726	-0.0138	-0.19	-0.1486	-0.7866	1968226	Cerep_002947	Clc1ncn(Cc2nc(cs2)C(=O)NNC(=O)OCCc3ccccc3Br)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D10	compound treatment	0.796	0.0133	0.18	0.741	0.00125	0.02	0.1392	0.7706	1968227	Cerep_002948	CCc1nc2ccccc2c3C(=O)N(NC(=O)Cc4ccccc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D11	compound treatment	0.779	-0.00367	-0.05	0.729	-0.0108	-0.15	-0.1387	-0.8963	1968228	Cerep_002949	COc1cc(ccc1CN2CCCC(COC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)C2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D12	compound treatment	0.791	0.00833	0.11	0.71	-0.0298	-0.41	-0.2075	-0.4928	1968229	Cerep_002950	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccc(C)s4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D13	compound treatment	0.791	0.00833	0.11	0.742	0.00225	0.03	0.1011	0.8683	1968230	Cerep_002951	CC(CCOC(=O)NNC(=O)Cn1cnc(Cl)c1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D14	compound treatment	0.748	-0.0347	-0.47	0.712	-0.0278	-0.38	-0.5984	-0.9945	1968231	Cerep_002952	CCN(CC)CCN1C(=O)c2c(C1=O)c3cc(Br)ccc3nc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D15	compound treatment	0.82	0.0373	0.5	0.744	0.00425	0.06	0.397	0.7833	1968232	Cerep_002953	O=C(NNC(=O)c1csc(n1)c2ccccc2)OCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D16	compound treatment	0.771	-0.0117	-0.16	0.711	-0.0288	-0.39	-0.3886	-0.9197	1968233	Cerep_002954	COCc1nc2ccccc2c3C(=O)N(Cc4c(OC)cc(OC)cc4OC)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D17	compound treatment	0.812	0.0293	0.4	0.736	-0.00375	-0.05	0.2436	0.6106	1968234	Cerep_002955	Cc1onc(c1COC(=O)NNC(=O)CNS(=O)(=O)c2cccc3nsnc23)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D18	compound treatment	0.783	3.26E-4	0.0	0.723	-0.0168	-0.23	-0.1584	-0.6934	1968235	Cerep_002956	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4cncc(Br)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D19	compound treatment	0.799	0.0163	0.22	0.728	-0.0118	-0.16	0.0424	0.1557	1968236	Cerep_002957	Oc1ccc2[nH]cc(CCNC(=O)OCc3ccccc3OC(F)F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D20	compound treatment	0.759	-0.0237	-0.32	0.728	-0.0118	-0.16	-0.3392	-0.9491	1968237	Cerep_002958	CCCc1nc2ccccc2c3C(=O)N(Cc4ccc(OC)cc4OC)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D21	compound treatment	0.788	0.00533	0.07	0.761	0.0212	0.29	0.2557	0.8565	1968238	Cerep_002959	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5cccc(c5)C(F)(F)F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	D22	compound treatment	0.778	-0.00467	-0.06	0.719	-0.0208	-0.28	-0.2447	-0.844	1968239	Cerep_002960	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4cscc4OC)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E03	compound treatment	0.77	-0.0127	-0.17	0.75	0.0102	0.14	-0.0221	-0.1	1968240	Cerep_002961	CCOc1ccccc1CNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E04	compound treatment	0.77	-0.0127	-0.17	0.743	0.00325	0.04	-0.0896	-0.5072	1968241	Cerep_002962	CC(C)(C)c1ccc(COC(=O)NNC(=O)Cn2cnc(Cl)c2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E05	compound treatment	0.78	-0.00267	-0.04	0.721	-0.0188	-0.26	-0.2063	-0.7989	1968242	Cerep_002963	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCCN(Cc5cccc6ccccc56)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E06	compound treatment	0.794	0.0113	0.15	0.72	-0.0198	-0.27	-0.0824	-0.2661	1968243	Cerep_002964	Clc1ccccc1CCOC(=O)N2CCC(CC2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E07	compound treatment	0.785	0.00233	0.03	0.725	-0.0148	-0.2	-0.1201	-0.5897	1968244	Cerep_002965	CN1CCN(C)C(C1)C(=O)NNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E08	compound treatment	0.832	0.0493	0.67	0.739	-7.52E-4	-0.01	0.4633	0.6961	1968245	Cerep_002966	Cc1cc(no1)c2onc(C)c2COC(=O)N3CCN(Cc4ccco4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E09	compound treatment	0.777	-0.00567	-0.08	0.751	0.0112	0.15	0.0543	0.3169	1968246	Cerep_002967	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OC/C=C/C#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E10	compound treatment	0.757	-0.0257	-0.35	0.769	0.0292	0.4	0.0371	0.0702	1968247	Cerep_002968	Clc1cccc(CCOC(=O)NNC(=O)c2cccs2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E11	compound treatment	0.768	-0.0147	-0.2	0.746	0.00625	0.09	-0.0797	-0.37	1968248	Cerep_002969	FC(F)(F)c1ccccc1CCOC(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E12	compound treatment	0.773	-0.00967	-0.13	0.747	0.00725	0.1	-0.0224	-0.1368	1968249	Cerep_002970	FC(F)(F)c1cccc(/C=C/C(=O)NNC(=O)OCCCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E13	compound treatment	0.772	-0.0107	-0.14	0.733	-0.00675	-0.09	-0.1669	-0.9767	1968250	Cerep_002971	O=C(NCc1ccccn1)OCc2ccc(C#Cc3ccccc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E14	compound treatment	0.784	0.00133	0.02	0.726	-0.0138	-0.19	-0.12	-0.6368	1968251	Cerep_002972	O=C(NCc1ccc(cc1)c2csnn2)OCC3CCCCN3Cc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E15	compound treatment	0.766	-0.0167	-0.22	0.721	-0.0188	-0.26	-0.3399	-0.998	1968252	Cerep_002973	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ccccc4OC)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E16	compound treatment	0.782	-6.74E-4	-0.01	0.729	-0.0108	-0.15	-0.1101	-0.7495	1968253	Cerep_002974	COc1ccc(CN2CCCC(COC(=O)N3CCC(CC3)C(=O)c4ccc(F)cc4)C2)cc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E17	compound treatment	0.776	-0.00667	-0.09	0.732	-0.00775	-0.11	-0.1384	-0.9968	1968254	Cerep_002975	Cc1ccc(COC(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E18	compound treatment	0.769	-0.0137	-0.18	0.744	0.00425	0.06	-0.0895	-0.4628	1968255	Cerep_002976	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(C)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E19	compound treatment	0.785	0.00233	0.03	0.75	0.0102	0.14	0.121	0.8449	1968256	Cerep_002977	COc1cc(Cl)c(COC(=O)NCCn2c(C)ncc2[N+](=O)[O-])cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E20	compound treatment	0.798	0.0153	0.21	0.767	0.0272	0.37	0.4089	0.9617	1968257	Cerep_002978	Fc1cccc(Cl)c1COC(=O)NNC(=O)c2ccccc2NC(=O)c3c(F)cccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E21	compound treatment	0.799	0.0163	0.22	0.748	0.00825	0.11	0.2353	0.9513	1968258	Cerep_002979	Clc1ccc(CCOC(=O)NNC(=O)c2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	E22	compound treatment	0.782	-6.74E-4	-0.01	0.757	0.0172	0.24	0.1599	0.6793	1968259	Cerep_002980	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCN3CCS(=O)(=O)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F03	compound treatment	0.811	0.0283	0.38	0.777	0.0372	0.51	0.6294	0.9902	1968260	Cerep_002981	[O-][N+](=O)c1cccc(c1)c2nnn(CC(=O)NNC(=O)OCc3cccc(OCc4ccccc4)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F04	compound treatment	0.768	-0.0147	-0.2	0.729	-0.0108	-0.15	-0.2437	-0.9891	1968261	Cerep_002982	CC(C)c1nc2ccccc2c3C(=O)N(CCCn4ccnc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F05	compound treatment	0.778	-0.00467	-0.06	0.752	0.0122	0.17	0.0735	0.4118	1968262	Cerep_002983	CCCCCOC(=O)NNC(=O)/C=C/c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F06	compound treatment	0.762	-0.0207	-0.28	0.722	-0.0178	-0.24	-0.3684	-0.9975	1968263	Cerep_002984	CC(C)Oc1ccc(CN2CCC(C2)N3C(=O)c4c(C3=O)c5ccccc5nc4C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F07	compound treatment	0.779	-0.00367	-0.05	0.751	0.0112	0.15	0.0734	0.4554	1968264	Cerep_002985	COc1cscc1C(=O)NNC(=O)OCCc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F08	compound treatment	0.766	-0.0167	-0.22	0.721	-0.0188	-0.26	-0.3399	-0.998	1968265	Cerep_002986	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccc(SC)cc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F09	compound treatment	0.807	0.0243	0.33	0.742	0.00225	0.03	0.2537	0.7698	1968266	Cerep_002987	Cc1cc(no1)c2onc(C)c2COC(=O)N3CCC(CC3)C(=O)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F10	compound treatment	0.765	-0.0177	-0.24	0.723	-0.0168	-0.23	-0.3301	-0.9998	1968267	Cerep_002988	CN(C)c1ccc(cc1)C(=O)NN2C(=O)C3C(C4CCC3C=C4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F11	compound treatment	0.793	0.0103	0.14	0.738	-0.00175	-0.02	0.0816	0.5774	1968268	Cerep_002989	COc1ccccc1CCOC(=O)NC(CCCNC(=O)OCc2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F12	compound treatment	0.748	-0.0347	-0.47	0.709	-0.0308	-0.42	-0.6273	-0.9985	1968269	Cerep_002990	CCCc1nc2ccccc2c3C(=O)N(C(=O)c31)c4ccccc4N5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F13	compound treatment	0.796	0.0133	0.18	0.742	0.00225	0.03	0.1488	0.8159	1968270	Cerep_002991	COc1cc(CCNC(=O)OCC(C)c2ccccc2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F14	compound treatment	0.75	-0.0327	-0.44	0.726	-0.0138	-0.19	-0.4443	-0.9275	1968271	Cerep_002992	Cc1nc2ccc(Br)cc2c3C(=O)N(C(=O)c31)c4ccccc4N5CCCCC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F15	compound treatment	0.795	0.0123	0.17	0.756	0.0162	0.22	0.2742	0.99	1968272	Cerep_002993	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F16	compound treatment	0.772	-0.0107	-0.14	0.742	0.00225	0.03	-0.0801	-0.5444	1968273	Cerep_002994	COCc1nc2ccccc2c3C(=O)N(CC4CCCO4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F17	compound treatment	0.761	-0.0217	-0.29	0.737	-0.00275	-0.04	-0.2333	-0.7914	1968274	Cerep_002995	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCSc3ncc4ccccn34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F18	compound treatment	0.791	0.00833	0.11	0.743	0.00325	0.04	0.1107	0.9172	1968275	Cerep_002996	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4sc(nc4C)n5cccc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F19	compound treatment	0.805	0.0223	0.3	0.74	2.48E-4	0.0	0.2154	0.715	1968276	Cerep_002997	O=C(OCCn1nc(cc1c2ccccc2)c3ccccc3)N4CCN(Cc5cc6ccccc6o5)CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F20	compound treatment	0.778	-0.00467	-0.06	0.71	-0.0298	-0.41	-0.3315	-0.8073	1968277	Cerep_002998	CCCc1nc2ccccc2c3C(=O)N(C(COC)Cc4ccccc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F21	compound treatment	0.766	-0.0167	-0.22	0.762	0.0222	0.3	0.0555	0.1469	1968278	Cerep_002999	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCC5CCCN(O)C5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	F22	compound treatment	0.782	-6.74E-4	-0.01	0.733	-0.00675	-0.09	-0.0715	-0.7732	1968279	Cerep_003000	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4cc(c(SC)s4)S(=O)(=O)C(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G03	compound treatment	0.789	0.00633	0.09	0.759	0.0192	0.26	0.2459	0.8911	1968280	Cerep_003001	Cc1ncc([N+](=O)[O-])n1CCNC(=O)OCc2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G04	compound treatment	0.805	0.0223	0.3	0.751	0.0112	0.15	0.3214	0.951	1968281	Cerep_003002	CCOC(=O)C(Cc1ccccc1)NC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G05	compound treatment	0.778	-0.00467	-0.06	0.756	0.0162	0.22	0.1121	0.4865	1968282	Cerep_003003	COc1ccc(CCOC(=O)N2CCCC2C(=O)OCc3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G06	compound treatment	0.82	0.0373	0.5	0.738	-0.00175	-0.02	0.3392	0.6728	1968283	Cerep_003004	CCN(CC)Cc1cc(NC(=O)OCCc2ccccc2OC)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G07	compound treatment	0.783	3.26E-4	0.0	0.744	0.00425	0.06	0.0441	0.7586	1968284	Cerep_003005	CC(CCOC(=O)NC1CCCC1OCc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G08	compound treatment	0.78	-0.00267	-0.04	0.729	-0.0108	-0.15	-0.1292	-0.8556	1968285	Cerep_003006	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCCN3Cc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G09	compound treatment	0.788	0.00533	0.07	0.739	-7.52E-4	-0.01	0.0436	0.6001	1968286	Cerep_003007	Clc1ncn(Cc2nc(cs2)C(=O)NNC(=O)OC/C=C/COCc3ccccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G10	compound treatment	0.789	0.00633	0.09	0.741	0.00125	0.02	0.0724	0.8317	1968287	Cerep_003008	CCN(CC)Cc1cc(NC(=O)OCCc2ccc(Br)cc2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G11	compound treatment	0.752	-0.0307	-0.41	0.738	-0.00175	-0.02	-0.3095	-0.7467	1968288	Cerep_003009	CCOc1ccc(COC(=O)NNC(=O)c2cc(c(SC)s2)c3nc(C)cs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G12	compound treatment	0.801	0.0183	0.25	0.757	0.0172	0.24	0.3411	0.9997	1968289	Cerep_003010	Cc1onc(c1COC(=O)NNC(=O)CC2Sc3ccccc3NC2=O)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G13	compound treatment	0.751	-0.0317	-0.43	0.725	-0.0148	-0.2	-0.4444	-0.9409	1968290	Cerep_003011	CCOc1ccsc1C(=O)NNC(=O)OCc2nccn2Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G14	compound treatment	0.802	0.0193	0.26	0.744	0.00425	0.06	0.2253	0.8436	1968291	Cerep_003012	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4cc5OCOc5cc4[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G15	compound treatment	0.771	-0.0117	-0.16	0.741	0.00125	0.02	-0.0993	-0.6271	1968292	Cerep_003013	CN(C)c1ccc(CN2CCN(CCOC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G16	compound treatment	0.781	-0.00167	-0.02	0.742	0.00225	0.03	0.0057	0.1498	1968293	Cerep_003014	Fc1cccc(F)c1COC(=O)NCc2csc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G17	compound treatment	0.792	0.00933	0.13	0.756	0.0162	0.22	0.2456	0.9641	1968294	Cerep_003015	Cc1cccc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G18	compound treatment	0.816	0.0333	0.45	0.727	-0.0128	-0.17	0.1949	0.4044	1968295	Cerep_003016	COc1cccc(CCOC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G19	compound treatment	0.779	-0.00367	-0.05	0.711	-0.0288	-0.39	-0.3123	-0.7902	1968296	Cerep_003017	Fc1ccccc1CCOC(=O)N2CCC3(CC2)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G20	compound treatment	0.785	0.00233	0.03	0.743	0.00325	0.04	0.0535	0.9858	1968297	Cerep_003018	[O-][N+](=O)c1ccc(NCCNC(=O)OCc2cccc(Oc3ccccc3)c2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G21	compound treatment	0.793	0.0103	0.14	0.755	0.0152	0.21	0.2455	0.981	1968298	Cerep_003019	Cc1ccc(CCOC(=O)NC(Cc2ccc(OC(C)(C)C)cc2)C(=O)OC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	G22	compound treatment	0.787	0.00433	0.06	0.743	0.00325	0.04	0.0726	0.9907	1968299	Cerep_003020	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3csc(Cn4cnc(Cl)c4Cl)n3)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H03	compound treatment	0.768	-0.0147	-0.2	0.744	0.00425	0.06	-0.099	-0.4801	1968300	Cerep_003021	Cc1ccccc1CCOC(=O)N2CCN(CC2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H04	compound treatment	0.757	-0.0257	-0.35	0.732	-0.00775	-0.11	-0.3197	-0.8827	1968301	Cerep_003022	CC(C)c1nc2ccccc2c3C(=O)N(CCc4c[nH]c5ccccc45)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H05	compound treatment	0.789	0.00633	0.09	0.76	0.0202	0.28	0.2556	0.8844	1968302	Cerep_003023	CCN(CC)CCCNC(=O)OCC1CCCN(Cc2cc(OC)c(OC)cc2Br)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H06	compound treatment	0.753	-0.0297	-0.4	0.729	-0.0108	-0.15	-0.3867	-0.9072	1968303	Cerep_003024	COc1cc(CN2CCC(C2)N3C(=O)c4c(C3=O)c5ccccc5nc4C(C)C)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H07	compound treatment	0.807	0.0243	0.33	0.771	0.0312	0.43	0.5334	0.9917	1968304	Cerep_003025	COCCCCOC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H08	compound treatment	0.785	0.00233	0.03	0.718	-0.0218	-0.3	-0.1876	-0.6288	1968305	Cerep_003026	CCc1nc2ccccc2c3C(=O)N(Cc4nc5ccccc5[nH]4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H09	compound treatment	0.778	-0.00467	-0.06	0.733	-0.00675	-0.09	-0.1097	-0.9829	1968306	Cerep_003027	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H10	compound treatment	0.786	0.00333	0.04	0.75	0.0102	0.14	0.1305	0.8894	1968307	Cerep_003028	CC(C)(C)c1ccc(cc1)C(=O)NN2C(=O)C3C(C4CCC3C=C4)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H11	compound treatment	0.779	-0.00367	-0.05	0.763	0.0232	0.32	0.1891	0.5894	1968308	Cerep_003029	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCCN(Cc4cccc(Cl)c4)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H12	compound treatment	0.76	-0.0227	-0.31	0.719	-0.0208	-0.28	-0.4164	-0.9992	1968309	Cerep_003030	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccc(cc4)N(CC)CC)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H13	compound treatment	0.759	-0.0237	-0.32	0.751	0.0112	0.15	-0.1174	-0.3313	1968310	Cerep_003031	CCN(CC)CCCCCCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H14	compound treatment	0.774	-0.00867	-0.12	0.753	0.0132	0.18	0.045	0.209	1968311	Cerep_003032	CCN(CC)c1ccc(cc1)C(=O)NN2C(=O)c3c(C2=O)c4cc(Br)ccc4nc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H15	compound treatment	0.795	0.0123	0.17	0.714	-0.0258	-0.35	-0.1307	-0.3365	1968312	Cerep_003033	CC(C)(C)c1ccc(COC(=O)NCC2CCCCC2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H16	compound treatment	0.777	-0.00567	-0.08	0.73	-0.00975	-0.13	-0.1482	-0.9656	1968313	Cerep_003034	COCc1nc2ccccc2c3C(=O)N(NC(=O)C(=O)N4CCCc5ccccc45)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H17	compound treatment	0.761	-0.0217	-0.29	0.771	0.0312	0.43	0.0945	0.183	1968314	Cerep_003035	COc1ccc(COC(=O)NNC(=O)c2ccc3nccnc3c2)c(Cl)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H18	compound treatment	0.734	-0.0487	-0.66	0.725	-0.0148	-0.2	-0.6066	-0.8832	1968315	Cerep_003036	CCc1nc2ccccc2c3C(=O)N(NC(=O)CC4(CC5CC6CC(C5)C4)C6)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H19	compound treatment	0.798	0.0153	0.21	0.768	0.0282	0.39	0.4186	0.9574	1968316	Cerep_003037	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(CC4)c5ccc(C)cc5)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H20	compound treatment	0.855	0.0723	0.98	0.726	-0.0138	-0.19	0.5573	0.5609	1968317	Cerep_003038	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccccc4Cl)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H21	compound treatment	0.794	0.0113	0.15	0.741	0.00125	0.02	0.1201	0.781	1968318	Cerep_003039	Cc1ccc([N+](=O)[O-])c(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	H22	compound treatment	0.775	-0.00767	-0.1	0.717	-0.0228	-0.31	-0.2926	-0.8946	1968319	Cerep_003040	COCc1nc2ccccc2c3C(=O)N(CCCn4ccnc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I03	compound treatment	0.796	0.0133	0.18	0.755	0.0152	0.21	0.2741	0.9974	1968320	Cerep_003041	Cc1ccccc1COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I04	compound treatment	0.771	-0.0117	-0.16	0.76	0.0202	0.28	0.0839	0.2639	1968321	Cerep_003042	CC(Sc1ccc(Cl)cc1)C(=O)NNC(=O)OCCc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I05	compound treatment	0.794	0.0113	0.15	0.742	0.00225	0.03	0.1297	0.8324	1968322	Cerep_003043	Fc1ccccc1CCOC(=O)NC(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I06	compound treatment	0.785	0.00233	0.03	0.742	0.00225	0.03	0.0439	0.9999	1968323	Cerep_003044	Clc1cccc(CCNC(=O)OCCc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I07	compound treatment	0.79	0.00733	0.1	0.718	-0.0218	-0.3	-0.1399	-0.4473	1968324	Cerep_003045	COc1ccc(CCCOC(=O)NC(C(C)C)C(=O)Nc2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I08	compound treatment	0.818	0.0353	0.48	0.757	0.0172	0.24	0.5033	0.947	1968325	Cerep_003046	CCOc1ccccc1CNC(=O)OCCN2CCN(Cc3cc4OCOc4c(OC)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I09	compound treatment	0.746	-0.0367	-0.49	0.739	-7.52E-4	-0.01	-0.3571	-0.7216	1968326	Cerep_003047	CC1(C)C2CC1C(COC(=O)N3CCN(CC3)c4ccc(cn4)C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I10	compound treatment	0.796	0.0133	0.18	0.739	-7.52E-4	-0.01	0.1199	0.6657	1968327	Cerep_003048	CC(C)C(NC(=O)OCCc1ccc(Cl)cc1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I11	compound treatment	0.783	3.26E-4	0.0	0.728	-0.0118	-0.16	-0.1102	-0.6874	1968328	Cerep_003049	O=C(CNS(=O)(=O)c1cccc2nsnc12)NNC(=O)OCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I12	compound treatment	0.77	-0.0127	-0.17	0.729	-0.0108	-0.15	-0.2246	-0.9971	1968329	Cerep_003050	O=C(NNC(=O)/C=C/c1ccco1)OCCN2CCS(=O)(=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I13	compound treatment	0.749	-0.0337	-0.45	0.724	-0.0158	-0.21	-0.4731	-0.9415	1968330	Cerep_003051	Clc1ccc(cc1)c2csc(COC(=O)N3CCN(CC3)c4cnccn4)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I14	compound treatment	0.8	0.0173	0.23	0.732	-0.00775	-0.11	0.0905	0.3529	1968331	Cerep_003052	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCCN3Cc4cc(Br)c(OC)cc4OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I15	compound treatment	0.778	-0.00467	-0.06	0.726	-0.0138	-0.19	-0.1772	-0.8956	1968332	Cerep_003053	CC(C)(C)OC(=O)N1CCCC1COC(=O)N2CCN(CC2)c3cc(nc4cc(nn34)C(C)(C)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I16	compound treatment	0.77	-0.0127	-0.17	0.735	-0.00475	-0.06	-0.1667	-0.9118	1968333	Cerep_003054	CCOc1ccccc1COC(=O)N2CCN(CC2)c3cc(ccn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I17	compound treatment	0.791	0.00833	0.11	0.757	0.0172	0.24	0.2457	0.9428	1968334	Cerep_003055	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCC3CCN(O)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I18	compound treatment	0.774	-0.00867	-0.12	0.74	2.48E-4	0.0	-0.0804	-0.6864	1968335	Cerep_003056	CCN1CCCC1CNC(=O)OCCc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I19	compound treatment	0.78	-0.00267	-0.04	0.774	0.0342	0.47	0.3047	0.6505	1968336	Cerep_003057	Fc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I20	compound treatment	0.762	-0.0207	-0.28	0.744	0.00425	0.06	-0.1563	-0.5486	1968337	Cerep_003058	O=C(NNC(=O)c1ccc(cc1)c2ccccc2)OCc3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I21	compound treatment	0.792	0.00933	0.13	0.748	0.00825	0.11	0.1685	0.9984	1968338	Cerep_003059	CC(CCOC(=O)NCc1ccc(Cl)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	I22	compound treatment	0.84	0.0573	0.77	0.746	0.00625	0.09	0.6071	0.7803	1968339	Cerep_003060	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCCN3CCN(Cc4ccccc4SC(C)(C)C)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J03	compound treatment	0.81	0.0273	0.37	0.734	-0.00575	-0.08	0.2052	0.5445	1968340	Cerep_003061	CC(COC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)C4CCC(=CC4)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J04	compound treatment	0.78	-0.00267	-0.04	0.73	-0.00975	-0.13	-0.1195	-0.8676	1968341	Cerep_003062	CCN1CCCC1CN2C(=O)c3c(C2=O)c4ccccc4nc3C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J05	compound treatment	0.761	-0.0217	-0.29	0.763	0.0232	0.32	0.0174	0.0404	1968342	Cerep_003063	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCN(Cc4ccc(OC)c(OCc5ccccc5)c4)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J06	compound treatment	0.764	-0.0187	-0.25	0.746	0.00625	0.09	-0.1179	-0.4433	1968343	Cerep_003064	CC(C)c1nc2ccccc2c3C(=O)N(Cc4ccc(C)o4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J07	compound treatment	0.777	-0.00567	-0.08	0.75	0.0102	0.14	0.0447	0.2805	1968344	Cerep_003065	COc1ccc(cc1)C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J08	compound treatment	0.777	-0.00567	-0.08	0.735	-0.00475	-0.06	-0.1	-0.9966	1968345	Cerep_003066	CCc1nc2ccccc2c3C(=O)N(Cc4ccccc4OC(F)(F)F)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J09	compound treatment	0.774	-0.00867	-0.12	0.746	0.00625	0.09	-0.0225	-0.1555	1968346	Cerep_003067	CN(C)c1ccc(CN2CCCCC2COC(=O)NCc3csc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J10	compound treatment	0.768	-0.0147	-0.2	0.746	0.00625	0.09	-0.0797	-0.37	1968347	Cerep_003068	Fc1cccc(F)c1C(=O)Nc2ccccc2C(=O)NN3C(=O)C4C(C5CCC4C=C5)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J11	compound treatment	0.803	0.0203	0.27	0.756	0.0162	0.22	0.3506	0.9944	1968348	Cerep_003069	CC(NC(=O)OCCc1cccc(Cl)c1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J12	compound treatment	0.763	-0.0197	-0.27	0.734	-0.00575	-0.08	-0.2431	-0.8785	1968349	Cerep_003070	CCCc1nc2ccccc2c3C(=O)N(CCN(CC)c4cccc(C)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J13	compound treatment	0.776	-0.00667	-0.09	0.76	0.0202	0.28	0.1316	0.453	1968350	Cerep_003071	CN1CCCC1CCOC(=O)NNC(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J14	compound treatment	0.78	-0.00267	-0.04	0.736	-0.00375	-0.05	-0.0617	-0.9854	1968351	Cerep_003072	CCN(CCN1C(=O)c2c(C1=O)c3cc(Br)ccc3nc2C)c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J15	compound treatment	0.775	-0.00767	-0.1	0.76	0.0202	0.28	0.122	0.4138	1968352	Cerep_003073	COc1ccc(CCNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J16	compound treatment	0.761	-0.0217	-0.29	0.723	-0.0168	-0.23	-0.3683	-0.9925	1968353	Cerep_003074	COCc1nc2ccccc2c3C(=O)N(NC(=O)C4CCCNC4=O)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J17	compound treatment	0.779	-0.00367	-0.05	0.731	-0.00875	-0.12	-0.1194	-0.9242	1968354	Cerep_003075	[O-][N+](=O)c1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)C(c4ccccc4)c5ccc(Cl)cc5)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J18	compound treatment	0.759	-0.0237	-0.32	0.704	-0.0358	-0.49	-0.5706	-0.979	1968355	Cerep_003076	CCc1nc2ccccc2c3C(=O)N(NC(=O)c4cc(n[nH]4)C(C)(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J19	compound treatment	0.798	0.0153	0.21	0.762	0.0222	0.3	0.3607	0.9825	1968356	Cerep_003077	CC(C)(C)OC(=O)N(CCOC(=O)N1CCN(CC1)c2nccnc2C#N)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J20	compound treatment	0.789	0.00633	0.09	0.699	-0.0408	-0.56	-0.3326	-0.5916	1968357	Cerep_003078	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccccc4C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J21	compound treatment	0.801	0.0183	0.25	0.756	0.0162	0.22	0.3315	0.9985	1968358	Cerep_003079	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3c(F)ccc(F)c3F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	J22	compound treatment	0.764	-0.0187	-0.25	0.744	0.00425	0.06	-0.1372	-0.5307	1968359	Cerep_003080	COCc1nc2ccccc2c3C(=O)N(CCc4c[nH]c5ccccc45)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K03	compound treatment	0.812	0.0293	0.4	0.753	0.0132	0.18	0.4075	0.9369	1968360	Cerep_003081	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K04	compound treatment	0.802	0.0193	0.26	0.767	0.0272	0.37	0.4471	0.985	1968361	Cerep_003082	COCCCCOC(=O)NNC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K05	compound treatment	0.778	-0.00467	-0.06	0.746	0.00625	0.09	0.0157	0.1477	1968362	Cerep_003083	COc1ccccc1CNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K06	compound treatment	0.799	0.0163	0.22	0.751	0.0112	0.15	0.2642	0.9844	1968363	Cerep_003084	COc1cccc(CCOC(=O)NCCc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K07	compound treatment	0.778	-0.00467	-0.06	0.772	0.0322	0.44	0.2664	0.5996	1968364	Cerep_003085	COc1ccc(CCNC(=O)OCCCCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K08	compound treatment	0.802	0.0193	0.26	0.708	-0.0318	-0.43	-0.1218	-0.241	1968365	Cerep_003086	O=C(NC1CCN(Cc2ccccc2)C1)OCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K09	compound treatment	0.762	-0.0207	-0.28	0.765	0.0252	0.34	0.0462	0.1043	1968366	Cerep_003087	Fc1ccc(/C=C/C(=O)NNC(=O)OCC2(CC3CC4CC(C3)C2)C4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K10	compound treatment	0.81	0.0273	0.37	0.755	0.0152	0.21	0.4077	0.9633	1968367	Cerep_003088	Cc1ccc(CCOC(=O)NC(CC(=O)N)C(=O)OC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K11	compound treatment	0.771	-0.0117	-0.16	0.73	-0.00975	-0.13	-0.2054	-0.9965	1968368	Cerep_003089	CN(C)c1ccc(CCOC(=O)N2CCC(O)(Cc3ccccc3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K12	compound treatment	0.79	0.00733	0.1	0.723	-0.0168	-0.23	-0.0916	-0.3682	1968369	Cerep_003090	FC(F)(F)Oc1ccccc1COC(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K13	compound treatment	0.772	-0.0107	-0.14	0.732	-0.00775	-0.11	-0.1766	-0.9885	1968370	Cerep_003091	O=C(NNC(=O)/C=C/c1ccco1)OCC2CCCN2Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K14	compound treatment	0.779	-0.00367	-0.05	0.733	-0.00675	-0.09	-0.1002	-0.9578	1968371	Cerep_003092	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3csc(C)n3)CC2)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K15	compound treatment	0.767	-0.0157	-0.21	0.761	0.0212	0.29	0.0554	0.1543	1968372	Cerep_003093	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCN4CCN(Cc5cc6ccccc6o5)CC4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K16	compound treatment	0.812	0.0293	0.4	0.806	0.0662	0.9	0.9185	0.9314	1968373	Cerep_003094	COc1cc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K17	compound treatment	0.774	-0.00867	-0.12	0.706	-0.0338	-0.46	-0.4082	-0.8595	1968374	Cerep_003095	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K18	compound treatment	0.792	0.00933	0.13	0.72	-0.0198	-0.27	-0.1015	-0.3414	1968375	Cerep_003096	Brc1ccc(CCOC(=O)N2CCC(CC2)N3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K19	compound treatment	0.801	0.0183	0.25	0.758	0.0182	0.25	0.3508	1.0	1968376	Cerep_003097	COc1ccccc1CCOC(=O)N2CCC(CC2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K20	compound treatment	0.795	0.0123	0.17	0.722	-0.0178	-0.24	-0.0536	-0.1825	1968377	Cerep_003098	CCN(CCOC(=O)N1CCN(CC1)c2ccccn2)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K21	compound treatment	0.778	-0.00467	-0.06	0.747	0.00725	0.1	0.0253	0.2158	1968378	Cerep_003099	Clc1ccccc1CCNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	K22	compound treatment	0.799	0.0163	0.22	0.74	2.48E-4	0.0	0.1581	0.7179	1968379	Cerep_003100	Cc1nnsc1C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L03	compound treatment	0.804	0.0213	0.29	0.746	0.00625	0.09	0.2637	0.8788	1968380	Cerep_003101	COc1ccc(cc1)C(=O)NNC(=O)OCC(C)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L04	compound treatment	0.775	-0.00767	-0.1	0.726	-0.0138	-0.19	-0.2058	-0.9608	1968381	Cerep_003102	CC(C)c1nc2ccccc2c3C(=O)N(NC(=O)c4ccccc4CCc5ccccc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L05	compound treatment	0.783	3.26E-4	0.0	0.727	-0.0128	-0.17	-0.1199	-0.689	1968382	Cerep_003103	Clc1ncn(Cc2nc(cs2)C(=O)NNC(=O)OCc3cccc(OCc4ccccc4)c3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L06	compound treatment	0.756	-0.0267	-0.36	0.723	-0.0168	-0.23	-0.416	-0.9759	1968383	Cerep_003104	COc1ccc(OCCN2C(=O)c3c(C2=O)c4ccccc4nc3C(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L07	compound treatment	0.772	-0.0107	-0.14	0.728	-0.0118	-0.16	-0.2151	-0.9986	1968384	Cerep_003105	Clc1ccc2nc(sc2c1)N3CCCN(CC3)C(=O)OC/C=C/COCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L08	compound treatment	0.766	-0.0167	-0.22	0.709	-0.0308	-0.42	-0.4556	-0.9574	1968385	Cerep_003106	CCc1nc2ccccc2c3C(=O)N(CCN4CCCC4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L09	compound treatment	0.77	-0.0127	-0.17	0.731	-0.00875	-0.12	-0.2053	-0.9846	1968386	Cerep_003107	COc1cc(OC)c(CNC(=O)OCCN2CCN(Cc3cc4OCOc4c(OC)c3)CC2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L10	compound treatment	0.756	-0.0267	-0.36	0.727	-0.0128	-0.17	-0.3774	-0.9443	1968387	Cerep_003108	CSc1ncc(C(=O)NN2C(=O)C3C(C4CCC3C=C4)C2=O)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L11	compound treatment	0.785	0.00233	0.03	0.743	0.00325	0.04	0.0535	0.9858	1968388	Cerep_003109	Cc1cccc(CCOC(=O)NCCN2CCOCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L12	compound treatment	0.753	-0.0297	-0.4	0.719	-0.0208	-0.28	-0.4832	-0.9856	1968389	Cerep_003110	CCCc1nc2ccccc2c3C(=O)N(C4CCN(Cc5ccc6n(CC)c7ccccc7c6c5)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L13	compound treatment	0.797	0.0143	0.19	0.754	0.0142	0.19	0.274	1.0	1968390	Cerep_003111	O=C(NNC(=O)c1cc(nc2ccccc12)c3ccccc3)OCc4cccc(Oc5ccccc5)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L14	compound treatment	0.773	-0.00967	-0.13	0.716	-0.0238	-0.32	-0.3213	-0.9201	1968391	Cerep_003112	Cc1nc2ccc(Br)cc2c3C(=O)N(Cc4ccccn4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L15	compound treatment	0.785	0.00233	0.03	0.733	-0.00675	-0.09	-0.0429	-0.4412	1968392	Cerep_003113	Cc1cc(C)c(CCOC(=O)NNC(=O)c2cc(n[nH]2)C(C)(C)C)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L16	compound treatment	0.752	-0.0307	-0.41	0.715	-0.0248	-0.34	-0.5313	-0.9949	1968393	Cerep_003114	COCc1nc2ccccc2c3C(=O)N(NC(=O)c4csc(C)n4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L17	compound treatment	0.767	-0.0157	-0.21	0.739	-7.52E-4	-0.01	-0.1568	-0.7405	1968394	Cerep_003115	O=C(OCCOc1ccc2ccccc2c1)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L18	compound treatment	0.738	-0.0447	-0.6	0.715	-0.0248	-0.34	-0.6648	-0.9625	1968395	Cerep_003116	Cc1nc2ccc(Cl)cc2c3C(=O)N(CCc4ccccn4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L19	compound treatment	0.787	0.00433	0.06	0.712	-0.0278	-0.38	-0.2263	-0.5911	1968396	Cerep_003117	ClCCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L20	compound treatment	0.771	-0.0117	-0.16	0.745	0.00525	0.07	-0.0608	-0.3513	1968397	Cerep_003118	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4cccc(OCC)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L21	compound treatment	0.814	0.0313	0.42	0.754	0.0142	0.19	0.4362	0.9378	1968398	Cerep_003119	Oc1ccc2[nH]cc(CCNC(=O)OCc3ccc(OC(F)F)cc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	L22	compound treatment	0.779	-0.00367	-0.05	0.722	-0.0178	-0.24	-0.2062	-0.8346	1968399	Cerep_003120	CCN1CCCC1CN2C(=O)c3c(C2=O)c4ccccc4nc3COC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M03	compound treatment	0.785	0.00233	0.03	0.748	0.00825	0.11	0.1017	0.8711	1968400	Cerep_003121	COc1ccc(CN2CCN(CC2)C(=O)OCC3CCN(O)CC3)cc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M04	compound treatment	0.837	0.0543	0.73	0.76	0.0202	0.28	0.7135	0.911	1968401	Cerep_003122	Cc1csc(C(=O)NNC(=O)OCC#Cc2ccccc2)c1n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M05	compound treatment	0.789	0.00633	0.09	0.754	0.0142	0.19	0.1977	0.9318	1968402	Cerep_003123	COc1ccccc1CCOC(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M06	compound treatment	0.785	0.00233	0.03	0.737	-0.00275	-0.04	-0.0044	-0.0889	1968403	Cerep_003124	Cc1cccc(CCOC(=O)NNC(=O)c2cccn2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M07	compound treatment	0.786	0.00333	0.04	0.77	0.0302	0.41	0.3234	0.7794	1968404	Cerep_003125	O=C(NC(CSCc1ccccc1)C(=O)Nc2ccc3ccccc3c2)OCCCCCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M08	compound treatment	0.792	0.00933	0.13	0.793	0.0532	0.73	0.6024	0.8174	1968405	Cerep_003126	Cc1cccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M09	compound treatment	0.759	-0.0237	-0.32	0.75	0.0102	0.14	-0.127	-0.3644	1968406	Cerep_003127	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCc3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M10	compound treatment	0.808	0.0253	0.34	0.747	0.00725	0.1	0.3115	0.8757	1968407	Cerep_003128	CC(CCOC(=O)NNC(=O)c1cc(C)n[nH]1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M11	compound treatment	0.778	-0.00467	-0.06	0.747	0.00725	0.1	0.0253	0.2158	1968408	Cerep_003129	CC1(C)OC2COC3(COC(=O)N4CCC(CC4)C(O)(c5ccccc5)c6ccccc6)OC(C)(C)OC3C2O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M12	compound treatment	0.784	0.00133	0.02	0.748	0.00825	0.11	0.0922	0.8094	1968409	Cerep_003130	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCCN3CCN(CC3)c4ccc(cn4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M13	compound treatment	0.759	-0.0237	-0.32	0.756	0.0162	0.22	-0.0692	-0.1779	1968410	Cerep_003131	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCCN3CCN(CCCN4c5ccccc5Sc6ccc(cc46)C(F)(F)F)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M14	compound treatment	0.82	0.0373	0.5	0.771	0.0312	0.43	0.6574	0.9965	1968411	Cerep_003132	CC(C)(C)Sc1ccccc1CN2CCN(CCOC(=O)NCc3ccc(cc3)c4csnn4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M15	compound treatment	0.731	-0.0517	-0.7	0.739	-7.52E-4	-0.01	-0.5002	-0.7174	1968412	Cerep_003133	COc1ccc(F)c(CN2CCCC(COC(=O)N3CCN(CC3)c4sc(cc4[N+](=O)[O-])S(=O)(=O)N)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M16	compound treatment	0.799	0.0163	0.22	0.721	-0.0188	-0.26	-0.0251	-0.0743	1968413	Cerep_003134	CCc1ccc(COC(=O)N2CCN(Cc3c(OC)cc(OC)cc3OC)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M17	compound treatment	0.79	0.00733	0.1	0.755	0.0152	0.21	0.2169	0.9422	1968414	Cerep_003135	Oc1ccc2[nH]cc(CCNC(=O)OCc3cccc(OC(F)(F)F)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M18	compound treatment	0.79	0.00733	0.1	0.739	-7.52E-4	-0.01	0.0626	0.6303	1968415	Cerep_003136	OC1CCN(C1)C(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M19	compound treatment	0.782	-6.74E-4	-0.01	0.741	0.00125	0.02	0.0056	0.2903	1968416	Cerep_003137	CC(C)(C)OC(=O)NC1CCN(C1)C(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M20	compound treatment	0.789	0.00633	0.09	0.73	-0.00975	-0.13	-0.0337	-0.2132	1968417	Cerep_003138	O=C(OCc1ccc(/C=C/c2ccccc2)cc1)N3CCN(CC3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M21	compound treatment	0.788	0.00533	0.07	0.765	0.0252	0.34	0.2943	0.8367	1968418	Cerep_003139	Cc1nn(c(C)c1CN2CCC(C2)NC(=O)OCCCCc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	M22	compound treatment	0.802	0.0193	0.26	0.755	0.0152	0.21	0.3314	0.9937	1968419	Cerep_003140	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc(cc4OC)N(C)C)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N03	compound treatment	0.803	0.0203	0.27	0.739	-7.52E-4	-0.01	0.1866	0.6802	1968420	Cerep_003141	CC(C(=O)NNC(=O)OCCc1ccccc1Br)n2nnc(n2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N04	compound treatment	0.797	0.0143	0.19	0.742	0.00225	0.03	0.1583	0.8091	1968421	Cerep_003142	CC(C)c1nc2ccccc2c3C(=O)N(C(CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N05	compound treatment	0.808	0.0253	0.34	0.758	0.0182	0.25	0.4175	0.9879	1968422	Cerep_003143	Fc1cccc(F)c1COC(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N06	compound treatment	0.782	-6.74E-4	-0.01	0.739	-7.52E-4	-0.01	-0.0137	-0.9982	1968423	Cerep_003144	CC(C)c1nc2ccccc2c3C(=O)N(CC(=O)Nc4ccc5ccccc5c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N07	compound treatment	0.767	-0.0157	-0.21	0.799	0.0592	0.81	0.4218	0.505	1968424	Cerep_003145	COc1cc(Br)c(CN2CCN(CC2)C(=O)OCCc3ccccc3C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N08	compound treatment	0.756	-0.0267	-0.36	0.746	0.00625	0.09	-0.1942	-0.5252	1968425	Cerep_003146	CCc1nc2ccccc2c3C(=O)N(CC(O)c4ccccc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N09	compound treatment	0.794	0.0113	0.15	0.763	0.0232	0.32	0.3322	0.944	1968426	Cerep_003147	COc1cc(CN2CCN(CCOC(=O)N3CCCC3C(=O)OCc4ccccc4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N10	compound treatment	0.774	-0.00867	-0.12	0.708	-0.0318	-0.43	-0.3889	-0.8671	1968427	Cerep_003148	CCc1nc2ccccc2c3C(=O)N(CCCN(C)c4ccccc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N11	compound treatment	0.792	0.00933	0.13	0.767	0.0272	0.37	0.3517	0.8965	1968428	Cerep_003149	Cn1cccc1C(=O)NNC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N12	compound treatment	0.773	-0.00967	-0.13	0.736	-0.00375	-0.05	-0.1285	-0.9164	1968429	Cerep_003150	CCCc1nc2ccccc2c3C(=O)N(NC(=O)/C=C/c4ccc(F)cc4Cl)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N13	compound treatment	0.808	0.0253	0.34	0.724	-0.0158	-0.21	0.0897	0.2223	1968430	Cerep_003151	Cc1nc(sc1C(=O)NNC(=O)OCc2ccc3OCOc3c2)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N14	compound treatment	0.827	0.0443	0.6	0.75	0.0102	0.14	0.5217	0.8495	1968431	Cerep_003152	Cc1nc2ccc(Br)cc2c3C(=O)N(NC(=O)/C=C/c4ccc(F)cc4Cl)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N15	compound treatment	0.745	-0.0377	-0.51	0.752	0.0122	0.17	-0.2413	-0.451	1968432	Cerep_003153	COCCCCOC(=O)N1CCN(Cc2cc(OC)c(OC)cc2Br)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N16	compound treatment	0.787	0.00433	0.06	0.728	-0.0118	-0.16	-0.0721	-0.4225	1968433	Cerep_003154	COCc1nc2ccc(Br)cc2c3C(=O)N(NC(=O)c4cc(OC)c5ccccc5n4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N17	compound treatment	0.799	0.0163	0.22	0.718	-0.0218	-0.3	-0.054	-0.1462	1968434	Cerep_003155	Cn1c(=O)n(C)c2ncn(CCOC(=O)NNC(=O)/C=C/c3ccco3)c2c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N18	compound treatment	0.77	-0.0127	-0.17	0.714	-0.0258	-0.35	-0.3692	-0.9453	1968435	Cerep_003156	Cc1nc2ccc(Cl)cc2c3C(=O)N(Cc4cccnc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N19	compound treatment	0.767	-0.0157	-0.21	0.711	-0.0288	-0.39	-0.4268	-0.958	1968436	Cerep_003157	CCN1CCCC1CNC(=O)OCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N20	compound treatment	0.76	-0.0227	-0.31	0.742	0.00225	0.03	-0.1946	-0.6331	1968437	Cerep_003158	CCCc1nc2ccccc2c3C(=O)N(NC(=O)C(C)Oc4ccc(OC(F)(F)F)cc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N21	compound treatment	0.791	0.00833	0.11	0.755	0.0152	0.21	0.2264	0.9582	1968438	Cerep_003159	Clc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	N22	compound treatment	0.766	-0.0167	-0.22	0.734	-0.00575	-0.08	-0.2145	-0.9005	1968439	Cerep_003160	COCc1nc2ccccc2c3C(=O)N(NC(=O)c4ccccc4CCc5ccccc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O03	compound treatment	0.789	0.00633	0.09	0.743	0.00325	0.04	0.0917	0.9533	1968440	Cerep_003161	COc1ccc(CN2CCN(CC2)C(=O)OCc3ccc(cc3)[N+](=O)[O-])cc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O04	compound treatment	0.784	0.00133	0.02	0.756	0.0162	0.22	0.1693	0.7617	1968441	Cerep_003162	CCOc1cccc(c1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O05	compound treatment	0.795	0.0123	0.17	0.758	0.0182	0.25	0.2935	0.9808	1968442	Cerep_003163	COc1cccc(CCOC(=O)NNC(=O)C2CN(C)CCN2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O06	compound treatment	0.807	0.0243	0.33	0.756	0.0162	0.22	0.3887	0.9817	1968443	Cerep_003164	Cc1nc(sc1C(=O)NNC(=O)OCc2ccccc2OC(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O07	compound treatment	0.794	0.0113	0.15	0.759	0.0192	0.26	0.2936	0.9668	1968444	Cerep_003165	COc1cc(CCNC(=O)OCc2ccc(cc2)C(C)(C)C)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O08	compound treatment	0.805	0.0223	0.3	0.749	0.00925	0.13	0.3021	0.9253	1968445	Cerep_003166	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(Cc5c(C)nn(c5C)c6ccccc6)CC4)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O09	compound treatment	0.868	0.0853	1.15	0.797	0.0572	0.78	1.366	0.9821	1968446	Cerep_003167	COc1ccc(CC(=O)NNC(=O)OCC(CC=C(C)C)C(=C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O10	compound treatment	0.787	0.00433	0.06	0.732	-0.00775	-0.11	-0.0335	-0.2773	1968447	Cerep_003168	[O-][N+](=O)c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)OCCCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O11	compound treatment	0.791	0.00833	0.11	0.759	0.0192	0.26	0.265	0.9283	1968448	Cerep_003169	CC1(C)C2CC1C(=CC2)CCOC(=O)N3CCC(O)(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O12	compound treatment	0.828	0.0453	0.61	0.772	0.0322	0.44	0.7433	0.9869	1968449	Cerep_003170	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O13	compound treatment	0.724	-0.0587	-0.79	0.731	-0.00875	-0.12	-0.6441	-0.8046	1968450	Cerep_003171	COc1ccc2ccccc2c1CN3CCCCC3COC(=O)N4CCN(CC4)c5cccc6[nH]ccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O14	compound treatment	0.836	0.0533	0.72	0.762	0.0222	0.3	0.7232	0.9263	1968451	Cerep_003172	O=C(OCCN1CCN(Cc2cc3ccccc3o2)CC1)N4CCN(CC4)c5nc(ns5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O15	compound treatment	0.79	0.00733	0.1	0.75	0.0102	0.14	0.1687	0.9856	1968452	Cerep_003173	COc1cc(OC)c(CNC(=O)OCc2cccc(OCc3ccccc3)c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O16	compound treatment	0.81	0.0273	0.37	0.746	0.00625	0.09	0.3209	0.8482	1968453	Cerep_003174	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3ccc(Cl)cc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O17	compound treatment	0.761	-0.0217	-0.29	0.727	-0.0128	-0.17	-0.3297	-0.9692	1968454	Cerep_003175	Fc1c(F)c(ccc1COC(=O)N2CCN(Cc3ccc(Oc4ccccc4)cc3)CC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O18	compound treatment	0.775	-0.00767	-0.1	0.736	-0.00375	-0.05	-0.1094	-0.9472	1968455	Cerep_003176	CCOC(=O)N1CCN(CC1)C(=O)OCCc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O19	compound treatment	0.784	0.00133	0.02	0.75	0.0102	0.14	0.1115	0.7912	1968456	Cerep_003177	COc1cccc(CCOC(=O)NNC(=O)c2csc(n2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O20	compound treatment	0.791	0.00833	0.11	0.732	-0.00775	-0.11	0.0047	0.0303	1968457	Cerep_003178	CCCOCCOC(=O)NNC(=O)CC1Sc2ccccc2NC1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O21	compound treatment	0.788	0.00533	0.07	0.76	0.0202	0.28	0.246	0.8624	1968458	Cerep_003179	Cc1ccccc1N2CCN(CC2)C(=O)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	O22	compound treatment	0.83	0.0473	0.64	0.765	0.0252	0.34	0.6949	0.958	1968459	Cerep_003180	Fc1ccc(C(=O)N2CCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P03	compound treatment	0.79	0.00733	0.1	0.764	0.0242	0.33	0.3037	0.88	1968460	Cerep_003181	CC(COC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P04	compound treatment	0.756	-0.0267	-0.36	0.732	-0.00775	-0.11	-0.3292	-0.8777	1968461	Cerep_003182	CC(C)c1nc2ccccc2c3C(=O)N(CCN4CCOCC4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P05	compound treatment	0.756	-0.0267	-0.36	0.713	-0.0268	-0.36	-0.5124	-1.0	1968462	Cerep_003183	CCOc1ccccc1COC(=O)N2CCN(C(C)C2)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P06	compound treatment	0.736	-0.0467	-0.63	0.716	-0.0238	-0.32	-0.6743	-0.9522	1968463	Cerep_003184	COc1cc(CCN2C(=O)c3c(C2=O)c4ccccc4nc3C(C)C)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P07	compound treatment	0.772	-0.0107	-0.14	0.734	-0.00575	-0.08	-0.1573	-0.9592	1968464	Cerep_003185	CCC/C=C/COC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P08	compound treatment	0.743	-0.0397	-0.54	0.725	-0.0148	-0.2	-0.5207	-0.9107	1968465	Cerep_003186	CCc1nc2ccccc2c3C(=O)N(CCc4ccc(O)cc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P09	compound treatment	0.696	-0.0867	-1.17	0.694	-0.0458	-0.62	-1.268	-0.9567	1968466	Cerep_003187	CC(C)Oc1ccc(CN2CCN(CCOC(=O)NCc3csc4ccccc34)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P10	compound treatment	0.13	-0.653	-8.8	0.096	-0.644	-8.78	-12.4334	-1.0	1968467	Cerep_003188	CCc1nc2ccccc2c3C(=O)N(Cc4ccncc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P11	compound treatment	0.745	-0.0377	-0.51	0.732	-0.00775	-0.11	-0.4341	-0.8363	1968468	Cerep_003189	CCOC(=O)N1CCN(CC1)C(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P12	compound treatment	0.739	-0.0437	-0.59	0.725	-0.0148	-0.2	-0.5589	-0.8977	1968469	Cerep_003190	CCCc1nc2ccccc2c3C(=O)N(C4CCN(Cc5ccccc5Sc6ccc(Cl)cc6)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P13	compound treatment	0.769	-0.0137	-0.18	0.76	0.0202	0.28	0.0648	0.1951	1968470	Cerep_003191	O=C(OCc1ccc(/C=C/c2ccccc2)cc1)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P14	compound treatment	0.764	-0.0187	-0.25	0.721	-0.0188	-0.26	-0.359	-1.0	1968471	Cerep_003192	Cc1nc2ccc(Br)cc2c3C(=O)N(C4CCN(Cc5ccccc5Sc6ccc(Cl)cc6)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P15	compound treatment	0.776	-0.00667	-0.09	0.725	-0.0148	-0.2	-0.2059	-0.9343	1968472	Cerep_003193	CCCOCCOC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P16	compound treatment	0.757	-0.0257	-0.35	0.717	-0.0228	-0.31	-0.4643	-0.9985	1968473	Cerep_003194	CCOc1ccc(cc1)C(=O)NN2C(=O)c3c(C2=O)c4ccccc4nc3CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P17	compound treatment	0.782	-6.74E-4	-0.01	0.754	0.0142	0.19	0.131	0.6733	1968474	Cerep_003195	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P18	compound treatment	0.767	-0.0157	-0.21	0.713	-0.0268	-0.36	-0.4075	-0.9664	1968475	Cerep_003196	CCCc1nc2ccccc2c3C(=O)N(C4CCN(Cc5c(C)nn(c5C)c6ccccc6)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P19	compound treatment	0.789	0.00633	0.09	0.727	-0.0128	-0.17	-0.0626	-0.3233	1968476	Cerep_003197	Oc1ccc(CCNC(=O)OCc2c(F)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P20	compound treatment	0.766	-0.0167	-0.22	0.711	-0.0288	-0.39	-0.4363	-0.9652	1968477	Cerep_003198	CCCc1nc2ccccc2c3C(=O)N(NC(=O)c4onc(c4C(=O)OC)c5c(Cl)cccc5Cl)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P21	compound treatment	0.772	-0.0107	-0.14	0.746	0.00625	0.09	-0.0416	-0.2485	1968478	Cerep_003199	CC(C)(C)c1ccc(COC(=O)NCCOc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.535	P22	compound treatment	0.753	-0.0297	-0.4	0.748	0.00825	0.11	-0.2035	-0.4895	1968479	Cerep_003200	COCc1nc2ccc(Br)cc2c3C(=O)N(NC(=O)C(Cc4ccccc4)NC(=O)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A03	compound treatment	0.817	0.0334	0.45	0.751	0.015	0.2	0.4635	0.9364	1968480	Cerep_003201	CSc1sc(cc1S(=O)(=O)C(C)C)C(=O)NN2C(=O)c3c(C2=O)c4cc(C)ccc4nc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A04	compound treatment	0.821	0.0374	0.5	0.744	0.00803	0.11	0.4342	0.841	1968481	Cerep_003202	Cc1sc(nc1CC(=O)NNC(=O)c2ccccc2OC(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A05	compound treatment	0.79	0.0064	0.09	0.738	0.00203	0.03	0.0806	0.8894	1968482	Cerep_003203	COCc1nc2ccc(C)cc2c3C(=O)N(NC(=O)C4(CCC4)c5ccc(Cl)cc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A06	compound treatment	0.82	0.0364	0.49	0.735	-9.69E-4	-0.01	0.3379	0.6878	1968483	Cerep_003204	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)CC(CC(=O)C3CC3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A07	compound treatment	0.835	0.0514	0.69	0.762	0.026	0.35	0.7413	0.9516	1968484	Cerep_003205	CCCCC/C=C/CC1CC(=O)N(C2CCN(Cc3ccc4n(CC)c5ccccc5c4c3)C2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A08	compound treatment	0.822	0.0384	0.52	0.747	0.011	0.15	0.4727	0.8762	1968485	Cerep_003206	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NCC(O)c3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A09	compound treatment	0.779	-0.0046	-0.06	0.716	-0.02	-0.27	-0.2364	-0.8466	1968486	Cerep_003207	O=C(NN1C(=O)C2C3CC(C=C3)C2C1=O)c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A10	compound treatment	0.794	0.0104	0.14	0.736	3.13E-5	0.0	0.0995	0.7093	1968487	Cerep_003208	Cc1sc(nc1CC(=O)NNC(=O)c2ccco2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A11	compound treatment	0.812	0.0284	0.38	0.72	-0.016	-0.22	0.1169	0.2653	1968488	Cerep_003209	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(CCN4CCCCCC4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A12	compound treatment	0.799	0.0154	0.21	0.746	0.01	0.14	0.2436	0.9795	1968489	Cerep_003210	Brc1ccc(cc1)C(CC(=O)C2CC2)CC(=O)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A13	compound treatment	0.77	-0.0136	-0.18	0.694	-0.042	-0.57	-0.5344	-0.8892	1968490	Cerep_003211	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(CCCN4CCCCC4C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A14	compound treatment	0.77	-0.0136	-0.18	0.689	-0.047	-0.64	-0.5826	-0.8745	1673105	Cerep_003212	COc1ccccc1C(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A15	compound treatment	0.779	-0.0046	-0.06	0.705	-0.031	-0.42	-0.3425	-0.8024	1968491	Cerep_003213	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccnc(Cl)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A16	compound treatment	0.811	0.0274	0.37	0.719	-0.017	-0.23	0.0977	0.2241	1968492	Cerep_003214	FC(F)(F)c1ccc(SCc2ccc(o2)C(=O)N3CCN(Cc4ccc(OCC=C)cc4)CC3)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A17	compound treatment	0.788	0.0044	0.06	0.715	-0.021	-0.29	-0.1602	-0.5487	1968493	Cerep_003215	O=C(CCc1c[nH]c2ccccc12)NCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A18	compound treatment	0.799	0.0154	0.21	0.725	-0.011	-0.15	0.0411	0.1607	1968494	Cerep_003216	Clc1ccc(CNC(=O)CC(CC(=O)C2CC2)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A19	compound treatment	0.805	0.0214	0.29	0.717	-0.019	-0.26	0.0212	0.0547	1968495	Cerep_003217	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)c3ccsc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A20	compound treatment	0.812	0.0284	0.38	0.718	-0.018	-0.25	0.0976	0.2147	1968496	Cerep_003218	[O-][N+](=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)NNC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A21	compound treatment	0.795	0.0114	0.15	0.724	-0.012	-0.16	-0.0067	-0.0298	1968497	Cerep_003219	CCc1ccc(cc1)c2ccc(cc2)C(=O)NCc3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	A22	compound treatment	0.797	0.0134	0.18	0.715	-0.021	-0.29	-0.0744	-0.2199	1968498	Cerep_003220	NC(=O)C1CCN(CC1)C(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B03	compound treatment	0.814	0.0304	0.41	0.758	0.022	0.3	0.5024	0.9883	1968499	Cerep_003221	CN(Cc1cccnc1)C(=O)CC(CC(=O)C2CC2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B04	compound treatment	0.757	-0.0266	-0.36	0.725	-0.011	-0.15	-0.3595	-0.9247	1968500	Cerep_003222	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(F)cc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B05	compound treatment	0.794	0.0104	0.14	0.771	0.035	0.48	0.437	0.8777	1968501	Cerep_003223	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)CCC=C)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B06	compound treatment	0.774	-0.0096	-0.13	0.721	-0.015	-0.2	-0.2359	-0.9759	1968502	Cerep_003224	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccccc2OCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B07	compound treatment	0.794	0.0104	0.14	0.718	-0.018	-0.25	-0.0741	-0.2623	1968503	Cerep_003225	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NC(Cc3ccc(OC(C)(C)C)cc3)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B08	compound treatment	0.756	-0.0276	-0.37	0.717	-0.019	-0.26	-0.4462	-0.9842	1968504	Cerep_003226	OC(=O)COc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B09	compound treatment	0.8	0.0164	0.22	0.739	0.00303	0.04	0.1857	0.825	1968505	Cerep_003227	Cc1noc(c1C(=O)NNC(=O)CCCCCNC(=O)OCc2ccccc2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B10	compound treatment	0.797	0.0134	0.18	0.727	-0.00897	-0.12	0.0413	0.1894	1968506	Cerep_003228	Cc1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B11	compound treatment	0.77	-0.0136	-0.18	0.746	0.01	0.14	-0.033	-0.1443	1968507	Cerep_003229	CCOc1ccccc1C(=O)NNC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B12	compound treatment	0.763	-0.0206	-0.28	0.707	-0.029	-0.4	-0.4759	-0.9852	1968508	Cerep_003230	Fc1cc(F)cc(/C=N/NC(=O)c2ccccc2Oc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B13	compound treatment	0.764	-0.0196	-0.26	0.724	-0.012	-0.16	-0.3024	-0.9731	1968509	Cerep_003231	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)CC(c3ccccc3)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B14	compound treatment	0.758	-0.0256	-0.35	0.696	-0.04	-0.55	-0.6296	-0.9758	1968510	Cerep_003232	OC(=O)COc1ccccc1/C=N/NC(=O)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B15	compound treatment	0.762	-0.0216	-0.29	0.737	0.00103	0.01	-0.1961	-0.6722	1968511	Cerep_003233	COc1cccc(CN2CCC(C2)NC(=O)CCc3ccc4OCOc4c3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B16	compound treatment	0.789	0.0054	0.07	0.708	-0.028	-0.38	-0.2182	-0.5619	1968512	Cerep_003234	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(OCC(=O)O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B17	compound treatment	0.796	0.0124	0.17	0.748	0.012	0.16	0.2343	1.0	1968513	Cerep_003235	Cc1cc(nn1C)C(=O)NCC(=O)NNC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B18	compound treatment	0.755	-0.0286	-0.39	0.676	-0.06	-0.82	-0.8511	-0.9412	1968514	Cerep_003236	Cc1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B19	compound treatment	0.79	0.0064	0.09	0.735	-9.69E-4	-0.01	0.0517	0.592	1968515	Cerep_003237	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)Cc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B20	compound treatment	0.78	-0.0036	-0.05	0.706	-0.03	-0.41	-0.3233	-0.7856	1968516	Cerep_003238	Fc1cc(F)cc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B21	compound treatment	0.77	-0.0136	-0.18	0.717	-0.019	-0.26	-0.3127	-0.9859	1968517	Cerep_003239	Fc1ccc(cc1)C(=O)CCC(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	B22	compound treatment	0.746	-0.0376	-0.51	0.674	-0.062	-0.85	-0.9562	-0.9702	1968518	Cerep_003240	OC(=O)COc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C03	compound treatment	0.777	-0.0066	-0.09	0.758	0.022	0.3	0.1495	0.477	1968519	Cerep_003241	CC(C)c1nc2ccc(F)cc2c3C(=O)N(CCc4ccccn4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C04	compound treatment	0.815	0.0314	0.42	0.745	0.00903	0.12	0.3866	0.8764	1968520	Cerep_003242	C=CCOc1ccc(CN2CCN(CC2)C(=O)CNC(=O)c3cccnc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C05	compound treatment	0.795	0.0114	0.15	0.732	-0.00397	-0.05	0.0705	0.4323	1968521	Cerep_003243	COCc1nc2ccc(C)cc2c3C(=O)N(Cc4ccc(C)o4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C06	compound treatment	0.791	0.0074	0.1	0.759	0.023	0.31	0.2927	0.8881	1968522	Cerep_003244	Cc1oc(nc1CC(=O)NC(CCCNC(=O)OCc2ccccc2)C(=O)OC(C)(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C07	compound treatment	0.778	-0.0056	-0.08	0.746	0.01	0.14	0.0433	0.277	1968523	Cerep_003245	CCCCC/C=C/CC1CC(=O)N(NC(=O)/C=C/c2ccc(F)cc2Cl)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C08	compound treatment	0.799	0.0154	0.21	0.754	0.018	0.25	0.3208	0.9965	1968524	Cerep_003246	COc1ccccc1C(=O)NC(C(=O)OC(C)(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C09	compound treatment	0.774	-0.0096	-0.13	0.725	-0.011	-0.15	-0.1974	-0.9974	1968525	Cerep_003247	O=C(NN1C(=O)C2C(C3CCC2C=C3)C1=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C10	compound treatment	0.769	-0.0146	-0.2	0.732	-0.00397	-0.05	-0.1776	-0.8692	1968526	Cerep_003248	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)CNC(=O)c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C11	compound treatment	0.762	-0.0216	-0.29	0.752	0.016	0.22	-0.0515	-0.1413	1968527	Cerep_003249	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccco4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C12	compound treatment	0.814	0.0304	0.41	0.743	0.00703	0.1	0.3578	0.8495	1968528	Cerep_003250	Cc1oc(nc1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C13	compound treatment	0.73	-0.0536	-0.72	0.724	-0.012	-0.16	-0.6267	-0.8454	1968529	Cerep_003251	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4sc(nc4C)c5ccccc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C14	compound treatment	0.771	-0.0126	-0.17	0.727	-0.00897	-0.12	-0.2067	-0.9869	1968530	Cerep_003252	FC(F)(F)Oc1cccc(CNC(=O)c2cc(nc3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C15	compound treatment	0.77	-0.0136	-0.18	0.714	-0.022	-0.3	-0.3416	-0.9723	1968531	Cerep_003253	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccc(Cl)nc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C16	compound treatment	0.781	-0.0026	-0.04	0.758	0.022	0.3	0.1876	0.6203	1968532	Cerep_003254	Cn1c(CCC(=O)NC2CCCCC2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C17	compound treatment	0.774	-0.0096	-0.13	0.739	0.00303	0.04	-0.0624	-0.4587	1968533	Cerep_003255	Clc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C18	compound treatment	0.805	0.0214	0.29	0.75	0.014	0.19	0.3394	0.9801	1968534	Cerep_003256	COC(=O)C(Cc1ccc(Cl)cc1)NC(=O)Cc2nc(oc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C19	compound treatment	0.788	0.0044	0.06	0.718	-0.018	-0.25	-0.1313	-0.5208	1968535	Cerep_003257	C=CCOc1ccc(CN2CCN(CC2)C(=O)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C20	compound treatment	0.794	0.0104	0.14	0.736	3.13E-5	0.0	0.0995	0.7093	1968536	Cerep_003258	COc1cccc(CN2CCN(CC2)C(=O)c3ccc(cc3)N4N=C(C)CC4=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C21	compound treatment	0.798	0.0144	0.19	0.726	-0.00997	-0.14	0.0412	0.1739	1968537	Cerep_003259	CC1CCCCN1CCCNC(=O)Cc2nc(sc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	C22	compound treatment	0.777	-0.0066	-0.09	0.725	-0.011	-0.15	-0.1687	-0.9693	1968538	Cerep_003260	CC(=O)NCCNC(=O)c1ccc(CSc2ccccn2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D03	compound treatment	0.793	0.0094	0.13	0.743	0.00703	0.1	0.1575	0.9905	1968539	Cerep_003261	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)Cc3nc(oc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D04	compound treatment	0.789	0.0054	0.07	0.736	3.13E-5	0.0	0.0518	0.7112	1968540	Cerep_003262	COc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D05	compound treatment	0.777	-0.0066	-0.09	0.746	0.01	0.14	0.0337	0.2068	1968541	Cerep_003263	Cc1cc(nn1C)C(=O)NC(Cc2ccc(O)cc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D06	compound treatment	0.767	-0.0166	-0.22	0.727	-0.00897	-0.12	-0.2449	-0.9595	1968542	Cerep_003264	COc1ccc(Cl)cc1C(=O)N/N=C/c2cccc(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D07	compound treatment	0.78	-0.0036	-0.05	0.739	0.00303	0.04	-0.0051	-0.0804	1968543	Cerep_003265	COc1ccccc1C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D08	compound treatment	0.774	-0.0096	-0.13	0.72	-0.016	-0.22	-0.2456	-0.9692	1968544	Cerep_003266	Fc1ccc(F)c(/C=N/NC(=O)c2ccccc2CCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D09	compound treatment	0.768	-0.0156	-0.21	0.704	-0.032	-0.44	-0.4571	-0.9442	1968545	Cerep_003267	C=CCOc1ccc(CN2CCN(CC2)C(=O)C3Cc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D10	compound treatment	0.777	-0.0066	-0.09	0.712	-0.024	-0.33	-0.2941	-0.8681	1968546	Cerep_003268	COc1cccc(/C=N/NC(=O)c2ccccc2Oc3ccccc3)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D11	compound treatment	0.779	-0.0046	-0.06	0.714	-0.022	-0.3	-0.2557	-0.8359	1968547	Cerep_003269	FC(F)(F)c1cccc(CCNC(=O)c2ccc3[nH]nnc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D12	compound treatment	0.776	-0.0076	-0.1	0.692	-0.044	-0.6	-0.4965	-0.8162	1968548	Cerep_003270	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2ccc(cc2)N3CCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D13	compound treatment	0.794	0.0104	0.14	0.733	-0.00297	-0.04	0.0706	0.4833	1968549	Cerep_003271	O=C(N1CCN(CC1)c2cnccn2)c3ccc(CSc4ccccn4)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D14	compound treatment	0.766	-0.0176	-0.24	0.693	-0.043	-0.59	-0.5822	-0.9209	1968550	Cerep_003272	OC(=O)c1cccc(/C=N/NC(=O)C2CC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D15	compound treatment	0.786	0.0024	0.03	0.726	-0.00997	-0.14	-0.0732	-0.5242	1968551	Cerep_003273	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)N(CCO)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D16	compound treatment	0.786	0.0024	0.03	0.723	-0.013	-0.18	-0.1022	-0.5683	1968552	Cerep_003274	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2cc(F)ccc2F)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D17	compound treatment	0.804	0.0204	0.28	0.732	-0.00397	-0.05	0.1563	0.5574	1968553	Cerep_003275	CCCCC(NC(=O)C)C(=O)N1CCN(Cc2ccc(OCC=C)cc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D18	compound treatment	0.773	-0.0106	-0.14	0.704	-0.032	-0.44	-0.4094	-0.8923	1968554	Cerep_003276	COc1cccc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D19	compound treatment	0.777	-0.0066	-0.09	0.723	-0.013	-0.18	-0.188	-0.9496	1968555	Cerep_003277	CC(C)CCC(=O)N1CCN(C/C=C/c2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D20	compound treatment	0.763	-0.0206	-0.28	0.724	-0.012	-0.16	-0.3119	-0.9678	1968556	Cerep_003278	O=C(N/N=C/c1ccc(cc1)N2CCCC2)c3ccccc3CCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D21	compound treatment	0.802	0.0184	0.25	0.748	0.012	0.16	0.2915	0.9798	1968557	Cerep_003279	CC/1=C(CC(=O)NNC(=O)c2cnn(c2C(F)(F)F)c3ccc(Cl)cc3)c4cc(F)ccc4\C1=C/c5ccc(cc5)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	D22	compound treatment	0.777	-0.0066	-0.09	0.709	-0.027	-0.37	-0.323	-0.8537	1968558	Cerep_003280	OC(=O)c1cccc(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E03	compound treatment	0.793	0.0094	0.13	0.745	0.00903	0.12	0.1767	0.9999	1968559	Cerep_003281	CC(C)c1nc2ccc(F)cc2c3C(=O)N(Cc4cccnc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E04	compound treatment	0.777	-0.0066	-0.09	0.749	0.013	0.18	0.0627	0.3153	1968560	Cerep_003282	COc1cccc(CC(=O)NNC(=O)c2cnn(c2C(F)(F)F)c3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E05	compound treatment	0.788	0.0044	0.06	0.731	-0.00497	-0.07	-0.006	-0.0661	1968561	Cerep_003283	COCc1nc2ccc(C)cc2c3C(=O)N(CCOc4ccc(OC)cc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E06	compound treatment	0.798	0.0144	0.19	0.722	-0.014	-0.19	0.0027	0.0098	1968562	Cerep_003284	Cc1ccc(C(=O)NNC(=O)c2ccc3nsnc3c2)c(Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E07	compound treatment	0.78	-0.0036	-0.05	0.724	-0.012	-0.16	-0.1498	-0.8795	1968563	Cerep_003285	O=C(NN1C(=O)C2C3CC(C=C3)C2C1=O)c4ccccc4CCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E08	compound treatment	0.817	0.0334	0.45	0.731	-0.00497	-0.07	0.2707	0.5941	1968564	Cerep_003286	Clc1ccc(CCNC(=O)c2cc(nc3ccccc23)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E09	compound treatment	0.771	-0.0126	-0.17	0.737	0.00103	0.01	-0.1103	-0.6464	1968565	Cerep_003287	COc1cc(nc2ccccc12)C(=O)NN3C(=O)C4C(C5CCC4C=C5)C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E10	compound treatment	0.77	-0.0136	-0.18	0.752	0.016	0.22	0.0248	0.087	1968566	Cerep_003288	COc1cccc(CNC(=O)CCc2nc3ccccc3n2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E11	compound treatment	0.737	-0.0466	-0.63	0.714	-0.022	-0.3	-0.6564	-0.9425	1968567	Cerep_003289	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4cccs4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E12	compound treatment	0.798	0.0144	0.19	0.757	0.021	0.29	0.3401	0.982	1968568	Cerep_003290	CCc1ccc(cc1)c2ccc(cc2)C(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E13	compound treatment	0.795	0.0114	0.15	0.728	-0.00797	-0.11	0.0319	0.1694	1968569	Cerep_003291	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(C4CCN(Cc5ccccc5)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E14	compound treatment	0.765	-0.0186	-0.25	0.729	-0.00697	-0.1	-0.2446	-0.9117	1968570	Cerep_003292	COc1ccc(cc1)C(=O)NNC(=O)c2cc3ccccc3n2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E15	compound treatment	0.77	-0.0136	-0.18	0.699	-0.037	-0.5	-0.4862	-0.9063	1968571	Cerep_003293	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4csc(Cn5cnc(Cl)c5Cl)n4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E16	compound treatment	0.78	-0.0036	-0.05	0.734	-0.00197	-0.03	-0.0533	-0.9609	1968572	Cerep_003294	CC(C)(C)OC(=O)NC(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)NCc1cccs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E17	compound treatment	0.784	3.98E-4	0.01	0.714	-0.022	-0.3	-0.208	-0.6943	1968573	Cerep_003295	CC(C)NC(=O)CN1CCN(CC1)C(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E18	compound treatment	0.774	-0.0096	-0.13	0.72	-0.016	-0.22	-0.2456	-0.9692	1968574	Cerep_003296	CCOc1ccc(cc1OCC)C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E19	compound treatment	0.791	0.0074	0.1	0.756	0.02	0.27	0.2637	0.9068	1968575	Cerep_003297	COc1ccccc1CNC(=O)CC2=C(C)/C(=C/c3ccc(cc3)S(=O)C)/c4ccc(F)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E20	compound treatment	0.792	0.0084	0.11	0.745	0.00903	0.12	0.1672	0.9991	1968576	Cerep_003298	CCN1CC(CN1CC)NC(=O)c2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E21	compound treatment	0.792	0.0084	0.11	0.742	0.00603	0.08	0.1383	0.9876	1968577	Cerep_003299	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)c5ccc(C)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	E22	compound treatment	0.795	0.0114	0.15	0.758	0.022	0.3	0.3212	0.9516	1968578	Cerep_003300	O=C(Cc1csc(n1)c2cnccn2)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F03	compound treatment	0.798	0.0144	0.19	0.748	0.012	0.16	0.2534	0.9965	1968579	Cerep_003301	Fc1ccc(CC(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F04	compound treatment	0.751	-0.0326	-0.44	0.712	-0.024	-0.33	-0.5421	-0.9893	1968580	Cerep_003302	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(O)c(C)ncc2CO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F05	compound treatment	0.798	0.0144	0.19	0.763	0.027	0.37	0.398	0.9552	1968581	Cerep_003303	COC(=O)C(Cc1cn(cn1)C(c2ccccc2)(c3ccccc3)c4ccccc4)NC(=O)c5ccc(NC(=O)C)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F06	compound treatment	0.775	-0.0086	-0.12	0.735	-9.69E-4	-0.01	-0.0914	-0.7825	1968582	Cerep_003304	COc1ccc(Cl)cc1C(=O)N/N=C/c2ccc(Br)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F07	compound treatment	0.779	-0.0046	-0.06	0.737	0.00103	0.01	-0.034	-0.5334	1968583	Cerep_003305	CC(CCC=C(C)C)CC(=O)NNC(=O)c1ccco1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F08	compound treatment	0.784	3.98E-4	0.01	0.71	-0.026	-0.35	-0.2466	-0.6963	1968584	Cerep_003306	CC(C)(C)OC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F09	compound treatment	0.777	-0.0066	-0.09	0.725	-0.011	-0.15	-0.1687	-0.9693	1968585	Cerep_003307	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)c3csc(CS(=O)(=O)Cc4ccco4)n3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F10	compound treatment	0.782	-0.0016	-0.02	0.714	-0.022	-0.3	-0.2271	-0.7562	1968586	Cerep_003308	OCc1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F11	compound treatment	0.793	0.0094	0.13	0.717	-0.019	-0.26	-0.0933	-0.3237	1968587	Cerep_003309	OC(CNC(=O)c1cc(=O)n([nH]1)c2ccccc2)c3cccc(O)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F12	compound treatment	0.783	-6.02E-4	-0.01	0.71	-0.026	-0.35	-0.2561	-0.7231	1968588	Cerep_003310	Cc1ncc(CO)c(/C=N/NC(=O)c2ccccc2Oc3ccccc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F13	compound treatment	0.802	0.0184	0.25	0.721	-0.015	-0.2	0.0312	0.097	1968589	Cerep_003311	Cn1c(CCC(=O)NNC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)nc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F14	compound treatment	0.76	-0.0236	-0.32	0.716	-0.02	-0.27	-0.4177	-0.997	1968590	Cerep_003312	Brc1ccc(/C=N/NC(=O)C2CC2c3ccccc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F15	compound treatment	0.799	0.0154	0.21	0.76	0.024	0.33	0.3786	0.9758	1968591	Cerep_003313	Cc1nc(sc1C(=O)NNC(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4)c5cnccc5C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F16	compound treatment	0.789	0.0054	0.07	0.75	0.014	0.19	0.1868	0.9124	1968592	Cerep_003314	CC(C)(C)OC(=O)Oc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F17	compound treatment	0.775	-0.0086	-0.12	0.739	0.00303	0.04	-0.0528	-0.4288	1968593	Cerep_003315	CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)c1cc(=O)n([nH]1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F18	compound treatment	0.772	-0.0116	-0.16	0.723	-0.013	-0.18	-0.2357	-0.9981	1968594	Cerep_003316	OCc1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F19	compound treatment	0.809	0.0254	0.34	0.749	0.013	0.18	0.3679	0.9533	1968595	Cerep_003317	FC(F)(F)c1ccccc1CNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F20	compound treatment	0.765	-0.0186	-0.25	0.71	-0.026	-0.35	-0.4278	-0.9858	1968596	Cerep_003318	Cc1ncc(CO)c(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F21	compound treatment	0.779	-0.0046	-0.06	0.767	0.031	0.42	0.2553	0.597	1968597	Cerep_003319	COc1cc(OC)cc(c1)C(=O)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	F22	compound treatment	0.778	-0.0056	-0.08	0.728	-0.00797	-0.11	-0.1303	-0.9843	1968598	Cerep_003320	FC(F)(F)c1ccc(nc1)S(=O)(=O)CC(=O)N/N=C/c2ccc(Br)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G03	compound treatment	0.744	-0.0396	-0.53	0.724	-0.012	-0.16	-0.4932	-0.8828	1968599	Cerep_003321	CC(C)c1nc2ccc(F)cc2c3C(=O)N(CCn4c(C)ncc4[N+](=O)[O-])C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G04	compound treatment	0.804	0.0204	0.28	0.756	0.02	0.27	0.3877	1.0	1968600	Cerep_003322	CC(=O)NCCNC(=O)CCCCCNC(=O)OCc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G05	compound treatment	0.763	-0.0206	-0.28	0.732	-0.00397	-0.05	-0.2348	-0.8292	1968601	Cerep_003323	COCc1nc2ccc(C)cc2c3C(=O)N(CC(=O)Nc4ccc5ccccc5c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G06	compound treatment	0.794	0.0104	0.14	0.716	-0.02	-0.27	-0.0934	-0.3048	1968602	Cerep_003324	CCc1ccc(cc1)c2ccc(cc2)C(=O)NC(C)c3cccc4OCCOc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G07	compound treatment	0.784	3.98E-4	0.01	0.737	0.00103	0.01	0.0137	0.9128	1968603	Cerep_003325	Clc1ccc(cc1)C2(CCC2)C(=O)NN3C(=O)C4C5CC(C=C5)C4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G08	compound treatment	0.782	-0.0016	-0.02	0.734	-0.00197	-0.03	-0.0343	-0.9942	1968604	Cerep_003326	CN(C)CCCN(CCCN(C)C)C(=O)c1cc2ccccc2n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G09	compound treatment	0.787	0.0034	0.05	0.731	-0.00497	-0.07	-0.0155	-0.1894	1968605	Cerep_003327	Cc1nc(sc1C(=O)NN2C(=O)C3C(C4CCC3C=C4)C2=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G10	compound treatment	0.771	-0.0126	-0.17	0.733	-0.00297	-0.04	-0.1488	-0.8517	1968606	Cerep_003328	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)c5csc(n5)c6cnccn6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G11	compound treatment	0.756	-0.0276	-0.37	0.73	-0.00597	-0.08	-0.3209	-0.8418	1968607	Cerep_003329	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(CCc4ccncc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G12	compound treatment	0.796	0.0124	0.17	0.742	0.00603	0.08	0.1764	0.9466	1968608	Cerep_003330	CC(C(=O)NC(Cc1ccccc1)C(=O)OCc2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G13	compound treatment	0.777	-0.0066	-0.09	0.714	-0.022	-0.3	-0.2748	-0.8793	1968609	Cerep_003331	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(CCCN4CCCC4=O)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G14	compound treatment	0.79	0.0064	0.09	0.744	0.00803	0.11	0.1385	0.9931	1968610	Cerep_003332	[O-][N+](=O)c1ccc(OCC(=O)NNC(=O)CCc2c[nH]c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G15	compound treatment	0.788	0.0044	0.06	0.75	0.014	0.19	0.1773	0.8848	1968611	Cerep_003333	CSc1ncc(C(=O)NN2C(=O)c3c(C2=O)c4cc(Cl)ccc4nc3C(C)C)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G16	compound treatment	0.779	-0.0046	-0.06	0.739	0.00303	0.04	-0.0147	-0.1967	1968612	Cerep_003334	FC(F)(F)c1ccccc1CNC(=O)CCCCCNC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G17	compound treatment	0.799	0.0154	0.21	0.754	0.018	0.25	0.3208	0.9965	1968613	Cerep_003335	CC(Oc1ccc(Cl)cc1C)C(=O)NNC(=O)C2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G18	compound treatment	0.806	0.0224	0.3	0.702	-0.034	-0.46	-0.1139	-0.2059	1968614	Cerep_003336	CCc1ccc(cc1)c2ccc(cc2)C(=O)N3CCN(Cc4ccc5n(CC)c6ccccc6c5c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G19	compound treatment	0.815	0.0314	0.42	0.74	0.00403	0.05	0.3384	0.7922	1606434	Cerep_003337	COCC(C)NC(=O)c1cc(OC)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G20	compound treatment	0.787	0.0034	0.05	0.732	-0.00397	-0.05	-0.0059	-0.0825	1371338	Cerep_003338	O=C(NCCN1CCOCC1)c2cc(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G21	compound treatment	0.785	0.0014	0.02	0.76	0.024	0.33	0.2451	0.7466	1968615	Cerep_003339	CC(=O)Nc1ccc(cc1)C(=O)NCC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	G22	compound treatment	0.784	3.98E-4	0.01	0.738	0.00203	0.03	0.0234	0.8288	1968616	Cerep_003340	Cn1c(CCC(=O)NCc2ccc(cc2)C(F)(F)F)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H03	compound treatment	0.801	0.0174	0.23	0.742	0.00603	0.08	0.2241	0.9012	1968617	Cerep_003341	COc1cccc(CN2CCC(C2)NC(=O)CCC(C)C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H04	compound treatment	0.753	-0.0306	-0.41	0.731	-0.00497	-0.07	-0.3398	-0.8123	1968618	Cerep_003342	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(OCCCN(C)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H05	compound treatment	0.792	0.0084	0.11	0.752	0.016	0.22	0.2347	0.9532	1968619	Cerep_003343	CC(C)(C)OC(=O)CCC(NC(=O)c1cc(=O)n([nH]1)c2ccccc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H06	compound treatment	0.754	-0.0296	-0.4	0.731	-0.00497	-0.07	-0.3303	-0.8154	1968620	Cerep_003344	COc1ccc(F)c(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H07	compound treatment	0.808	0.0244	0.33	0.766	0.03	0.41	0.5223	0.9941	1968621	Cerep_003345	Cn1c(cc2ccccc12)C(=O)NCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H08	compound treatment	0.761	-0.0226	-0.3	0.706	-0.03	-0.41	-0.5046	-0.9896	1968622	Cerep_003346	Fc1cc(/C=N/NC(=O)COc2ccccc2Cl)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H09	compound treatment	0.79	0.0064	0.09	0.737	0.00103	0.01	0.071	0.8116	1968623	Cerep_003347	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)NNC(=O)CC2=C(C)/C(=C/c3ccc(cc3)S(=O)C)/c4ccc(F)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H10	compound treatment	0.772	-0.0116	-0.16	0.732	-0.00397	-0.05	-0.1489	-0.8994	1968624	Cerep_003348	CC(=O)OCc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H11	compound treatment	0.834	0.0504	0.68	0.765	0.029	0.4	0.7607	0.9669	1968625	Cerep_003349	COC(=O)C(NC(=O)c1ccc(cc1)N2N=C(C)CC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H12	compound treatment	0.761	-0.0226	-0.3	0.707	-0.029	-0.4	-0.4949	-0.9918	1968626	Cerep_003350	CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccccc2Oc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H13	compound treatment	0.786	0.0024	0.03	0.749	0.013	0.18	0.1485	0.8223	1968627	Cerep_003351	CC(C)(C)OC(=O)NC(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)N1CCC(C1)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H14	compound treatment	0.774	-0.0096	-0.13	0.743	0.00703	0.1	-0.0238	-0.1477	1968628	Cerep_003352	COc1ccc(F)c(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H15	compound treatment	0.788	0.0044	0.06	0.714	-0.022	-0.3	-0.1699	-0.5563	1968629	Cerep_003353	Cc1noc(c1C(=O)NNC(=O)c2ccc(CSc3ccccn3)o2)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H16	compound treatment	0.758	-0.0256	-0.35	0.711	-0.025	-0.34	-0.485	-1.0	1968630	Cerep_003354	COc1ccc(cc1OC)C(=O)N/N=C/c2cc(F)cc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H17	compound treatment	0.789	0.0054	0.07	0.78	0.044	0.6	0.4761	0.7871	1968631	Cerep_003355	COC(=O)C(Cc1cn(Cc2ccccc2)cn1)NC(=O)c3ccc(cc3)N4N=C(C)CC4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H18	compound treatment	0.764	-0.0196	-0.26	0.735	-9.69E-4	-0.01	-0.1963	-0.7415	1968632	Cerep_003356	CC(=O)OCc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H19	compound treatment	0.806	0.0224	0.3	0.763	0.027	0.37	0.4743	0.9951	1968633	Cerep_003357	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)Cn3cnc(Cl)c3Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H20	compound treatment	0.786	0.0024	0.03	0.715	-0.021	-0.29	-0.1793	-0.6231	1968634	Cerep_003358	CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H21	compound treatment	0.808	0.0244	0.33	0.737	0.00103	0.01	0.2427	0.7366	1968635	Cerep_003359	COc1cc(CCNC(=O)CC(CC(=O)C2CC2)c3ccc(Br)cc3)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	H22	compound treatment	0.779	-0.0046	-0.06	0.733	-0.00297	-0.04	-0.0725	-0.9785	1968636	Cerep_003360	COc1ccc(F)c(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I03	compound treatment	0.794	0.0104	0.14	0.756	0.02	0.27	0.2923	0.952	1968637	Cerep_003361	CC(C)c1nc2ccc(F)cc2c3C(=O)N(CCCN(C)c4ccccc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I04	compound treatment	0.754	-0.0296	-0.4	0.741	0.00503	0.07	-0.2339	-0.5772	1968638	Cerep_003362	Clc1ccc(CN2CCCN(CC2)C(=O)c3ccsc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I05	compound treatment	0.78	-0.0036	-0.05	0.73	-0.00597	-0.08	-0.0919	-0.9696	1968639	Cerep_003363	COCc1nc2ccc(C)cc2c3C(=O)N(CCc4cc(OC)cc(OC)c4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I06	compound treatment	0.78	-0.0036	-0.05	0.728	-0.00797	-0.11	-0.1112	-0.9342	1968640	Cerep_003364	CCC(C)C(=O)N1CCN(CC1)C(=O)c2ccc(OC)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I07	compound treatment	0.763	-0.0206	-0.28	0.738	0.00203	0.03	-0.1769	-0.6335	1968641	Cerep_003365	COc1cc(CN2CCC(C2)N3C(=O)C4C5CC(C=C5)C4C3=O)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I08	compound treatment	0.8	0.0164	0.22	0.731	-0.00497	-0.07	0.1085	0.469	1968642	Cerep_003366	O=C(CCc1c[nH]c2ccccc12)NNC(=O)c3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I09	compound treatment	0.784	3.98E-4	0.01	0.739	0.00303	0.04	0.033	0.7923	1968643	Cerep_003367	COc1cscc1C(=O)NN2C(=O)c3c(C2=O)c4cc(Br)ccc4nc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I10	compound treatment	0.78	-0.0036	-0.05	0.742	0.00603	0.08	0.0238	0.2491	1968644	Cerep_003368	NS(=O)(=O)c1ccc(CCNC(=O)CCCCCNC(=O)OCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I11	compound treatment	0.775	-0.0086	-0.12	0.729	-0.00697	-0.1	-0.1493	-0.9951	1968645	Cerep_003369	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccncc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I12	compound treatment	0.799	0.0154	0.21	0.759	0.023	0.31	0.369	0.9799	1968646	Cerep_003370	COC(=O)CCC(=O)N1CCN(C/C=C/c2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I13	compound treatment	0.774	-0.0096	-0.13	0.735	-9.69E-4	-0.01	-0.1009	-0.7752	1968647	Cerep_003371	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(CC4(O)CCCCC4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I14	compound treatment	0.806	0.0224	0.3	0.736	3.13E-5	0.0	0.214	0.7081	1968648	Cerep_003372	CCN(CCNC(=O)c1ccc(cc1)n2cccc2)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I15	compound treatment	0.769	-0.0146	-0.2	0.73	-0.00597	-0.08	-0.1968	-0.9235	1968649	Cerep_003373	COc1ccc(CCN(C)C(=O)c2ccccc2OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I16	compound treatment	0.762	-0.0216	-0.29	0.751	0.015	0.2	-0.0611	-0.1716	1968650	Cerep_003374	CSc1sc(C(=O)NNC(=O)c2ccsc2)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I17	compound treatment	0.797	0.0134	0.18	0.76	0.024	0.33	0.3595	0.9607	1968651	Cerep_003375	Cc1sc(nc1CC(=O)NNC(=O)c2cc3ccccc3s2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I18	compound treatment	0.782	-0.0016	-0.02	0.748	0.012	0.16	0.1007	0.6087	1968652	Cerep_003376	CC(C(=O)NNC(=O)C1=C(CC=C1)n2c(C)ccc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I19	compound treatment	0.782	-0.0016	-0.02	0.742	0.00603	0.08	0.0429	0.5042	1968653	Cerep_003377	CCOC(=O)CNC(=O)CC(CC(=O)C1CC1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I20	compound treatment	0.773	-0.0106	-0.14	0.756	0.02	0.27	0.092	0.2984	1968654	Cerep_003378	CC(NC(=O)c1cc2ccccc2n1C)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I21	compound treatment	0.812	0.0284	0.38	0.865	0.129	1.76	1.5151	0.8414	1968655	Cerep_003379	CC(C)(C)OC(=O)CC(NC(=O)CNC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	I22	compound treatment	0.815	0.0314	0.42	0.748	0.012	0.16	0.4155	0.9148	1968656	Cerep_003380	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)C(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J03	compound treatment	0.799	0.0154	0.21	0.737	0.00103	0.01	0.1568	0.7533	1968657	Cerep_003381	COc1cccc(CN2CCC(C2)NC(=O)C(C)c3ccc(Cl)cc3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J04	compound treatment	0.784	3.98E-4	0.01	0.738	0.00203	0.03	0.0234	0.8288	1968658	Cerep_003382	COc1ccc(cc1)C(=O)N/N=C/c2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J05	compound treatment	0.771	-0.0126	-0.17	0.772	0.036	0.49	0.2272	0.437	1968659	Cerep_003383	COc1ccc(Br)cc1CCNC(=O)c2ccc(cc2)N3N=C(C)CC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J06	compound treatment	0.772	-0.0116	-0.16	0.748	0.012	0.16	0.0053	0.0235	1968660	Cerep_003384	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3ccccc3OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J07	compound treatment	0.773	-0.0106	-0.14	0.735	-9.69E-4	-0.01	-0.1105	-0.7691	1965557	Cerep_003385	COc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J08	compound treatment	0.793	0.0094	0.13	0.724	-0.012	-0.16	-0.0258	-0.1246	1968661	Cerep_003386	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(F)c(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J09	compound treatment	0.773	-0.0106	-0.14	0.751	0.015	0.2	0.0438	0.1753	1968662	Cerep_003387	COc1cc(OC)cc(c1)C(=O)N2CCN(CC2)C(=O)Cc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J10	compound treatment	0.757	-0.0266	-0.36	0.723	-0.013	-0.18	-0.3788	-0.9468	1968663	Cerep_003388	CCCCCc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J11	compound treatment	0.799	0.0154	0.21	0.745	0.00903	0.12	0.234	0.9689	1968664	Cerep_003389	CSc1ncc(C(=O)NNC(=O)OCCc2cccc(F)c2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J12	compound treatment	0.775	-0.0086	-0.12	0.74	0.00403	0.05	-0.0432	-0.3363	1968665	Cerep_003390	O=C(N/N=C/c1ccc2OCCOc2c1)c3ccccc3CCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J13	compound treatment	0.764	-0.0196	-0.26	0.738	0.00203	0.03	-0.1674	-0.6296	1968666	Cerep_003391	Cc1nn(Cc2nnn(CC(=O)NNC(=O)c3cn[nH]c3)n2)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J14	compound treatment	0.786	0.0024	0.03	0.737	0.00103	0.01	0.0328	0.9304	1968667	Cerep_003392	O=C(N/N=C/c1ccccc1OCc2ccccc2)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J15	compound treatment	0.77	-0.0136	-0.18	0.751	0.015	0.2	0.0152	0.0552	1968668	Cerep_003393	FC(F)(F)Oc1ccccc1COC(=O)N2CCN(CC2)c3ncccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J16	compound treatment	0.763	-0.0206	-0.28	0.719	-0.017	-0.23	-0.3601	-0.9959	1968669	Cerep_003394	Fc1cc(F)c(/C=N/NC(=O)c2ccc3ccccc3c2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J17	compound treatment	0.791	0.0074	0.1	0.739	0.00303	0.04	0.0998	0.9239	1968670	Cerep_003395	COc1c(cnc2n(C)nc(C)c12)C(=O)NNC(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J18	compound treatment	0.751	-0.0326	-0.44	0.689	-0.047	-0.64	-0.7639	-0.9832	1968671	Cerep_003396	CCCCCc1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J19	compound treatment	0.81	0.0264	0.36	0.767	0.031	0.42	0.551	0.9963	1968672	Cerep_003397	CC1CCCCN1CCCNC(=O)c2ccc(NC(=O)C)c(NC(=O)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J20	compound treatment	0.79	0.0064	0.09	0.699	-0.037	-0.5	-0.2954	-0.5776	1968673	Cerep_003398	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2ccc3OCCOc3c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J21	compound treatment	0.804	0.0204	0.28	0.747	0.011	0.15	0.301	0.9596	1968674	Cerep_003399	CCOc1ccc(cc1)N2CCN(CC2)C(=O)Cc3nc(sc3C)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	J22	compound treatment	0.743	-0.0406	-0.55	0.717	-0.019	-0.26	-0.5702	-0.9413	1968675	Cerep_003400	O=C(Nc1ccccc1C(=O)N/N=C/c2ccccc2OCc3ccccc3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K03	compound treatment	0.819	0.0354	0.48	0.765	0.029	0.4	0.6176	0.9957	1968676	Cerep_003401	COCc1nc2ccc(C)cc2c3C(=O)N(NC(=O)c4ccccc4CCc5ccccc5)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K04	compound treatment	0.786	0.0024	0.03	0.753	0.017	0.23	0.1871	0.7979	1968677	Cerep_003402	COc1cccc(CNC(=O)c2ccc(cc2)n3nc(cc3C(C)(C)C)C(C)(C)C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K05	compound treatment	0.783	-6.02E-4	-0.01	0.734	-0.00197	-0.03	-0.0247	-0.8815	1968678	Cerep_003403	Cc1ccc(s1)C(=O)NN2C(=O)C3CC=CCC3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K06	compound treatment	0.783	-6.02E-4	-0.01	0.742	0.00603	0.08	0.0524	0.6342	1968679	Cerep_003404	Cc1cc(nn1C)C(=O)NC(CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K07	compound treatment	0.756	-0.0276	-0.37	0.74	0.00403	0.05	-0.2244	-0.5963	1968680	Cerep_003405	O=C(CN1C(=O)C2C3CC(C=C3)C2C1=O)Nc4ccc5ccccc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K08	compound treatment	0.779	-0.0046	-0.06	0.732	-0.00397	-0.05	-0.0822	-0.9977	1968681	Cerep_003406	FC(F)(F)c1cc(CNC(=O)c2ccc(cc2)n3cccc3)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K09	compound treatment	0.769	-0.0146	-0.2	0.736	3.13E-5	0.0	-0.139	-0.7056	1968682	Cerep_003407	CCc1nc2ccccc2c3C(=O)N(CCc4ccccn4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K10	compound treatment	0.803	0.0194	0.26	0.754	0.018	0.25	0.3589	0.9995	1968683	Cerep_003408	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NC3CCCCC3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K11	compound treatment	0.76	-0.0236	-0.32	0.724	-0.012	-0.16	-0.3406	-0.9518	1968684	Cerep_003409	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(C4CCN(Cc5cc6OCOc6cc5Cl)C4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K12	compound treatment	0.858	0.0744	1.0	0.743	0.00703	0.1	0.7775	0.7711	1968685	Cerep_003410	Cc1cc(nn1C)C(=O)NCC(O)c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K13	compound treatment	0.764	-0.0196	-0.26	0.725	-0.011	-0.15	-0.2928	-0.9636	1968686	Cerep_003411	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccc(cc4)N(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K14	compound treatment	0.772	-0.0116	-0.16	0.727	-0.00897	-0.12	-0.1972	-0.9926	1968687	Cerep_003412	CC(C)(C)OC(=O)NC(Cc1c[nH]cn1)C(=O)NNC(=O)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K15	compound treatment	0.802	0.0184	0.25	0.73	-0.00597	-0.08	0.118	0.4516	1968688	Cerep_003413	CCCCCCNC(=O)c1cc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K16	compound treatment	0.794	0.0104	0.14	0.757	0.021	0.29	0.302	0.9459	1968689	Cerep_003414	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NCc3ccc(cc3)C(F)(F)F)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K17	compound treatment	0.788	0.0044	0.06	0.733	-0.00297	-0.04	0.0133	0.1856	1968690	Cerep_003415	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)CNC(=O)c3cccnc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K18	compound treatment	0.801	0.0174	0.23	0.741	0.00503	0.07	0.2145	0.8771	1968691	Cerep_003416	COC(=O)CCC(=O)NC1CCN(Cc2cccc(OC)c2[N+](=O)[O-])C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K19	compound treatment	0.765	-0.0186	-0.25	0.743	0.00703	0.1	-0.1097	-0.4082	1968692	Cerep_003417	CCOc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(cc3)n4nc(C)c(CCC(=O)OC)c4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K20	compound treatment	0.796	0.0124	0.17	0.744	0.00803	0.11	0.1957	0.9789	1968693	Cerep_003418	Fc1cccc(c1)C(=O)NNC(=O)CCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K21	compound treatment	0.804	0.0204	0.28	0.745	0.00903	0.12	0.2817	0.9343	1968694	Cerep_003419	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NC(CCC(=O)OC(C)(C)C)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	K22	compound treatment	0.792	0.0084	0.11	0.748	0.012	0.16	0.1961	0.9837	1968695	Cerep_003420	OC1(CCN(CC1)C(=O)CCCCCNC(=O)OCc2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L03	compound treatment	0.799	0.0154	0.21	0.741	0.00503	0.07	0.1954	0.8932	1968696	Cerep_003421	O=C(N1CCN(C/C=C/c2ccccc2)CC1)c3ccc4OCOc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L04	compound treatment	0.762	-0.0216	-0.29	0.725	-0.011	-0.15	-0.3118	-0.952	1968697	Cerep_003422	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L05	compound treatment	0.787	0.0034	0.05	0.724	-0.012	-0.16	-0.083	-0.4895	1968698	Cerep_003423	COc1ccccc1C(=O)N2CCN(CC(=O)NC(C)C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L06	compound treatment	0.76	-0.0236	-0.32	0.731	-0.00497	-0.07	-0.2731	-0.8388	1968699	Cerep_003424	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OC)c(OC)cc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L07	compound treatment	0.763	-0.0206	-0.28	0.737	0.00103	0.01	-0.1866	-0.6705	1968700	Cerep_003425	FC(F)(F)c1ccc(c2nc(cs2)C(=O)NNC(=O)c3cn[nH]c3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L08	compound treatment	0.762	-0.0216	-0.29	0.721	-0.015	-0.2	-0.3504	-0.9848	1968701	Cerep_003426	Cc1c(/C=N/NC(=O)c2ccccc2CCc3ccccc3)sc4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L09	compound treatment	0.771	-0.0126	-0.17	0.742	0.00603	0.08	-0.0621	-0.3286	1968702	Cerep_003427	COc1ccccc1C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L10	compound treatment	0.768	-0.0156	-0.21	0.738	0.00203	0.03	-0.1292	-0.6088	1968703	Cerep_003428	Fc1ccc(/C=N/NC(=O)COc2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L11	compound treatment	0.79	0.0064	0.09	0.738	0.00203	0.03	0.0806	0.8894	1968704	Cerep_003429	CC(O)CNC(=O)c1ccc2[nH]nnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L12	compound treatment	0.777	-0.0066	-0.09	0.733	-0.00297	-0.04	-0.0916	-0.9363	1968705	Cerep_003430	OC(=O)c1ccccc1/C=N/NC(=O)COc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L13	compound treatment	0.79	0.0064	0.09	0.736	3.13E-5	0.0	0.0613	0.7106	1968706	Cerep_003431	O=C(N1CCN(CC1)c2ccccc2)c3ccoc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L14	compound treatment	0.769	-0.0146	-0.2	0.724	-0.012	-0.16	-0.2547	-0.9956	1968707	Cerep_003432	COc1cc(OC)c(/C=N/NC(=O)c2ccccc2Oc3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L15	compound treatment	0.79	0.0064	0.09	0.737	0.00103	0.01	0.071	0.8116	1968708	Cerep_003433	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)c5ccc(Br)o5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L16	compound treatment	0.772	-0.0116	-0.16	0.744	0.00803	0.11	-0.0332	-0.174	1968709	Cerep_003434	Cc1c(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])sc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L17	compound treatment	0.793	0.0094	0.13	0.749	0.013	0.18	0.2153	0.9863	1968710	Cerep_003435	COc1ccc(N2CCN(CC2)C(=O)c3ccc(cc3)n4nc(cc4C(C)(C)C)C(C)(C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L18	compound treatment	0.748	-0.0356	-0.48	0.735	-9.69E-4	-0.01	-0.349	-0.7263	1968711	Cerep_003436	COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L19	compound treatment	0.801	0.0174	0.23	0.745	0.00903	0.12	0.2531	0.9547	1968712	Cerep_003437	OC(C1CCN(CC1)C(=O)c2ccc(cc2)C(F)(F)F)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L20	compound treatment	0.765	-0.0186	-0.25	0.737	0.00103	0.01	-0.1675	-0.6664	1968713	Cerep_003438	COc1ccc(cc1OC)C(=O)N/N=C/c2ccccc2C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L21	compound treatment	0.803	0.0194	0.26	0.739	0.00303	0.04	0.2143	0.8088	1968714	Cerep_003439	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCC5CCCN(O)C5)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	L22	compound treatment	0.783	-6.02E-4	-0.01	0.734	-0.00197	-0.03	-0.0247	-0.8815	1968715	Cerep_003440	COc1cc(OC)c(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M03	compound treatment	0.776	-0.0076	-0.1	0.749	0.013	0.18	0.0531	0.259	1968716	Cerep_003441	COCc1nc2ccc(C)cc2c3C(=O)N(CCN4CCOCC4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M04	compound treatment	0.81	0.0264	0.36	0.763	0.027	0.37	0.5125	0.9999	1968717	Cerep_003442	CC/1=C(CC(=O)N2CCC(C2)NC(=O)OC(C)(C)C)c3cc(F)ccc3\C1=C/c4ccc(cc4)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M05	compound treatment	0.796	0.0124	0.17	0.753	0.017	0.23	0.2825	0.987	1968718	Cerep_003443	CSc1ccc(cc1)C(=O)NN2C(=O)C3CC=CCC3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M06	compound treatment	0.791	0.0074	0.1	0.747	0.011	0.15	0.1769	0.9801	1968719	Cerep_003444	COc1ccc(CC(=O)NNC(=O)c2ccc(NC(=O)C)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M07	compound treatment	0.761	-0.0226	-0.3	0.733	-0.00297	-0.04	-0.2442	-0.794	1968720	Cerep_003445	Cc1cccc(c1)C(=O)NN2C(=O)C3C4CC(C=C4)C3C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M08	compound treatment	0.789	0.0054	0.07	0.768	0.032	0.44	0.3604	0.8138	1968721	Cerep_003446	C=CCOc1ccc(CN2CCN(CC2)C(=O)c3ccc(s3)c4ccccn4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M09	compound treatment	0.781	-0.0026	-0.04	0.74	0.00403	0.05	0.0141	0.2154	1968722	Cerep_003447	CCc1nc2ccccc2c3C(=O)N(Cc4cccnc4)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M10	compound treatment	0.782	-0.0016	-0.02	0.749	0.013	0.18	0.1104	0.6166	1968723	Cerep_003448	CC(N1CCN(CC1)C(=O)CC2=C(C)/C(=C/c3ccc(cc3)S(=O)C)/c4ccc(F)cc24)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M11	compound treatment	0.769	-0.0146	-0.2	0.725	-0.011	-0.15	-0.2451	-0.9908	1968724	Cerep_003449	COc1cc(nc2ccccc12)C(=O)NN3C(=O)c4c(C3=O)c5cc(Cl)ccc5nc4C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M12	compound treatment	0.804	0.0204	0.28	0.742	0.00603	0.08	0.2527	0.88	1968725	Cerep_003450	COc1cc(ccc1CN2CCC(C2)NC(=O)c3ccc(NC(=O)C)cc3)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M13	compound treatment	0.801	0.0174	0.23	0.714	-0.022	-0.3	-0.0459	-0.1205	1968726	Cerep_003451	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccc(cc4)C(C)(C)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M14	compound treatment	0.822	0.0384	0.52	0.76	0.024	0.33	0.598	0.9756	1968727	Cerep_003452	COc1ccccc1CNC(=O)CC(c2ccccc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M15	compound treatment	0.746	-0.0376	-0.51	0.733	-0.00297	-0.04	-0.3873	-0.7611	1968728	Cerep_003453	CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cnn(c1C(F)(F)F)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M16	compound treatment	0.817	0.0334	0.45	0.742	0.00603	0.08	0.3768	0.8226	1968729	Cerep_003454	CC/1=C(CC(=O)NNC(=O)c2ccc(Cn3cnc(Cl)c3Cl)o2)c4cc(F)ccc4\C1=C/c5ccc(cc5)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M17	compound treatment	0.794	0.0104	0.14	0.748	0.012	0.16	0.2152	0.997	1968730	Cerep_003455	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NC3CCN(Cc4ccc(N(C)C)c5ccccc45)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M18	compound treatment	0.785	0.0014	0.02	0.729	-0.00697	-0.1	-0.0539	-0.5559	1968731	Cerep_003456	CC(C)C(NC(=O)c1cc(C)n(C)n1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M19	compound treatment	0.78	-0.0036	-0.05	0.765	0.029	0.4	0.2456	0.6157	1968732	Cerep_003457	COc1cc(/C=C/C(=O)NNC(=O)Cc2nc(oc2C)c3ccccc3)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M20	compound treatment	0.818	0.0344	0.46	0.735	-9.69E-4	-0.01	0.3188	0.6867	1968733	Cerep_003458	O=C(NCCCN1CCOCC1)c2ccc(cc2)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M21	compound treatment	0.786	0.0024	0.03	0.756	0.02	0.27	0.216	0.7854	1620302	Cerep_003459	COc1ccccc1C(=O)N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	M22	compound treatment	0.804	0.0204	0.28	0.752	0.016	0.22	0.3492	0.9935	1968734	Cerep_003460	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)c3ccsc3)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N03	compound treatment	0.805	0.0214	0.29	0.758	0.022	0.3	0.4166	0.9998	1968735	Cerep_003461	Cc1cc(nn1C)C(=O)NNC(=O)c2ccccc2S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N04	compound treatment	0.792	0.0084	0.11	0.742	0.00603	0.08	0.1383	0.9876	1968736	Cerep_003462	Oc1ccccc1/C=N/NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N05	compound treatment	0.817	0.0334	0.45	0.768	0.032	0.44	0.6275	0.9999	1968737	Cerep_003463	CC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N06	compound treatment	0.781	-0.0026	-0.04	0.735	-9.69E-4	-0.01	-0.0342	-0.9108	1968738	Cerep_003464	CC(C)(C)Sc1ccccc1/C=N/NC(=O)c2ccccc2CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N07	compound treatment	0.761	-0.0226	-0.3	0.795	0.059	0.8	0.3536	0.4108	1968739	Cerep_003465	COc1ccc(N2CCN(CC2)C(=O)CCc3nc4ccccc4n3C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N08	compound treatment	0.745	-0.0386	-0.52	0.732	-0.00397	-0.05	-0.4065	-0.7764	1968740	Cerep_003466	Fc1c(/C=N/NC(=O)c2ccccc2Oc3ccccc3)cccc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N09	compound treatment	0.764	-0.0196	-0.26	0.719	-0.017	-0.23	-0.3506	-0.9978	1968741	Cerep_003467	COCCC(=O)N1CCN(C/C=C/c2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N10	compound treatment	0.769	-0.0146	-0.2	0.704	-0.032	-0.44	-0.4475	-0.9355	1968742	Cerep_003468	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(F)c(Br)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N11	compound treatment	0.781	-0.0026	-0.04	0.752	0.016	0.22	0.1298	0.5861	1968743	Cerep_003469	COc1ccc(CC(=O)NNC(=O)c2ccc(cc2)n3cccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N12	compound treatment	0.785	0.0014	0.02	0.741	0.00503	0.07	0.0619	0.8692	1968744	Cerep_003470	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N13	compound treatment	0.811	0.0274	0.37	0.722	-0.014	-0.19	0.1267	0.3046	1968745	Cerep_003471	COc1ccc(cc1)C(=O)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N14	compound treatment	0.813	0.0294	0.4	0.746	0.01	0.14	0.3772	0.899	1968746	Cerep_003472	COc1ccc(cc1)C(=O)N/N=C/c2ccccc2SC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N15	compound treatment	0.731	-0.0526	-0.71	0.737	0.00103	0.01	-0.4918	-0.693	1968747	Cerep_003473	COc1cc(/C=C/C(=O)NNC(=O)CNC(=O)c2ccccc2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N16	compound treatment	0.796	0.0124	0.17	0.729	-0.00697	-0.1	0.0511	0.2655	1968748	Cerep_003474	Fc1c(/C=N/NC(=O)c2ccc(cc2)C(F)(F)F)cccc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N17	compound treatment	0.83	0.0464	0.63	0.734	-0.00197	-0.03	0.4236	0.6762	1968749	Cerep_003475	CN(CCc1c[nH]c2ccccc12)C(=O)CC3=C(C)/C(=C/c4ccc(cc4)S(=O)C)/c5ccc(F)cc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N18	compound treatment	0.783	-6.02E-4	-0.01	0.721	-0.015	-0.2	-0.1501	-0.7347	1968750	Cerep_003476	Fc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N19	compound treatment	0.771	-0.0126	-0.17	0.725	-0.011	-0.15	-0.226	-0.998	1968751	Cerep_003477	Brc1ccc(cc1)C(CC(=O)C2CC2)CC(=O)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N20	compound treatment	0.789	0.0054	0.07	0.744	0.00803	0.11	0.1289	0.9803	1968752	Cerep_003478	Oc1ccccc1/C=N/NC(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N21	compound treatment	0.797	0.0134	0.18	0.768	0.032	0.44	0.4367	0.9237	1968753	Cerep_003479	COCC(C)NC(=O)CCC(=O)c1ccc(F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	N22	compound treatment	0.756	-0.0276	-0.37	0.712	-0.024	-0.33	-0.4944	-0.9979	1968754	Cerep_003480	COc1cccc(c1)C(=O)N/N=C/c2ccccc2SC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O03	compound treatment	0.745	-0.0386	-0.52	0.737	0.00103	0.01	-0.3583	-0.6878	1968755	Cerep_003481	COCc1nc2ccc(C)cc2c3C(=O)N(CCC4CCCN4C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O04	compound treatment	0.797	0.0134	0.18	0.784	0.048	0.65	0.5909	0.8697	1968756	Cerep_003482	COc1cc(OC)cc(c1)C(=O)NCc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O05	compound treatment	0.85	0.0664	0.9	0.754	0.018	0.25	0.8073	0.8691	1968757	Cerep_003483	Cc1nc(sc1C(=O)NN2C(=O)C3CC=CCC3C2=O)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O06	compound treatment	0.8	0.0164	0.22	0.767	0.031	0.42	0.4556	0.9542	1968758	Cerep_003484	NS(=O)(=O)c1ccc(CNC(=O)c2c(F)cccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O07	compound treatment	0.788	0.0044	0.06	0.756	0.02	0.27	0.2351	0.8411	1968759	Cerep_003485	Cc1cccc(C(=O)NN2C(=O)C3C4CC(C=C4)C3C2=O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O08	compound treatment	0.811	0.0274	0.37	0.764	0.028	0.38	0.5316	0.9999	1968760	Cerep_003486	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NNC(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O09	compound treatment	0.846	0.0624	0.84	0.796	0.06	0.82	1.1741	0.9999	1968761	Cerep_003487	CCc1nc2ccccc2c3C(=O)N(CCn4c(C)ncc4[N+](=O)[O-])C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O10	compound treatment	0.786	0.0024	0.03	0.729	-0.00697	-0.1	-0.0443	-0.4415	1968762	Cerep_003488	COc1cc(OC)cc(c1)C(=O)NCC2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O11	compound treatment	0.797	0.0134	0.18	0.746	0.01	0.14	0.2245	0.9906	1968763	Cerep_003489	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)C(Cc4ccccc4)NC(=O)C)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O12	compound treatment	0.82	0.0364	0.49	0.761	0.025	0.34	0.5886	0.9842	1968764	Cerep_003490	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NC(CC(=O)N)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O13	compound treatment	0.777	-0.0066	-0.09	0.757	0.021	0.29	0.1398	0.4656	1968765	Cerep_003491	CC(C)c1nc2ccc(Cl)cc2c3C(=O)N(NC(=O)c4ccccc4NC(=O)c5c(F)cccc5F)C(=O)c31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O14	compound treatment	0.797	0.0134	0.18	0.761	0.025	0.34	0.3692	0.9558	1968766	Cerep_003492	COc1cccc(CN2CCC(C2)NC(=O)Cc3nc(sc3C)c4ccccc4)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O15	compound treatment	0.801	0.0174	0.23	0.759	0.023	0.31	0.388	0.9897	1968767	Cerep_003493	O=C(N1CCC(Cc2ccccc2)CC1)c3nccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O16	compound treatment	0.791	0.0074	0.1	0.742	0.00603	0.08	0.1287	0.9954	1968768	Cerep_003494	COc1cc(OC)cc(c1)C(=O)NCCCN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O17	compound treatment	0.778	-0.0056	-0.08	0.742	0.00603	0.08	0.0047	0.0422	1968769	Cerep_003495	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O18	compound treatment	0.796	0.0124	0.17	0.753	0.017	0.23	0.2825	0.987	1968770	Cerep_003496	CC(=O)Nc1ccc(cc1)C(=O)NCC2CCCCC2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O19	compound treatment	0.811	0.0274	0.37	0.731	-0.00497	-0.07	0.2134	0.568	1968771	Cerep_003497	Cc1ccc(C(=O)NNC(=O)c2ccco2)c(Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O20	compound treatment	0.771	-0.0126	-0.17	0.753	0.017	0.23	0.044	0.1529	1968772	Cerep_003498	CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O21	compound treatment	0.81	0.0264	0.36	0.773	0.037	0.5	0.6089	0.9854	1968773	Cerep_003499	FC(F)(F)c1cccc(CCNC(=O)c2cc(nc3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	O22	compound treatment	0.796	0.0124	0.17	0.744	0.00803	0.11	0.1957	0.9789	1968774	Cerep_003500	Cc1cccc(C)c1N2CCN(CC2)C(=O)c3ccc(cc3)n4nc(cc4C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P03	compound treatment	0.788	0.0044	0.06	0.756	0.02	0.27	0.2351	0.8411	1968775	Cerep_003501	CC(C(=O)N1CCN(C/C=C/c2ccccc2)CC1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P04	compound treatment	0.756	-0.0276	-0.37	0.731	-0.00497	-0.07	-0.3112	-0.8223	1968776	Cerep_003502	CCOc1ccccc1/C=N/NC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P05	compound treatment	0.816	0.0324	0.44	0.765	0.029	0.4	0.589	0.9988	1968777	Cerep_003503	CC(C)(C)OC(=O)CCC(NC(=O)c1cc(=O)n([nH]1)c2ccccc2)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P06	compound treatment	0.751	-0.0326	-0.44	0.728	-0.00797	-0.11	-0.3878	-0.8561	1968778	Cerep_003504	Clc1ccc(Sc2ccccc2/C=N/NC(=O)CC3Sc4ccccc4NC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P07	compound treatment	0.759	-0.0246	-0.33	0.722	-0.014	-0.19	-0.3694	-0.9653	1968779	Cerep_003505	CC(C)(C)OC(=O)NC(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)N1CCC(CC1)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P08	compound treatment	0.762	-0.0216	-0.29	0.724	-0.012	-0.16	-0.3215	-0.9625	1968780	Cerep_003506	O=C(N/N=C/c1ccccc1)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P09	compound treatment	0.662	-0.122	-1.64	0.663	-0.073	-1.0	-1.8636	-0.9713	1968781	Cerep_003507	O=C(NNC(=O)c1ccoc1)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P10	compound treatment	0.091	-0.693	-9.34	0.085	-0.651	-8.88	-12.8839	-0.9997	1968782	Cerep_003508	CCCCc1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P11	compound treatment	0.773	-0.0106	-0.14	0.749	0.013	0.18	0.0245	0.1075	1968783	Cerep_003509	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P12	compound treatment	0.744	-0.0396	-0.53	0.734	-0.00197	-0.03	-0.3968	-0.7417	1968784	Cerep_003510	CCOc1ccccc1/C=N/NC(=O)c2ccccc2CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P13	compound treatment	0.768	-0.0156	-0.21	0.749	0.013	0.18	-0.0232	-0.0841	1968785	Cerep_003511	CCCCCCNC(=O)c1ccc2[nH]nnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P14	compound treatment	0.777	-0.0066	-0.09	0.728	-0.00797	-0.11	-0.1398	-0.9951	1968786	Cerep_003512	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P15	compound treatment	0.783	-6.02E-4	-0.01	0.716	-0.02	-0.27	-0.1983	-0.7279	1968787	Cerep_003513	CCC(C)(O)CC(=O)N1CCC(Cc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P16	compound treatment	0.765	-0.0186	-0.25	0.726	-0.00997	-0.14	-0.2736	-0.9585	1968788	Cerep_003514	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P17	compound treatment	0.777	-0.0066	-0.09	0.742	0.00603	0.08	-0.0048	-0.0398	1968789	Cerep_003515	COc1cc(CCNC(=O)c2cc(OC)cc(OC)c2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P18	compound treatment	0.745	-0.0386	-0.52	0.694	-0.042	-0.57	-0.7729	-0.9989	1968790	Cerep_003516	CCCCc1ccc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P19	compound treatment	0.781	-0.0026	-0.04	0.733	-0.00297	-0.04	-0.0534	-0.9975	1968791	Cerep_003517	Cc1sc(nc1CC(=O)N2CCN(CC2)C(=O)c3ccc(C)cc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P20	compound treatment	0.759	-0.0246	-0.33	0.698	-0.038	-0.52	-0.6008	-0.9769	1968792	Cerep_003518	CCOc1ccccc1/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P21	compound treatment	0.753	-0.0306	-0.41	0.729	-0.00697	-0.1	-0.3591	-0.8477	1968793	Cerep_003519	CC(C)CCC(=O)NNC(=O)c1ccc2nsnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.536	P22	compound treatment	0.733	-0.0506	-0.68	0.73	-0.00597	-0.08	-0.5403	-0.7858	1968794	Cerep_003520	Clc1ccc(Sc2ccccc2/C=N/NC(=O)c3ccc4ccccc4c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A03	compound treatment	0.81	0.026	0.35	0.742	-4.61E-4	-0.01	0.2432	0.6943	1968795	Cerep_003521	OC(=O)COc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A04	compound treatment	0.83	0.046	0.62	0.749	0.00654	0.09	0.5015	0.8006	1968796	Cerep_003522	OC1CCCN(C1)S(=O)(=O)c2ccc(F)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A05	compound treatment	0.797	0.013	0.17	0.72	-0.0225	-0.31	-0.093	-0.2636	1968797	Cerep_003523	COc1cccc(c1)C(=O)N/N=C/c2ccc(C)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A06	compound treatment	0.828	0.044	0.59	0.728	-0.0145	-0.2	0.2799	0.4479	1968798	Cerep_003524	COc1ccc(Cl)cc1S(=O)(=O)N2CCC(CC2)(C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A07	compound treatment	0.802	0.018	0.24	0.736	-0.00646	-0.09	0.109	0.4229	1968799	Cerep_003525	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cc(F)cc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A08	compound treatment	0.798	0.014	0.19	0.73	-0.0125	-0.17	0.013	0.0513	1968800	Cerep_003526	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)NCCCO
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A09	compound treatment	0.8	0.016	0.22	0.714	-0.0285	-0.39	-0.1222	-0.2753	1968801	Cerep_003527	OC(=O)COc1ccccc1/C=N/NC(=O)c2cc3ccccc3cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A10	compound treatment	0.802	0.018	0.24	0.734	-0.00846	-0.12	0.0897	0.3344	1968802	Cerep_003528	CCN(CCc1ccccn1)S(=O)(=O)c2ccc(C)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A11	compound treatment	0.814	0.03	0.4	0.711	-0.0315	-0.43	-0.0176	-0.0298	1968803	Cerep_003529	OC(=O)COc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A12	compound treatment	0.809	0.025	0.34	0.763	0.0205	0.28	0.4361	0.9958	1968804	Cerep_003530	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)S(=O)(=O)c4ccc(cc4)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A13	compound treatment	0.775	-0.00904	-0.12	0.714	-0.0285	-0.39	-0.3607	-0.8866	1968805	Cerep_003531	Oc1cccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A14	compound treatment	0.805	0.021	0.28	0.719	-0.0235	-0.32	-0.0263	-0.0616	1968806	Cerep_003532	COc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A15	compound treatment	0.783	-0.00104	-0.01	0.72	-0.0225	-0.31	-0.2265	-0.7387	1968807	Cerep_003533	COc1ccccc1/C=N/NC(=O)\C=C\c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A16	compound treatment	0.812	0.028	0.38	0.736	-0.00646	-0.09	0.2044	0.5277	1968808	Cerep_003534	COc1ccc(C)cc1S(=O)(=O)NCc2ccc(F)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A17	compound treatment	0.797	0.013	0.17	0.724	-0.0185	-0.25	-0.0544	-0.1774	1968809	Cerep_003535	COc1cc(C)c(/C=N/NC(=O)C2CC2c3ccccc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A18	compound treatment	0.796	0.012	0.16	0.729	-0.0135	-0.18	-0.0157	-0.0643	1968810	Cerep_003536	COc1ccc(Cl)cc1S(=O)(=O)N(C)C2CCN(Cc3ccccc3C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A19	compound treatment	0.808	0.024	0.32	0.734	-0.00846	-0.12	0.147	0.4282	1968811	Cerep_003537	CN(C)c1ccc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A20	compound treatment	0.799	0.015	0.2	0.737	-0.00546	-0.07	0.09	0.4186	1968812	Cerep_003538	Fc1ccc(cc1)C(CCCN2CCN(CC2)S(=O)(=O)c3ccc(F)cc3F)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A21	compound treatment	0.787	0.00296	0.04	0.742	-4.61E-4	-0.01	0.0238	0.5886	1968813	Cerep_003539	Oc1cccc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	A22	compound treatment	0.802	0.018	0.24	0.741	-0.00146	-0.02	0.1572	0.6468	1968814	Cerep_003540	CN(C1CCN(Cc2ccccc2C(F)(F)F)C1)S(=O)(=O)c3cc(F)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B03	compound treatment	0.824	0.04	0.54	0.76	0.0175	0.24	0.5503	0.9331	1233521	Cerep_003541	CC(=O)Nc1ccc(cc1)S(=O)(=O)NC2CC3CCC2(C)C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B04	compound treatment	0.758	-0.026	-0.35	0.708	-0.0345	-0.47	-0.5807	-0.9897	1968815	Cerep_003542	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)c3cc(Cl)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B05	compound treatment	0.795	0.011	0.15	0.746	0.00354	0.05	0.1387	0.8916	1968816	Cerep_003543	CCc1ccccc1N2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B06	compound treatment	0.79	0.00596	0.08	0.731	-0.0115	-0.16	-0.0537	-0.3053	1968817	Cerep_003544	CCCCN(CCCC)CCNS(=O)(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B07	compound treatment	0.817	0.033	0.44	0.745	0.00254	0.03	0.3389	0.7599	1968818	Cerep_003545	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)S(=O)(=O)c4ccc(F)cc4F)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B08	compound treatment	0.756	-0.028	-0.38	0.726	-0.0165	-0.22	-0.4262	-0.9689	1505917	Cerep_003546	O=S(=O)(N1CCN(Cc2ccc3OCOc3c2)CC1)c4ccccc4C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B09	compound treatment	0.809	0.025	0.34	0.75	0.00754	0.1	0.3108	0.8828	1968819	Cerep_003547	Clc1sc(cc1Br)S(=O)(=O)N2CCN(CC2)c3nccnc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B10	compound treatment	0.808	0.024	0.32	0.738	-0.00446	-0.06	0.1855	0.5641	1968820	Cerep_003548	OC(=O)C1CC1C(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B11	compound treatment	0.769	-0.015	-0.2	0.757	0.0145	0.2	-0.0033	-0.0116	1700457	Cerep_003549	COc1ccc(cc1)S(=O)(=O)NC2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B12	compound treatment	0.771	-0.013	-0.18	0.741	-0.00146	-0.02	-0.1385	-0.7822	1968821	Cerep_003550	OC(=O)C1CC1C(=O)N2CCN(CC2)c3cc(nc4ccccc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B13	compound treatment	0.768	-0.016	-0.22	0.74	-0.00246	-0.03	-0.1767	-0.8071	1968822	Cerep_003551	Clc1cc(sc1Cl)S(=O)(=O)N2CCN(CCC3CCCCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B14	compound treatment	0.77	-0.014	-0.19	0.707	-0.0355	-0.48	-0.4759	-0.9163	1968823	Cerep_003552	CC(C)(CC(=O)O)CC(=O)N1CCC(O)(CC1)c2ccc(Cl)c(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B15	compound treatment	0.777	-0.00704	-0.09	0.751	0.00854	0.12	0.0152	0.101	1968824	Cerep_003553	Fc1cccc(F)c1S(=O)(=O)NC2CCN(Cc3ccc4ccccc4c3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B16	compound treatment	0.779	-0.00504	-0.07	0.717	-0.0255	-0.35	-0.2936	-0.8298	1968825	Cerep_003554	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)CC(C)(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B17	compound treatment	0.787	0.00296	0.04	0.743	5.39E-4	0.01	0.0334	0.8235	1271674	Cerep_003555	Brc1ccc(cc1)S(=O)(=O)N(CCC#N)CC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B18	compound treatment	0.749	-0.035	-0.47	0.695	-0.0475	-0.65	-0.7919	-0.9881	1968826	Cerep_003556	CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)CSCC(=O)O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B19	compound treatment	0.779	-0.00504	-0.07	0.734	-0.00846	-0.12	-0.1297	-0.9682	1968827	Cerep_003557	Brc1ccc(Br)c(c1)S(=O)(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B20	compound treatment	0.75	-0.034	-0.46	0.719	-0.0235	-0.32	-0.5509	-0.9844	1968828	Cerep_003558	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)CSCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B21	compound treatment	0.787	0.00296	0.04	0.736	-0.00646	-0.09	-0.0341	-0.3522	1968829	Cerep_003559	COc1ccc(cc1)S(=O)(=O)NC(CO)Cc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	B22	compound treatment	0.751	-0.033	-0.45	0.684	-0.0585	-0.8	-0.8789	-0.9623	1968830	Cerep_003560	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C03	compound treatment	0.796	0.012	0.16	0.761	0.0185	0.25	0.2928	0.9765	1968831	Cerep_003561	COc1cccc(c1)C(=O)N/N=C/c2cc(F)ccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C04	compound treatment	0.807	0.023	0.31	0.747	0.00454	0.06	0.2628	0.832	1968832	Cerep_003562	Cc1nn(c(C)c1CN2CCN(CC2)S(=O)(=O)c3ccc(F)c(F)c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C05	compound treatment	0.813	0.029	0.39	0.76	0.0175	0.24	0.4454	0.9723	1968833	Cerep_003563	COc1cccc(/C=N/NC(=O)c2cc3ccccc3cc2O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C06	compound treatment	0.8	0.016	0.22	0.763	0.0205	0.28	0.3503	0.9916	1968834	Cerep_003564	COc1ccc(Cl)cc1S(=O)(=O)N2CCCC2C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C07	compound treatment	0.787	0.00296	0.04	0.745	0.00254	0.03	0.0527	0.9975	1968835	Cerep_003565	COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C08	compound treatment	0.802	0.018	0.24	0.746	0.00354	0.05	0.2054	0.8316	1968836	Cerep_003566	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)NC2CCCCC2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C09	compound treatment	0.791	0.00696	0.09	0.752	0.00954	0.13	0.1584	0.9872	1968837	Cerep_003567	OC(=O)c1cccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C10	compound treatment	0.801	0.017	0.23	0.749	0.00654	0.09	0.2248	0.9156	1968838	Cerep_003568	Cc1nn(c(C)c1CN2CCC(C2)NS(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-])c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C11	compound treatment	0.764	-0.02	-0.27	0.741	-0.00146	-0.02	-0.2053	-0.7572	1968839	Cerep_003569	Clc1cc2OCOc2cc1/C=N/NC(=O)c3ccc4nonc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C12	compound treatment	0.806	0.022	0.3	0.748	0.00554	0.08	0.2629	0.8599	1968840	Cerep_003570	Cc1ccc(cc1)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C13	compound treatment	0.782	-0.00204	-0.03	0.731	-0.0115	-0.16	-0.13	-0.8191	1968841	Cerep_003571	COc1ccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C14	compound treatment	0.796	0.012	0.16	0.74	-0.00246	-0.03	0.0904	0.5483	1968842	Cerep_003572	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C15	compound treatment	0.781	-0.00304	-0.04	0.716	-0.0265	-0.36	-0.2842	-0.7825	1968843	Cerep_003573	COc1cc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc(O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C16	compound treatment	0.784	-4.08E-5	0.0	0.76	0.0175	0.24	0.1687	0.7055	1968844	Cerep_003574	COc1ccc(CNS(=O)(=O)c2cc(C)ccc2OC)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C17	compound treatment	0.776	-0.00804	-0.11	0.718	-0.0245	-0.33	-0.3126	-0.8911	1968845	Cerep_003575	COc1cc(/C=N/NC(=O)c2cc(Br)ccc2Cl)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C18	compound treatment	0.775	-0.00904	-0.12	0.743	5.39E-4	0.01	-0.081	-0.6633	1968846	Cerep_003576	CCOc1ccccc1CN2CCC(C2)N(C)S(=O)(=O)c3cc(Cl)ccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C19	compound treatment	0.816	0.032	0.43	0.701	-0.0415	-0.57	-0.0949	-0.1335	1968847	Cerep_003577	Clc1cc2OCOc2cc1/C=N/NC(=O)CC3OC(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C20	compound treatment	0.798	0.014	0.19	0.742	-4.61E-4	-0.01	0.1287	0.6831	1968848	Cerep_003578	Fc1ccc(c(F)c1)S(=O)(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C21	compound treatment	0.801	0.017	0.23	0.739	-0.00346	-0.05	0.1284	0.5497	1968849	Cerep_003579	COc1ccc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	C22	compound treatment	0.788	0.00396	0.05	0.73	-0.0125	-0.17	-0.0824	-0.4625	1968850	Cerep_003580	CCOc1ccccc1CN2CCC(C2)N(C)S(=O)(=O)c3cc(F)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D03	compound treatment	0.796	0.012	0.16	0.753	0.0105	0.14	0.2157	0.9983	1968851	Cerep_003581	CC(=O)Nc1ccc(cc1)S(=O)(=O)NC2CCCCNC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D04	compound treatment	0.77	-0.014	-0.19	0.723	-0.0195	-0.27	-0.3216	-0.9863	1968852	Cerep_003582	CCc1cc(Br)ccc1S(=O)(=O)NCCSCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D05	compound treatment	0.799	0.015	0.2	0.747	0.00454	0.06	0.1865	0.8834	1968853	Cerep_003583	FC(F)(F)c1cc(N2CCN(CC2)S(=O)(=O)c3ccccc3Br)c4ccccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D06	compound treatment	0.776	-0.00804	-0.11	0.747	0.00454	0.06	-0.0329	-0.2637	1968854	Cerep_003584	CCN(CC)CCCC(C)NS(=O)(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D07	compound treatment	0.782	-0.00204	-0.03	0.747	0.00454	0.06	0.0243	0.3587	1968855	Cerep_003585	Fc1ccc(c(F)c1)S(=O)(=O)N2CCN(CC2)c3nccnc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D08	compound treatment	0.778	-0.00604	-0.08	0.721	-0.0215	-0.29	-0.2646	-0.8709	1968856	Cerep_003586	O=S(=O)(NCCN1CCCCCC1)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D09	compound treatment	0.795	0.011	0.15	0.729	-0.0135	-0.18	-0.0253	-0.1071	1968857	Cerep_003587	COc1cc(OC)cc(c1)N2CCN(CC2)S(=O)(=O)c3cc(Br)c(Cl)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D10	compound treatment	0.801	0.017	0.23	0.735	-0.00746	-0.1	0.0898	0.3588	1968858	Cerep_003588	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)C4CC4C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D11	compound treatment	0.786	0.00196	0.03	0.739	-0.00346	-0.05	-0.0147	-0.2714	1968859	Cerep_003589	COc1ccc(cc1)S(=O)(=O)NC(C(C)OCc2ccccc2)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D12	compound treatment	0.792	0.00796	0.11	0.711	-0.0315	-0.43	-0.2274	-0.5143	1968860	Cerep_003590	OC(=O)C1CC1C(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D13	compound treatment	0.792	0.00796	0.11	0.747	0.00454	0.06	0.1197	0.9658	1968861	Cerep_003591	COc1cc(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)c(Cl)s3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D14	compound treatment	0.762	-0.022	-0.3	0.712	-0.0305	-0.42	-0.504	-0.9866	1968862	Cerep_003592	CC1CN(CCN1c2ccc(C)cc2)C(=O)CC(C)(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D15	compound treatment	0.791	0.00696	0.09	0.742	-4.61E-4	-0.01	0.0619	0.6583	1968863	Cerep_003593	CN(CCCC1(CCC2c3ccccc31)c4ccccc24)S(=O)(=O)c5c(F)cccc5F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D16	compound treatment	0.771	-0.013	-0.18	0.732	-0.0105	-0.14	-0.2253	-0.9946	1968864	Cerep_003594	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)CC(C)(C)CC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D17	compound treatment	0.79	0.00596	0.08	0.735	-0.00746	-0.1	-0.0151	-0.1164	1968865	Cerep_003595	CC(O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D18	compound treatment	0.78	-0.00404	-0.05	0.725	-0.0175	-0.24	-0.2069	-0.8471	1968866	Cerep_003596	OC(=O)CSCC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D19	compound treatment	0.788	0.00396	0.05	0.72	-0.0225	-0.31	-0.1788	-0.5751	1968867	Cerep_003597	Brc1ccc(s1)S(=O)(=O)NC2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D20	compound treatment	0.75	-0.034	-0.46	0.735	-0.00746	-0.1	-0.3967	-0.8433	1968868	Cerep_003598	OC(=O)CSCC(=O)N1CCN(CC1)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D21	compound treatment	0.8	0.016	0.22	0.758	0.0155	0.21	0.3021	1.0	1968869	Cerep_003599	COC(=O)C1CC(CN1S(=O)(=O)c2ccc(OC)cc2)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	D22	compound treatment	0.762	-0.022	-0.3	0.721	-0.0215	-0.29	-0.4172	-1.0	1968870	Cerep_003600	COc1ccc(N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E03	compound treatment	0.79	0.00596	0.08	0.757	0.0145	0.2	0.197	0.921	1968871	Cerep_003601	CC(C)(C)OC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E04	compound treatment	0.771	-0.013	-0.18	0.748	0.00554	0.08	-0.071	-0.3708	1968872	Cerep_003602	Fc1ccc(cc1F)S(=O)(=O)NC2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E05	compound treatment	0.774	-0.01	-0.14	0.749	0.00654	0.09	-0.0327	-0.2018	1968873	Cerep_003603	COc1cccc(c1)C(=O)N/N=C/c2ccc(CO)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E06	compound treatment	0.798	0.014	0.19	0.723	-0.0195	-0.27	-0.0545	-0.1674	1968874	Cerep_003604	COc1ccc(Cl)cc1S(=O)(=O)NC2CCN(Cc3ccnc4ccccc34)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E07	compound treatment	0.791	0.00696	0.09	0.712	-0.0305	-0.42	-0.2273	-0.5338	1968875	Cerep_003605	Cc1ncc(CO)c(/C=N/NC(=O)c2cc3ccccc3cc2O)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E08	compound treatment	0.829	0.045	0.61	0.748	0.00554	0.08	0.4823	0.7891	1968876	Cerep_003606	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCC(O)(CC2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E09	compound treatment	0.791	0.00696	0.09	0.743	5.39E-4	0.01	0.0716	0.7602	1968877	Cerep_003607	Brc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E10	compound treatment	0.796	0.012	0.16	0.77	0.0275	0.38	0.3796	0.9288	1968878	Cerep_003608	CC(C)c1ccc(CN2CCC(C2)N(C)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E11	compound treatment	0.799	0.015	0.2	0.746	0.00354	0.05	0.1768	0.8522	1968879	Cerep_003609	COc1cc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E12	compound treatment	0.78	-0.00404	-0.05	0.748	0.00554	0.08	0.0149	0.1596	1968880	Cerep_003610	COc1ccc(cc1F)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E13	compound treatment	0.806	0.022	0.3	0.761	0.0185	0.25	0.3882	0.9969	1968881	Cerep_003611	COc1ccc2ccccc2c1/C=N/NC(=O)COc3ncn(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E14	compound treatment	0.774	-0.01	-0.14	0.736	-0.00646	-0.09	-0.1581	-0.9783	1968882	Cerep_003612	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)NCCOc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E15	compound treatment	0.764	-0.02	-0.27	0.73	-0.0125	-0.17	-0.3113	-0.975	1968883	Cerep_003613	COc1cc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E16	compound treatment	0.784	-4.08E-5	0.0	0.729	-0.0135	-0.18	-0.1302	-0.7092	1968884	Cerep_003614	CCN(CC)CCCC(C)NS(=O)(=O)c1cc(C)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E17	compound treatment	0.766	-0.018	-0.24	0.73	-0.0125	-0.17	-0.2922	-0.9846	1968885	Cerep_003615	O=C(N/N=C/c1ccc2OCOc2c1)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E18	compound treatment	0.783	-0.00104	-0.01	0.735	-0.00746	-0.1	-0.0819	-0.7971	1968886	Cerep_003616	COc1ccc(Cl)cc1S(=O)(=O)NCCCN2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E19	compound treatment	0.78	-0.00404	-0.05	0.764	0.0215	0.29	0.1691	0.5662	1968887	Cerep_003617	COc1cc(/C=N/NC(=O)c2cc(Br)ccc2Cl)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E20	compound treatment	0.792	0.00796	0.11	0.756	0.0135	0.18	0.2065	0.9667	1968888	Cerep_003618	COc1ccc2ccccc2c1CN3CCC(C3)NS(=O)(=O)c4ccc(F)cc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E21	compound treatment	0.778	-0.00604	-0.08	0.725	-0.0175	-0.24	-0.226	-0.898	1968889	Cerep_003619	Cc1cc(C)cc(/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	E22	compound treatment	0.785	9.59E-4	0.01	0.758	0.0155	0.21	0.159	0.7489	1968890	Cerep_003620	Cc1ccc(F)cc1S(=O)(=O)NCCCN2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F03	compound treatment	0.793	0.00896	0.12	0.768	0.0255	0.35	0.3317	0.8999	1968891	Cerep_003621	CC(NS(=O)(=O)c1ccc(NC(=O)C)cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F04	compound treatment	0.767	-0.017	-0.23	0.728	-0.0145	-0.2	-0.302	-0.9971	1968892	Cerep_003622	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F05	compound treatment	0.775	-0.00904	-0.12	0.753	0.0105	0.14	0.0154	0.0816	1968893	Cerep_003623	FC(F)(F)c1ccnc(c1)N2CCN(CC2)S(=O)(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F06	compound treatment	0.762	-0.022	-0.3	0.729	-0.0135	-0.18	-0.34	-0.9731	1560100	Cerep_003624	COCC(C)NS(=O)(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F07	compound treatment	0.778	-0.00604	-0.08	0.747	0.00454	0.06	-0.0139	-0.1354	1968894	Cerep_003625	COc1cc(OC)cc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F08	compound treatment	0.787	0.00296	0.04	0.728	-0.0145	-0.2	-0.1112	-0.5527	1968895	Cerep_003626	O=S(=O)(N1CCCCCCC1)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F09	compound treatment	0.805	0.021	0.28	0.749	0.00654	0.09	0.263	0.887	1968896	Cerep_003627	Brc1cccc(c1)S(=O)(=O)NC2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F10	compound treatment	0.771	-0.013	-0.18	0.719	-0.0235	-0.32	-0.3506	-0.9603	1968897	Cerep_003628	CC1N(CCc2cc(O)c(O)cc12)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F11	compound treatment	0.79	0.00596	0.08	0.736	-0.00646	-0.09	-0.0055	-0.0457	1968898	Cerep_003629	COc1ccc(cc1)S(=O)(=O)NC(CO)Cc2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F12	compound treatment	0.759	-0.025	-0.34	0.697	-0.0455	-0.62	-0.6772	-0.9593	1968899	Cerep_003630	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)C4CC4C(=O)O)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F13	compound treatment	0.781	-0.00304	-0.04	0.74	-0.00246	-0.03	-0.0527	-0.995	1968900	Cerep_003631	COc1cc(CCNS(=O)(=O)c2ccc(C#N)cc2)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F14	compound treatment	0.755	-0.029	-0.39	0.732	-0.0105	-0.14	-0.3779	-0.9064	1968901	Cerep_003632	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F15	compound treatment	0.797	0.013	0.17	0.761	0.0185	0.25	0.3024	0.9838	1968902	Cerep_003633	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NC2CCN(Cc3ccccc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F16	compound treatment	0.773	-0.011	-0.15	0.739	-0.00346	-0.05	-0.1387	-0.8877	1968903	Cerep_003634	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F17	compound treatment	0.761	-0.023	-0.31	0.735	-0.00746	-0.1	-0.2917	-0.892	1968904	Cerep_003635	Cc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3c(C)c(C)cc(C)c3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F18	compound treatment	0.785	9.59E-4	0.01	0.734	-0.00846	-0.12	-0.0724	-0.6239	1968905	Cerep_003636	CN(CCc1ccccc1)C(=O)CSCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F19	compound treatment	0.777	-0.00704	-0.09	0.744	0.00154	0.02	-0.0523	-0.5379	1968906	Cerep_003637	OC1Cc2ccccc2C1NS(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F20	compound treatment	0.779	-0.00504	-0.07	0.704	-0.0385	-0.52	-0.4189	-0.7922	1968907	Cerep_003638	OC(=O)CSCC(=O)N1CCN(CC1)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F21	compound treatment	0.772	-0.012	-0.16	0.782	0.0395	0.54	0.2664	0.4731	1968908	Cerep_003639	COc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	F22	compound treatment	0.783	-0.00104	-0.01	0.736	-0.00646	-0.09	-0.0722	-0.8096	1968909	Cerep_003640	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CCCC(c3ccc(F)cc3)c4ccc(F)cc4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G03	compound treatment	0.786	0.00196	0.03	0.734	-0.00846	-0.12	-0.0629	-0.5313	1968910	Cerep_003641	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2cc(F)cc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G04	compound treatment	0.802	0.018	0.24	0.769	0.0265	0.36	0.4272	0.981	1968911	Cerep_003642	COc1cc(CN(Cc2ccco2)S(=O)(=O)c3ccc(F)c(F)c3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G05	compound treatment	0.779	-0.00504	-0.07	0.74	-0.00246	-0.03	-0.0718	-0.947	1968912	Cerep_003643	CC(=O)OCc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G06	compound treatment	0.794	0.00996	0.13	0.748	0.00554	0.08	0.1484	0.9629	1968913	Cerep_003644	COc1ccc(Cl)cc1S(=O)(=O)NC2CCN(Cc3ccc(OC(C)C)cc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G07	compound treatment	0.788	0.00396	0.05	0.744	0.00154	0.02	0.0526	0.9167	1968914	Cerep_003645	CN(C)CCCOc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G08	compound treatment	0.782	-0.00204	-0.03	0.77	0.0275	0.38	0.2461	0.6535	1968915	Cerep_003646	CN(C)CCNS(=O)(=O)c1ccc(cc1)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G09	compound treatment	0.789	0.00496	0.07	0.738	-0.00446	-0.06	0.0043	0.0475	1968916	Cerep_003647	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OC)ccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G10	compound treatment	0.793	0.00896	0.12	0.736	-0.00646	-0.09	0.0232	0.1549	1968917	Cerep_003648	Cc1ccc(cc1)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G11	compound treatment	0.763	-0.021	-0.28	0.75	0.00754	0.1	-0.128	-0.424	1968918	Cerep_003649	COc1ccc(Br)cc1/C=N/NC(=O)COc2ncn(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G12	compound treatment	0.794	0.00996	0.13	0.746	0.00354	0.05	0.1291	0.9045	1968919	Cerep_003650	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)NC2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G13	compound treatment	0.782	-0.00204	-0.03	0.733	-0.00946	-0.13	-0.1107	-0.8391	1968920	Cerep_003651	Oc1ccc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G14	compound treatment	0.8	0.016	0.22	0.742	-4.61E-4	-0.01	0.1478	0.6862	1968921	Cerep_003652	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G15	compound treatment	0.795	0.011	0.15	0.746	0.00354	0.05	0.1387	0.8916	1968922	Cerep_003653	COc1ccc(Oc2cccc(/C=N/NC(=O)CC3OC(=O)c4ccccc34)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G16	compound treatment	0.779	-0.00504	-0.07	0.741	-0.00146	-0.02	-0.0622	-0.8774	1968923	Cerep_003654	COCC(C)NS(=O)(=O)c1cc(C)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G17	compound treatment	0.809	0.025	0.34	0.776	0.0335	0.46	0.5615	0.9887	1968924	Cerep_003655	Oc1ccc2ccccc2c1/C=N/NC(=O)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G18	compound treatment	0.812	0.028	0.38	0.729	-0.0135	-0.18	0.1369	0.3264	1968925	Cerep_003656	COc1ccc(Cl)cc1S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G19	compound treatment	0.783	-0.00104	-0.01	0.745	0.00254	0.03	0.0146	0.3896	1968926	Cerep_003657	COc1ccc(Br)cc1/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G20	compound treatment	0.795	0.011	0.15	0.74	-0.00246	-0.03	0.0808	0.5331	1968927	Cerep_003658	Fc1ccc(c(F)c1)S(=O)(=O)N2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G21	compound treatment	0.791	0.00696	0.09	0.74	-0.00246	-0.03	0.0427	0.4279	1968928	Cerep_003659	Oc1ccc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	G22	compound treatment	0.801	0.017	0.23	0.75	0.00754	0.1	0.2345	0.9348	1968929	Cerep_003660	Cc1ccc(F)cc1S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H03	compound treatment	0.789	0.00496	0.07	0.743	5.39E-4	0.01	0.0525	0.7801	1140536	Cerep_003661	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cc(C)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H04	compound treatment	0.757	-0.027	-0.36	0.736	-0.00646	-0.09	-0.3202	-0.8533	1968930	Cerep_003662	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ncccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H05	compound treatment	0.78	-0.00404	-0.05	0.754	0.0115	0.16	0.0727	0.4367	1968931	Cerep_003663	Brc1ccccc1S(=O)(=O)N2CCN(CC2)c3cccc4[nH]ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H06	compound treatment	0.757	-0.027	-0.36	0.728	-0.0145	-0.2	-0.3974	-0.9583	1968932	Cerep_003664	COc1ccc(cc1)S(=O)(=O)N(C)CC(O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H07	compound treatment	0.82	0.036	0.49	0.774	0.0315	0.43	0.6471	0.9982	1968933	Cerep_003665	COc1ccc(CCNS(=O)(=O)c2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H08	compound treatment	0.779	-0.00504	-0.07	0.724	-0.0185	-0.25	-0.2261	-0.867	1968934	Cerep_003666	O=C(CN1CCN(CC1)S(=O)(=O)c2ccccc2C#N)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H09	compound treatment	0.791	0.00696	0.09	0.744	0.00154	0.02	0.0812	0.8443	1968935	Cerep_003667	OC1Cc2ccccc2C1NS(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H10	compound treatment	0.795	0.011	0.15	0.753	0.0105	0.14	0.2062	0.9999	1968936	Cerep_003668	OC(=O)C1CC1C(=O)N2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H11	compound treatment	0.781	-0.00304	-0.04	0.76	0.0175	0.24	0.1401	0.5774	1457003	Cerep_003669	COc1ccc(cc1)S(=O)(=O)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H12	compound treatment	0.766	-0.018	-0.24	0.708	-0.0345	-0.47	-0.5044	-0.9531	1968937	Cerep_003670	CCc1ccccc1N2CCN(CC2)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H13	compound treatment	0.763	-0.021	-0.28	0.744	0.00154	0.02	-0.1859	-0.653	1968938	Cerep_003671	CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H14	compound treatment	0.777	-0.00704	-0.09	0.726	-0.0165	-0.22	-0.2259	-0.9268	1968939	Cerep_003672	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)C2c3ccccc3-c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H15	compound treatment	0.773	-0.011	-0.15	0.728	-0.0145	-0.2	-0.2448	-0.9904	1968940	Cerep_003673	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H16	compound treatment	0.756	-0.028	-0.38	0.737	-0.00546	-0.07	-0.3201	-0.8304	1968941	Cerep_003674	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H17	compound treatment	0.766	-0.018	-0.24	0.764	0.0215	0.29	0.0356	0.0933	1267437	Cerep_003675	COc1ccc(cc1)N2CCN(CC2C)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H18	compound treatment	0.755	-0.029	-0.39	0.74	-0.00246	-0.03	-0.3008	-0.7649	1968942	Cerep_003676	OC(=O)CSCC(=O)N1CCN(CC1)c2cc(ccn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H19	compound treatment	0.8	0.016	0.22	0.774	0.0315	0.43	0.4564	0.9488	1968943	Cerep_003677	Fc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H20	compound treatment	0.765	-0.019	-0.26	0.711	-0.0315	-0.43	-0.485	-0.9699	1968944	Cerep_003678	OC(=O)CSCC(=O)N1CCN(CC1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H21	compound treatment	0.787	0.00296	0.04	0.743	5.39E-4	0.01	0.0334	0.8235	1968945	Cerep_003679	COc1ccc(cc1)S(=O)(=O)N(Cc2ccco2)Cc3cccc(Oc4ccc(Cl)cc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	H22	compound treatment	0.776	-0.00804	-0.11	0.721	-0.0215	-0.29	-0.2836	-0.9088	1968946	Cerep_003680	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I03	compound treatment	0.788	0.00396	0.05	0.761	0.0185	0.25	0.2165	0.838	1968947	Cerep_003681	Fc1cc(F)c(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I04	compound treatment	0.769	-0.015	-0.2	0.766	0.0235	0.32	0.0835	0.2199	1968948	Cerep_003682	CC(C)c1ccc(CN(Cc2ccco2)S(=O)(=O)c3ccc(F)c(F)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I05	compound treatment	0.765	-0.019	-0.26	0.751	0.00854	0.12	-0.0993	-0.3521	1968949	Cerep_003683	CCCCCc1ccc(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I06	compound treatment	0.774	-0.01	-0.14	0.731	-0.0115	-0.16	-0.2063	-0.9975	1968950	Cerep_003684	COc1ccc(Cl)cc1S(=O)(=O)NC2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I07	compound treatment	0.813	0.029	0.39	0.756	0.0135	0.18	0.4068	0.9414	1968951	Cerep_003685	COc1cccc(c1)C(=O)N/N=C/c2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I08	compound treatment	0.814	0.03	0.4	0.757	0.0145	0.2	0.426	0.9463	1968952	Cerep_003686	Cc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I09	compound treatment	0.771	-0.013	-0.18	0.732	-0.0105	-0.14	-0.2253	-0.9946	1968953	Cerep_003687	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccccc2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I10	compound treatment	0.802	0.018	0.24	0.739	-0.00346	-0.05	0.1379	0.5589	1968954	Cerep_003688	COc1ccc(cc1F)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(C)c(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I11	compound treatment	0.776	-0.00804	-0.11	0.729	-0.0135	-0.18	-0.2065	-0.9685	1968955	Cerep_003689	CC(C)Oc1ccc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I12	compound treatment	0.769	-0.015	-0.2	0.737	-0.00546	-0.07	-0.1961	-0.9074	1968956	Cerep_003690	Cc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I13	compound treatment	0.767	-0.017	-0.23	0.729	-0.0135	-0.18	-0.2924	-0.9938	1968957	Cerep_003691	Fc1cccc(Cl)c1/C=N/NC(=O)c2ccc3nonc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I14	compound treatment	0.809	0.025	0.34	0.743	5.39E-4	0.01	0.2433	0.7224	1968958	Cerep_003692	CCN(CCc1ccccn1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I15	compound treatment	0.792	0.00796	0.11	0.732	-0.0105	-0.14	-0.0249	-0.1397	1968959	Cerep_003693	Cc1ccc(Oc2cccc(/C=N/NC(=O)CC3OC(=O)c4ccccc34)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I16	compound treatment	0.783	-0.00104	-0.01	0.747	0.00454	0.06	0.0338	0.5332	1968960	Cerep_003694	CCN(CC)CCN(CC)S(=O)(=O)c1cc(C)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I17	compound treatment	0.792	0.00796	0.11	0.752	0.00954	0.13	0.1679	0.9955	1968961	Cerep_003695	Clc1ccc(Br)cc1C(=O)N/N=C/c2ccccc2OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I18	compound treatment	0.784	-4.08E-5	0.0	0.746	0.00354	0.05	0.0337	0.699	1968962	Cerep_003696	COc1ccc(Cl)cc1S(=O)(=O)NCC2CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I19	compound treatment	0.79	0.00596	0.08	0.767	0.0245	0.33	0.2935	0.8527	1968963	Cerep_003697	CC(C)Oc1ccc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I20	compound treatment	0.765	-0.019	-0.26	0.751	0.00854	0.12	-0.0993	-0.3521	1968964	Cerep_003698	Fc1ccc(c(F)c1)S(=O)(=O)NC2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I21	compound treatment	0.797	0.013	0.17	0.737	-0.00546	-0.07	0.071	0.3735	1968965	Cerep_003699	Fc1cccc(Cl)c1/C=N/NC(=O)CC2OC(=O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	I22	compound treatment	0.817	0.033	0.44	0.755	0.0125	0.17	0.4353	0.9138	1968966	Cerep_003700	Cc1ccc(F)cc1S(=O)(=O)NCC2CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J03	compound treatment	0.794	0.00996	0.13	0.736	-0.00646	-0.09	0.0327	0.2036	1130721	Cerep_003701	CC1CN(CCN1c2cccc(C)c2)S(=O)(=O)c3ccc(NC(=O)C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J04	compound treatment	0.785	9.59E-4	0.01	0.74	-0.00246	-0.03	-0.0146	-0.4053	1968967	Cerep_003702	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cc(Cl)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J05	compound treatment	0.775	-0.00904	-0.12	0.775	0.0325	0.44	0.2275	0.4944	1968968	Cerep_003703	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)S(=O)(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J06	compound treatment	0.766	-0.018	-0.24	0.752	0.00954	0.13	-0.0801	-0.2903	1183115	Cerep_003704	COc1ccc(cc1)S(=O)(=O)N2CCN(C)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J07	compound treatment	0.79	0.00596	0.08	0.753	0.0105	0.14	0.1585	0.9623	1968969	Cerep_003705	Cc1cccc(c1)S(=O)(=O)NCCC(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J08	compound treatment	0.779	-0.00504	-0.07	0.725	-0.0175	-0.24	-0.2164	-0.8741	1968970	Cerep_003706	O=S(=O)(NC1CCN(CC1)c2ccccc2)c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J09	compound treatment	0.765	-0.019	-0.26	0.753	0.0105	0.14	-0.08	-0.2718	1416595	Cerep_003707	Fc1ccccc1N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J10	compound treatment	0.764	-0.02	-0.27	0.73	-0.0125	-0.17	-0.3113	-0.975	1968971	Cerep_003708	OC(=O)C1CC1C(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J11	compound treatment	0.806	0.022	0.3	0.757	0.0145	0.2	0.3497	0.9809	1369887	Cerep_003709	COc1ccc(cc1)S(=O)(=O)NCc2ccccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J12	compound treatment	0.762	-0.022	-0.3	0.737	-0.00546	-0.07	-0.2629	-0.8577	1968972	Cerep_003710	COc1ccccc1C2CCN(CC2)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J13	compound treatment	0.774	-0.01	-0.14	0.749	0.00654	0.09	-0.0327	-0.2018	1968973	Cerep_003711	OC1(CNS(=O)(=O)c2ccc(C#N)cc2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J14	compound treatment	0.786	0.00196	0.03	0.726	-0.0165	-0.22	-0.14	-0.6196	1968974	Cerep_003712	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2cc(ccn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J15	compound treatment	0.781	-0.00304	-0.04	0.757	0.0145	0.2	0.1112	0.5492	1968975	Cerep_003713	CCN1CCCC1CNS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J16	compound treatment	0.758	-0.026	-0.35	0.716	-0.0265	-0.36	-0.5036	-0.9999	1968976	Cerep_003714	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J17	compound treatment	0.787	0.00296	0.04	0.744	0.00154	0.02	0.0431	0.9549	1968977	Cerep_003715	CCc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J18	compound treatment	0.751	-0.033	-0.45	0.705	-0.0375	-0.51	-0.6764	-0.9977	1968978	Cerep_003716	OC(=O)CSCC(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J19	compound treatment	0.797	0.013	0.17	0.763	0.0205	0.28	0.3217	0.9743	1600607	Cerep_003717	Clc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J20	compound treatment	0.783	-0.00104	-0.01	0.707	-0.0355	-0.48	-0.3519	-0.7273	1968979	Cerep_003718	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CC2)c3cccc(c3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J21	compound treatment	0.805	0.021	0.28	0.759	0.0165	0.23	0.3594	0.9937	1968980	Cerep_003719	COc1ccc(cc1)S(=O)(=O)N(Cc2ccco2)Cc3ccc(OC)c(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	J22	compound treatment	0.749	-0.035	-0.47	0.749	0.00654	0.09	-0.2712	-0.5638	1968981	Cerep_003720	COc1cccc(c1)N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K03	compound treatment	0.808	0.024	0.32	0.757	0.0145	0.2	0.3687	0.9725	1968982	Cerep_003721	COc1cccc(c1)C(=O)N/N=C/c2sc3ccccc3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K04	compound treatment	0.799	0.015	0.2	0.773	0.0305	0.42	0.4372	0.9447	1968983	Cerep_003722	Fc1ccc(cc1F)S(=O)(=O)NCc2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K05	compound treatment	0.779	-0.00504	-0.07	0.741	-0.00146	-0.02	-0.0622	-0.8774	1968984	Cerep_003723	[O-][N+](=O)c1ccc(o1)C(=O)N/N=C/c2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K06	compound treatment	0.788	0.00396	0.05	0.74	-0.00246	-0.03	0.014	0.2226	1968985	Cerep_003724	COCC(Cc1ccccc1)NS(=O)(=O)c2cc(Cl)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K07	compound treatment	0.799	0.015	0.2	0.771	0.0285	0.39	0.4179	0.9532	1968986	Cerep_003725	OC(=O)c1ccccc1/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K08	compound treatment	0.811	0.027	0.36	0.782	0.0395	0.54	0.6384	0.9816	1968987	Cerep_003726	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc(Oc4ccccc4)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K09	compound treatment	0.765	-0.019	-0.26	0.756	0.0135	0.18	-0.0511	-0.1615	1968988	Cerep_003727	COc1cc(OC)c(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K10	compound treatment	0.812	0.028	0.38	0.761	0.0185	0.25	0.4455	0.9811	1968989	Cerep_003728	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NC2CC3CCC2C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K11	compound treatment	0.802	0.018	0.24	0.757	0.0145	0.2	0.3115	0.995	1968990	Cerep_003729	COc1cc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)ccc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K12	compound treatment	0.795	0.011	0.15	0.748	0.00554	0.08	0.158	0.9514	1968991	Cerep_003730	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K13	compound treatment	0.765	-0.019	-0.26	0.748	0.00554	0.08	-0.1282	-0.4789	1968992	Cerep_003731	COc1cc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)cc(Br)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K14	compound treatment	0.783	-0.00104	-0.01	0.749	0.00654	0.09	0.0531	0.5885	1968993	Cerep_003732	Cc1nn(c(C)c1CN2CCC(C2)NS(=O)(=O)c3ccc(cc3)S(=O)(=O)C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K15	compound treatment	0.777	-0.00704	-0.09	0.77	0.0275	0.38	0.1984	0.5121	1968994	Cerep_003733	O=C(N/N=C/c1cccc(Oc2ccccc2)c1)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K16	compound treatment	0.788	0.00396	0.05	0.766	0.0235	0.32	0.2647	0.8136	1968995	Cerep_003734	COc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3cc(C)ccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K17	compound treatment	0.8	0.016	0.22	0.738	-0.00446	-0.06	0.1092	0.4882	1968996	Cerep_003735	Oc1c(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc(Br)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K18	compound treatment	0.79	0.00596	0.08	0.736	-0.00646	-0.09	-0.0055	-0.0457	1968997	Cerep_003736	COc1ccc(Cl)cc1S(=O)(=O)NCC(C)(C)CN(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K19	compound treatment	0.764	-0.02	-0.27	0.766	0.0235	0.32	0.0358	0.0853	1968998	Cerep_003737	COc1cc(/C=N/NC(=O)c2cc(Br)ccc2Cl)ccc1OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K20	compound treatment	0.796	0.012	0.16	0.755	0.0125	0.17	0.235	0.9996	1433635	Cerep_003738	Fc1ccc(c(F)c1)S(=O)(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K21	compound treatment	0.786	0.00196	0.03	0.742	-4.61E-4	-0.01	0.0142	0.5244	1968999	Cerep_003739	COc1cc(/C=N/NC(=O)c2cc(Br)ccc2Cl)cc(Br)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	K22	compound treatment	0.793	0.00896	0.12	0.755	0.0125	0.17	0.2064	0.9856	1969000	Cerep_003740	CN(C)CC(C)(C)CNS(=O)(=O)c1cc(F)ccc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L03	compound treatment	0.814	0.03	0.4	0.755	0.0125	0.17	0.4067	0.9267	1969001	Cerep_003741	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L04	compound treatment	0.767	-0.017	-0.23	0.722	-0.0205	-0.28	-0.3598	-0.9954	1969002	Cerep_003742	COc1ccc(cc1)S(=O)(=O)N(CCC#N)Cc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L05	compound treatment	0.782	-0.00204	-0.03	0.725	-0.0175	-0.24	-0.1878	-0.7836	1969003	Cerep_003743	CN(C)CCCNS(=O)(=O)c1ccccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L06	compound treatment	0.768	-0.016	-0.22	0.735	-0.00746	-0.1	-0.225	-0.9408	1433770	Cerep_003744	COc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L07	compound treatment	0.767	-0.017	-0.23	0.738	-0.00446	-0.06	-0.2056	-0.8645	1969004	Cerep_003745	COc1ccc(cc1)N2CCN(CC2C)S(=O)(=O)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L08	compound treatment	0.77	-0.014	-0.19	0.729	-0.0135	-0.18	-0.2637	-0.9999	1969005	Cerep_003746	CCN1CC(CN1CC)NS(=O)(=O)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L09	compound treatment	0.771	-0.013	-0.18	0.746	0.00354	0.05	-0.0903	-0.4948	1265556	Cerep_003747	Clc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L10	compound treatment	0.764	-0.02	-0.27	0.737	-0.00546	-0.07	-0.2438	-0.8695	1969006	Cerep_003748	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)C5CC5C(=O)O)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L11	compound treatment	0.788	0.00396	0.05	0.746	0.00354	0.05	0.0719	0.9987	1685172	Cerep_003749	CCc1ccc(NS(=O)(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L12	compound treatment	0.756	-0.028	-0.38	0.724	-0.0185	-0.25	-0.4455	-0.9804	1969007	Cerep_003750	CN(C1CCN(Cc2c(Cl)cccc2Cl)C1)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L13	compound treatment	0.797	0.013	0.17	0.76	0.0175	0.24	0.2927	0.9881	1969008	Cerep_003751	Cc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L14	compound treatment	0.773	-0.011	-0.15	0.718	-0.0245	-0.33	-0.3412	-0.934	1969009	Cerep_003752	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L15	compound treatment	0.773	-0.011	-0.15	0.745	0.00254	0.03	-0.0808	-0.5286	1969010	Cerep_003753	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NCc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L16	compound treatment	0.752	-0.032	-0.43	0.729	-0.0135	-0.18	-0.4354	-0.9272	1969011	Cerep_003754	OC(=O)CSCC(=O)N1CCC(=CC1)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L17	compound treatment	0.783	-0.00104	-0.01	0.746	0.00354	0.05	0.0242	0.4814	1969012	Cerep_003755	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCC(C)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L18	compound treatment	0.74	-0.044	-0.59	0.718	-0.0245	-0.33	-0.656	-0.9627	1969013	Cerep_003756	OC(=O)CSCC(=O)N1CCN(CC1)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L19	compound treatment	0.784	-4.08E-5	0.0	0.73	-0.0125	-0.17	-0.1205	-0.7094	1969014	Cerep_003757	Clc1ccc2nc(sc2c1)N3CCCN(CC3)S(=O)(=O)c4ccc(Br)s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L20	compound treatment	0.777	-0.00704	-0.09	0.755	0.0125	0.17	0.0537	0.2748	1969015	Cerep_003758	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCC(O)(CC2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L21	compound treatment	0.803	0.019	0.26	0.743	5.39E-4	0.01	0.1861	0.7271	1969016	Cerep_003759	COc1ccc(cc1)S(=O)(=O)NCCC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	L22	compound treatment	0.779	-0.00504	-0.07	0.728	-0.0145	-0.2	-0.1875	-0.899	1969017	Cerep_003760	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCN(CC2)c3ncccc3C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M03	compound treatment	0.788	0.00396	0.05	0.763	0.0205	0.28	0.2358	0.8271	1969018	Cerep_003761	Oc1cc2ccccc2cc1C(=O)N/N=C/c3cccc(c3F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M04	compound treatment	0.805	0.021	0.28	0.738	-0.00446	-0.06	0.1569	0.5426	1969019	Cerep_003762	CCOc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M05	compound treatment	0.778	-0.00604	-0.08	0.736	-0.00646	-0.09	-0.1199	-0.9992	1969020	Cerep_003763	Fc1ccc(/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M06	compound treatment	0.787	0.00296	0.04	0.746	0.00354	0.05	0.0624	0.9956	1969021	Cerep_003764	COc1ccc(Cl)cc1S(=O)(=O)NC(c2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M07	compound treatment	0.779	-0.00504	-0.07	0.771	0.0285	0.39	0.2271	0.5748	1969022	Cerep_003765	Oc1ccccc1/C=N/NC(=O)c2ccc(OC(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M08	compound treatment	0.804	0.02	0.27	0.807	0.0645	0.88	0.8127	0.883	1969023	Cerep_003766	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)NCCc2c[nH]c3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M09	compound treatment	0.783	-0.00104	-0.01	0.758	0.0155	0.21	0.1399	0.6588	1969024	Cerep_003767	CC(C)(C)Sc1ccccc1/C=N/NC(=O)c2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M10	compound treatment	0.816	0.032	0.43	0.76	0.0175	0.24	0.474	0.9614	1969025	Cerep_003768	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M11	compound treatment	0.768	-0.016	-0.22	0.754	0.0115	0.16	-0.0418	-0.156	1969026	Cerep_003769	COc1cc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc(OC)c1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M12	compound treatment	0.789	0.00496	0.07	0.751	0.00854	0.12	0.1296	0.9654	1969027	Cerep_003770	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M13	compound treatment	0.804	0.02	0.27	0.744	0.00154	0.02	0.2052	0.7599	1969028	Cerep_003771	COc1cc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M14	compound treatment	0.829	0.045	0.61	0.773	0.0305	0.42	0.7234	0.9832	1969029	Cerep_003772	CC(C)c1ccc(CN2CCC(C2)N(C)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M15	compound treatment	0.76	-0.024	-0.32	0.753	0.0105	0.14	-0.1277	-0.36	1969030	Cerep_003773	OC(=O)/C=C/c1ccc(\C=N\NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M16	compound treatment	0.793	0.00896	0.12	0.734	-0.00846	-0.12	0.0039	0.0232	1969031	Cerep_003774	COc1ccc(C)cc1S(=O)(=O)N2CCN(CC2)c3ccc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M17	compound treatment	0.789	0.00496	0.07	0.741	-0.00146	-0.02	0.0332	0.4759	1969032	Cerep_003775	O=C(N/N=C/c1cc(OCc2ccccc2)cc(OCc3ccccc3)c1)c4csc(CS(=O)(=O)Cc5ccco5)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M18	compound treatment	0.794	0.00996	0.13	0.746	0.00354	0.05	0.1291	0.9045	1969033	Cerep_003776	COc1ccc(Cl)cc1S(=O)(=O)NCCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M19	compound treatment	0.774	-0.01	-0.14	0.738	-0.00446	-0.06	-0.1388	-0.9347	1969034	Cerep_003777	COc1cc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc(OC)c1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M20	compound treatment	0.794	0.00996	0.13	0.749	0.00654	0.09	0.1581	0.9802	1969035	Cerep_003778	COc1cccc(CCNS(=O)(=O)c2ccc(F)cc2F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M21	compound treatment	0.798	0.014	0.19	0.761	0.0185	0.25	0.3119	0.9895	1969036	Cerep_003779	COc1cc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	M22	compound treatment	0.806	0.022	0.3	0.761	0.0185	0.25	0.3882	0.9969	1969037	Cerep_003780	Cc1ccc(F)cc1S(=O)(=O)NCCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N03	compound treatment	0.797	0.013	0.17	0.758	0.0155	0.21	0.2735	0.9954	1473550	Cerep_003781	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N04	compound treatment	0.8	0.016	0.22	0.755	0.0125	0.17	0.2731	0.9935	1969038	Cerep_003782	COc1ccc(cc1)S(=O)(=O)N(CCC#N)CC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N05	compound treatment	0.798	0.014	0.19	0.765	0.0225	0.31	0.3505	0.9724	1969039	Cerep_003783	Cc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N06	compound treatment	0.788	0.00396	0.05	0.749	0.00654	0.09	0.1008	0.97	1969040	Cerep_003784	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(C)cc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N07	compound treatment	0.761	-0.023	-0.31	0.793	0.0505	0.69	0.2675	0.3539	1969041	Cerep_003785	CCc1ccccc1N2CCN(CC2)S(=O)(=O)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N08	compound treatment	0.757	-0.027	-0.36	0.751	0.00854	0.12	-0.1756	-0.4586	1581446	Cerep_003786	OCC1CCCN(C1)S(=O)(=O)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N09	compound treatment	0.784	-4.08E-5	0.0	0.764	0.0215	0.29	0.2073	0.7058	1969042	Cerep_003787	Clc1ccc2nc(sc2c1)N3CCCN(CC3)S(=O)(=O)c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N10	compound treatment	0.777	-0.00704	-0.09	0.728	-0.0145	-0.2	-0.2066	-0.9439	1969043	Cerep_003788	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)C3CC3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N11	compound treatment	0.793	0.00896	0.12	0.767	0.0245	0.33	0.3221	0.9053	1969044	Cerep_003789	COc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc4ccccc4n3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N12	compound treatment	0.762	-0.022	-0.3	0.74	-0.00246	-0.03	-0.234	-0.7819	1969045	Cerep_003790	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)C(=O)C4CC4C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N13	compound treatment	0.805	0.021	0.28	0.729	-0.0135	-0.18	0.0701	0.2081	1969046	Cerep_003791	O=S(=O)(N(CCC#N)CCc1ccccn1)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N14	compound treatment	0.809	0.025	0.34	0.751	0.00854	0.12	0.3204	0.8994	1969047	Cerep_003792	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N15	compound treatment	0.741	-0.043	-0.58	0.75	0.00754	0.1	-0.3379	-0.573	1969048	Cerep_003793	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)NCc2cccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N16	compound treatment	0.784	-4.08E-5	0.0	0.722	-0.0205	-0.28	-0.1977	-0.7085	1969049	Cerep_003794	OC(=O)CSCC(=O)N1CCC(O)(CC1)c2ccc(Cl)c(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N17	compound treatment	0.8	0.016	0.22	0.722	-0.0205	-0.28	-0.0451	-0.1278	1969050	Cerep_003795	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCCc2ccc(OCc3ccccc3)c(OCc4ccccc4)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N18	compound treatment	0.768	-0.016	-0.22	0.738	-0.00446	-0.06	-0.196	-0.8721	1969051	Cerep_003796	OC(=O)CSCC(=O)N1CCN(CC1)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N19	compound treatment	0.768	-0.016	-0.22	0.718	-0.0245	-0.33	-0.3889	-0.9781	1969052	Cerep_003797	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCCN(CC2)c3nc4ccc(Cl)cc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N20	compound treatment	0.756	-0.028	-0.38	0.752	0.00954	0.13	-0.1755	-0.4387	1969053	Cerep_003798	COc1ccccc1N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N21	compound treatment	0.78	-0.00404	-0.05	0.761	0.0185	0.25	0.1402	0.5422	1969054	Cerep_003799	COc1ccc(cc1)S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	N22	compound treatment	0.755	-0.029	-0.39	0.716	-0.0265	-0.36	-0.5322	-0.9992	1969055	Cerep_003800	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O03	compound treatment	0.775	-0.00904	-0.12	0.762	0.0195	0.27	0.1022	0.3486	1969056	Cerep_003801	Oc1cc2ccccc2cc1C(=O)N/N=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O04	compound treatment	0.783	-0.00104	-0.01	0.766	0.0235	0.32	0.217	0.6755	1424380	Cerep_003802	COc1ccccc1C2CCN(CC2)S(=O)(=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O05	compound treatment	0.806	0.022	0.3	0.757	0.0145	0.2	0.3497	0.9809	1969057	Cerep_003803	CCCCc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O06	compound treatment	0.818	0.034	0.46	0.75	0.00754	0.1	0.3966	0.8448	1969058	Cerep_003804	COc1ccc(Cl)cc1S(=O)(=O)N2CCN(CCN3CCOCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O07	compound treatment	0.796	0.012	0.16	0.764	0.0215	0.29	0.3218	0.9602	1969059	Cerep_003805	CCOc1ccccc1/C=N/NC(=O)c2cccc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O08	compound treatment	0.805	0.021	0.28	0.758	0.0155	0.21	0.3498	0.9899	1969060	Cerep_003806	CCOc1ccccc1CN(Cc2ccco2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O09	compound treatment	0.847	0.063	0.85	0.804	0.0615	0.84	1.194	1.0	1969061	Cerep_003807	FC(F)(F)Oc1ccc(cc1)C(=O)N/N=C/c2ccccc2Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O10	compound treatment	0.777	-0.00704	-0.09	0.741	-0.00146	-0.02	-0.0812	-0.8372	1969062	Cerep_003808	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O11	compound treatment	0.79	0.00596	0.08	0.749	0.00654	0.09	0.1199	0.9987	1969063	Cerep_003809	CSc1ccc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O12	compound treatment	0.818	0.034	0.46	0.769	0.0265	0.36	0.5799	0.9932	1969064	Cerep_003810	CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(Cc2ccco2)Cc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O13	compound treatment	0.763	-0.021	-0.28	0.742	-4.61E-4	-0.01	-0.2052	-0.7226	1969065	Cerep_003811	COc1ccc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O14	compound treatment	0.802	0.018	0.24	0.762	0.0195	0.27	0.3597	0.9989	1969066	Cerep_003812	CCOc1ccccc1CNS(=O)(=O)c2cc(C)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O15	compound treatment	0.792	0.00796	0.11	0.746	0.00354	0.05	0.1101	0.9348	1969067	Cerep_003813	CCOc1cccc(/C=N/NC(=O)c2cc(Br)ccc2Cl)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O16	compound treatment	0.796	0.012	0.16	0.759	0.0165	0.23	0.2736	0.9865	1969068	Cerep_003814	COc1ccc(Cl)cc1S(=O)(=O)N(C)Cc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O17	compound treatment	0.784	-4.08E-5	0.0	0.763	0.0205	0.28	0.1977	0.7057	1969069	Cerep_003815	COc1cc(/C=N/NC(=O)CC2OC(=O)c3ccccc23)ccc1OCc4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O18	compound treatment	0.783	-0.00104	-0.01	0.746	0.00354	0.05	0.0242	0.4814	1969070	Cerep_003816	CN(C)c1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(F)cc3F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O19	compound treatment	0.787	0.00296	0.04	0.749	0.00654	0.09	0.0913	0.9343	1969071	Cerep_003817	CSc1ccc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O20	compound treatment	0.762	-0.022	-0.3	0.74	-0.00246	-0.03	-0.234	-0.7819	1969072	Cerep_003818	CN(Cc1cccnc1)S(=O)(=O)c2cc(F)ccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O21	compound treatment	0.789	0.00496	0.07	0.766	0.0235	0.32	0.2743	0.8365	1969073	Cerep_003819	COc1ccc(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	O22	compound treatment	0.802	0.018	0.24	0.751	0.00854	0.12	0.2537	0.9436	1969074	Cerep_003820	CN(C1CCN(Cc2cc3ccccc3o2)C1)S(=O)(=O)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P03	compound treatment	0.791	0.00696	0.09	0.78	0.0375	0.51	0.4284	0.8231	1969075	Cerep_003821	COc1ccc(cc1)N2CCN(CC2C)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P04	compound treatment	0.771	-0.013	-0.18	0.738	-0.00446	-0.06	-0.1674	-0.8994	1969076	Cerep_003822	COc1ccc(cc1)S(=O)(=O)NCc2ccc(F)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P05	compound treatment	0.766	-0.018	-0.24	0.732	-0.0105	-0.14	-0.273	-0.9676	1969077	Cerep_003823	COC(=O)c1csc2c(cc(nc12)N3CCN(CC3)S(=O)(=O)c4ccc(F)cc4F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P06	compound treatment	0.737	-0.047	-0.63	0.729	-0.0135	-0.18	-0.5785	-0.8757	1969078	Cerep_003824	OCC1CCCN1S(=O)(=O)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P07	compound treatment	0.775	-0.00904	-0.12	0.745	0.00254	0.03	-0.0618	-0.4871	1969079	Cerep_003825	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)S(=O)(=O)c4cc(Br)c(Cl)s4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P08	compound treatment	0.757	-0.027	-0.36	0.741	-0.00146	-0.02	-0.272	-0.7446	1969080	Cerep_003826	COc1ccc(CCN(C)C(=O)C2CC2C(=O)O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P09	compound treatment	0.682	-0.102	-1.38	0.699	-0.0435	-0.59	-1.3925	-0.9291	1969081	Cerep_003827	COc1ccc(cc1)S(=O)(=O)NC2C3CC4CC(C3)CC2C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P10	compound treatment	0.143	-0.641	-8.65	0.119	-0.623	-8.5	-12.1268	-1.0	1969082	Cerep_003828	OC(=O)C1CC1C(=O)N2CCC(CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P11	compound treatment	0.765	-0.019	-0.26	0.747	0.00454	0.06	-0.1379	-0.5218	1969083	Cerep_003829	Clc1ccc(s1)S(=O)(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P12	compound treatment	0.746	-0.038	-0.51	0.74	-0.00246	-0.03	-0.3866	-0.7517	1969084	Cerep_003830	CC(C)(CC(=O)O)CC(=O)N1CCC(=CC1)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P13	compound treatment	0.768	-0.016	-0.22	0.761	0.0185	0.25	0.0257	0.0774	1969085	Cerep_003831	Fc1cccc(F)c1S(=O)(=O)NC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P14	compound treatment	0.764	-0.02	-0.27	0.725	-0.0175	-0.24	-0.3595	-0.998	1969086	Cerep_003832	CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P15	compound treatment	0.777	-0.00704	-0.09	0.725	-0.0175	-0.24	-0.2355	-0.9188	1554764	Cerep_003833	CN1CCN(CC1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P16	compound treatment	0.753	-0.031	-0.42	0.724	-0.0185	-0.25	-0.4741	-0.9703	1969087	Cerep_003834	OC(=O)CSCC(=O)N1CCC(Cc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P17	compound treatment	0.76	-0.024	-0.32	0.741	-0.00146	-0.02	-0.2434	-0.7491	1969088	Cerep_003835	Brc1ccc(Br)c(c1)S(=O)(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P18	compound treatment	0.759	-0.025	-0.34	0.715	-0.0275	-0.37	-0.5037	-0.9987	1969089	Cerep_003836	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)CSCC(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P19	compound treatment	0.781	-0.00304	-0.04	0.735	-0.00746	-0.1	-0.1009	-0.9202	1969090	Cerep_003837	COc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3cc4OCOc4c(OC)c3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P20	compound treatment	0.755	-0.029	-0.39	0.72	-0.0225	-0.31	-0.4936	-0.9926	1969091	Cerep_003838	Cc1cc(C)c(C(=O)O)c(CC(C)(C)C(=O)N2CCC(O)(Cc3ccccc3)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P21	compound treatment	0.761	-0.023	-0.31	0.745	0.00254	0.03	-0.1953	-0.6245	1122946	Cerep_003839	CCc1cc(Br)ccc1S(=O)(=O)N2CCN(CC2)c3ncccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.537	P22	compound treatment	0.739	-0.045	-0.61	0.735	-0.00746	-0.1	-0.5016	-0.8142	1969092	Cerep_003840	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)C(C)(C)Cc3cc(C)cc(C)c3C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A03	compound treatment	0.802	0.0231	0.31	0.745	1.29E-4	0.0	0.2219	0.7111	1969093	Cerep_003841	Brc1ccc(CCOC(=O)NCCNc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A04	compound treatment	0.823	0.0441	0.6	0.743	-0.00187	-0.03	0.4029	0.6762	1969094	Cerep_003842	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)OCC(C)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A05	compound treatment	0.793	0.0141	0.19	0.739	-0.00587	-0.08	0.0782	0.3781	1969095	Cerep_003843	COc1ccc(OCCNC(=O)OCCC(C)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A06	compound treatment	0.815	0.0361	0.49	0.726	-0.0189	-0.26	0.1627	0.2951	1969096	Cerep_003844	O=C(NC1CCN(Cc2ccccc2)C1)OCCc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A07	compound treatment	0.791	0.0121	0.16	0.739	-0.00587	-0.08	0.0591	0.3243	1969097	Cerep_003845	Fc1cccc(Cl)c1COC(=O)NNC(=O)Cn2nnc(n2)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A08	compound treatment	0.788	0.00913	0.12	0.752	0.00713	0.1	0.1558	0.9931	1969098	Cerep_003846	COc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ccc(cc4)C(F)(F)F)CC2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A09	compound treatment	0.787	0.00813	0.11	0.723	-0.0219	-0.3	-0.1334	-0.4197	1969099	Cerep_003847	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3ccc(c(F)c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A10	compound treatment	0.782	0.00313	0.04	0.745	1.29E-4	0.0	0.0311	0.7358	1969100	Cerep_003848	NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A11	compound treatment	0.786	0.00713	0.1	0.724	-0.0209	-0.28	-0.1333	-0.4435	1969101	Cerep_003849	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4ccc(C)c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A12	compound treatment	0.787	0.00813	0.11	0.756	0.0111	0.15	0.1848	0.9873	1969102	Cerep_003850	COC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A13	compound treatment	0.727	-0.0519	-0.7	0.727	-0.0179	-0.24	-0.6671	-0.9003	1969103	Cerep_003851	FC(F)(F)c1ccc2Sc3ccccc3N(CCCN4CCN(CCOC(=O)N5CCC(=CC5)n6c(=O)[nH]c7ccccc67)CC4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A14	compound treatment	0.787	0.00813	0.11	0.745	1.29E-4	0.0	0.0788	0.7183	1969104	Cerep_003852	COc1ccc2ccccc2c1CN3CCCC(COC(=O)NCCc4c[nH]c5ccc(Cl)cc45)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A15	compound treatment	0.779	1.29E-4	0.0	0.728	-0.0169	-0.23	-0.1615	-0.7018	1969105	Cerep_003853	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3ccccc3CCc4ccccc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A16	compound treatment	0.817	0.0381	0.51	0.739	-0.00587	-0.08	0.3071	0.5899	1969106	Cerep_003854	Oc1ccccc1C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A17	compound treatment	0.791	0.0121	0.16	0.732	-0.0129	-0.18	-0.0084	-0.0351	1969107	Cerep_003855	CC(COC(=O)NNC(=O)c1ccc(cc1)c2ccccc2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A18	compound treatment	0.807	0.0281	0.38	0.74	-0.00487	-0.07	0.2214	0.5746	1969108	Cerep_003856	COc1ccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(nc5cc(nn45)C(C)(C)C)C(F)(F)F)CC2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A19	compound treatment	0.81	0.0311	0.42	0.75	0.00513	0.07	0.3464	0.8137	1969109	Cerep_003857	CCCCCCC#CCCOC(=O)NCCc1c[nH]c2ccc(OC)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A20	compound treatment	0.793	0.0141	0.19	0.735	-0.00987	-0.13	0.0396	0.1697	1969110	Cerep_003858	COc1cccc(CCOC(=O)NC2CCN(Cc3c(C)nn(c3C)c4ccccc4)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A21	compound treatment	0.76	-0.0189	-0.25	0.756	0.0111	0.15	-0.0727	-0.2453	1969111	Cerep_003859	COc1ccc(CN2CCN(CC2)C(=O)OCc3ccc(c(F)c3)C(F)(F)F)cc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	A22	compound treatment	0.811	0.0321	0.43	0.748	0.00313	0.04	0.3367	0.773	1969112	Cerep_003860	FC(F)COC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B03	compound treatment	0.825	0.0461	0.62	0.77	0.0251	0.34	0.6823	0.9605	1969113	Cerep_003861	COc1ccc(OC)c(COC(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B04	compound treatment	0.749	-0.0299	-0.4	0.732	-0.0129	-0.18	-0.4091	-0.9306	1969114	Cerep_003862	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NCCCN3CCCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B05	compound treatment	0.786	0.00713	0.1	0.764	0.0191	0.26	0.2524	0.9081	1969115	Cerep_003863	CC(COC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl)C2CCC(=CC2)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B06	compound treatment	0.785	0.00613	0.08	0.736	-0.00887	-0.12	-0.0271	-0.1848	1969116	Cerep_003864	CN(C)CCCN(C)C(=O)c1cc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B07	compound treatment	0.785	0.00613	0.08	0.742	-0.00287	-0.04	0.0308	0.3364	1969117	Cerep_003865	O=C(NCc1cccnc1)OCc2ccc(/C=C/c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B08	compound treatment	0.746	-0.0329	-0.44	0.736	-0.00887	-0.12	-0.3991	-0.8683	1969118	Cerep_003866	COc1c(cnc2n(C)nc(C)c12)C(=O)NC(CCCCNC(=O)OCc3ccccc3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B09	compound treatment	0.777	-0.00187	-0.03	0.747	0.00213	0.03	0.0027	0.0694	1969119	Cerep_003867	COc1ccc(CCCOC(=O)N2CCC(C2)NC(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B10	compound treatment	0.803	0.0241	0.33	0.746	0.00113	0.02	0.2411	0.7397	1969120	Cerep_003868	COc1ccc(OCCNC(=O)OCCc2cccc(C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B11	compound treatment	0.768	-0.0109	-0.15	0.756	0.0111	0.15	0.0036	0.0171	1969121	Cerep_003869	CCOc1ccsc1C(=O)NNC(=O)OCC(CC2CCCCC2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B12	compound treatment	0.758	-0.0209	-0.28	0.746	0.00113	0.02	-0.1882	-0.6675	1879775	Cerep_003870	COc1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B13	compound treatment	0.765	-0.0139	-0.19	0.746	0.00113	0.02	-0.1214	-0.6468	1969122	Cerep_003871	Cc1cccc(CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B14	compound treatment	0.747	-0.0319	-0.43	0.708	-0.0369	-0.5	-0.6596	-0.997	1969123	Cerep_003872	COc1cc(CN2CCN(CCOC(=O)NNC(=O)c3ccc4OCOc4c3)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B15	compound treatment	0.767	-0.0119	-0.16	0.766	0.0211	0.29	0.0905	0.2745	1969124	Cerep_003873	COc1cc(CN2CCN(CCOC(=O)NNC(=O)C(C)n3nnc(n3)N4CCOCC4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B16	compound treatment	0.772	-0.00687	-0.09	0.735	-0.00987	-0.13	-0.1607	-0.9834	1969125	Cerep_003874	O=C(N1CCC(CC1)n2c(=O)[nH]c3ccccc23)c4csc(n4)c5cnccn5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B17	compound treatment	0.787	0.00813	0.11	0.747	0.00213	0.03	0.0981	0.8645	1969126	Cerep_003875	CN1CCN(C)C(C1)C(=O)NNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B18	compound treatment	0.749	-0.0299	-0.4	0.693	-0.0519	-0.71	-0.7851	-0.9644	1969127	Cerep_003876	COc1ccc(cc1)C(=O)NCc2cc(cc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B19	compound treatment	0.786	0.00713	0.1	0.755	0.0101	0.14	0.1657	0.9843	1969128	Cerep_003877	COc1ccc(OC)c(COC(=O)NCc2csc3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B20	compound treatment	0.762	-0.0169	-0.23	0.727	-0.0179	-0.24	-0.3333	-0.9994	1969129	Cerep_003878	Cc1sc(nc1CC(=O)NC2CCOC2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B21	compound treatment	0.785	0.00613	0.08	0.738	-0.00687	-0.09	-0.0078	-0.0624	1969130	Cerep_003879	Cc1ncc([N+](=O)[O-])n1CCOC(=O)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	B22	compound treatment	0.745	-0.0339	-0.46	0.694	-0.0509	-0.69	-0.8136	-0.9795	1969131	Cerep_003880	C=CCOc1ccc(CN2CCN(CC2)C(=O)CNC(=O)c3ccco3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C03	compound treatment	0.796	0.0171	0.23	0.773	0.0281	0.38	0.4346	0.9706	1969132	Cerep_003881	Cc1ccc(CCOC(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C04	compound treatment	0.81	0.0311	0.42	0.759	0.0141	0.19	0.4332	0.9376	1969133	Cerep_003882	O=C(NNC(=O)C1c2ccccc2Oc3ccccc13)OCCSCc4ccc5nonc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C05	compound treatment	0.796	0.0171	0.23	0.76	0.0151	0.21	0.3093	0.9984	1969134	Cerep_003883	Fc1cccc(CCNC(=O)OCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C06	compound treatment	0.789	0.0101	0.14	0.768	0.0231	0.32	0.3196	0.9299	1969135	Cerep_003884	Oc1cccc(c1)C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C07	compound treatment	0.776	-0.00287	-0.04	0.765	0.0201	0.27	0.1667	0.6014	1969136	Cerep_003885	Cc1cccc2c(CCNC(=O)OCc3cccc(OCc4ccccc4)c3)c[nH]c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C08	compound treatment	0.781	0.00213	0.03	0.76	0.0151	0.21	0.1662	0.7978	1969137	Cerep_003886	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ncnc5sccc45)CC2)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C09	compound treatment	0.78	0.00113	0.02	0.761	0.0161	0.22	0.1663	0.7542	1969138	Cerep_003887	Fc1ccc(C(=O)N2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C10	compound treatment	0.777	-0.00187	-0.03	0.749	0.00413	0.06	0.022	0.3559	1969139	Cerep_003888	CC(C)(C)OC(=O)N(CCOC(=O)NC1CCN(Cc2ccccc2)C1)C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C11	compound treatment	0.761	-0.0179	-0.24	0.763	0.0181	0.25	0.0043	0.0125	1969140	Cerep_003889	O=C(OCCN1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1)N4CCN(CC4)c5cccc6[nH]ccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C12	compound treatment	0.807	0.0281	0.38	0.748	0.00313	0.04	0.2985	0.7817	1969141	Cerep_003890	Fc1cccc(CCNC(=O)OCCc2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C13	compound treatment	0.765	-0.0139	-0.19	0.74	-0.00487	-0.07	-0.1793	-0.9029	1969142	Cerep_003891	COc1ccc(OC)c(CN2CCCCC2COC(=O)NCCc3c[nH]c4ccc(C)cc34)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C14	compound treatment	0.789	0.0101	0.14	0.732	-0.0129	-0.18	-0.0275	-0.1236	1969143	Cerep_003892	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3cccc(SC(F)(F)F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C15	compound treatment	0.768	-0.0109	-0.15	0.723	-0.0219	-0.3	-0.3146	-0.9466	1969144	Cerep_003893	Clc1ccc2[nH]cc(CCNC(=O)OCc3ccccn3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C16	compound treatment	0.788	0.00913	0.12	0.766	0.0211	0.29	0.2908	0.9281	1969145	Cerep_003894	Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)OCc3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C17	compound treatment	0.764	-0.0149	-0.2	0.746	0.00113	0.02	-0.131	-0.651	1969146	Cerep_003895	OC1(CCN(CC1)C(=O)OCC2CCOC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C18	compound treatment	0.797	0.0181	0.24	0.757	0.0121	0.17	0.2899	0.9819	1969147	Cerep_003896	COc1cc(CN2CCN(CCOC(=O)N3CCCN(CC3)c4nc5ccc(Cl)cc5s4)CC2)cc6OCOc61
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C19	compound treatment	0.803	0.0241	0.33	0.699	-0.0459	-0.63	-0.2121	-0.3008	1969148	Cerep_003897	Clc1ccccc1N2CCN(CC2)C(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C20	compound treatment	0.802	0.0231	0.31	0.76	0.0151	0.21	0.3665	0.9798	1969149	Cerep_003898	Cc1cccc(CCOC(=O)NCc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C21	compound treatment	0.788	0.00913	0.12	0.752	0.00713	0.1	0.1558	0.9931	1969150	Cerep_003899	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCCc3scnc3C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	C22	compound treatment	0.796	0.0171	0.23	0.75	0.00513	0.07	0.2128	0.8816	1969151	Cerep_003900	Cc1ccccc1CCOC(=O)NNC(=O)c2cccc(O)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D03	compound treatment	0.797	0.0181	0.24	0.763	0.0181	0.25	0.3477	1.0	1969152	Cerep_003901	COc1cc(COC(=O)N2CCN(Cc3ccccc3OCc4ccccc4)CC2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D04	compound treatment	0.769	-0.00987	-0.13	0.727	-0.0179	-0.24	-0.2665	-0.9596	1969153	Cerep_003902	FC(F)(F)c1ccc(SCc2ccc(o2)C(=O)NNC(=O)c3csc(n3)c4cnccn4)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D05	compound treatment	0.787	0.00813	0.11	0.762	0.0171	0.23	0.2427	0.9406	1969154	Cerep_003903	COc1cc(CCNC(=O)OCC2(CC2)c3ccc(Cl)cc3)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D06	compound treatment	0.764	-0.0149	-0.2	0.752	0.00713	0.1	-0.0731	-0.328	1969155	Cerep_003904	CSc1sc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c2CCCC3(SCCS3)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D07	compound treatment	0.771	-0.00787	-0.11	0.758	0.0131	0.18	0.0515	0.2474	1969156	Cerep_003905	O=C(OCc1ccc2ccccc2c1)N3CCN(CC3)c4nccnc4C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D08	compound treatment	0.763	-0.0159	-0.21	0.729	-0.0159	-0.22	-0.3044	-1.0	1969157	Cerep_003906	COc1c(cnc2n(C)nc(C)c12)C(=O)NC(CCCCNC(=O)OCc3ccccc3)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D09	compound treatment	0.762	-0.0169	-0.23	0.729	-0.0159	-0.22	-0.314	-0.9997	1969158	Cerep_003907	Clc1ncn(CC(=O)NNC(=O)OCCCCCc2ccccc2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D10	compound treatment	0.775	-0.00387	-0.05	0.745	1.29E-4	0.0	-0.0357	-0.683	1969159	Cerep_003908	Brc1ccc(CCOC(=O)NC(CSCc2ccccc2)C(=O)Nc3ccc4ccccc4c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D11	compound treatment	0.781	0.00213	0.03	0.751	0.00613	0.08	0.0794	0.8985	1969160	Cerep_003909	O=C(OCCN1CCNC1=S)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D12	compound treatment	0.78	0.00113	0.02	0.704	-0.0409	-0.56	-0.3833	-0.6875	1969161	Cerep_003910	CN(CCc1c[nH]c2ccccc12)C(=O)c3csc(n3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D13	compound treatment	0.78	0.00113	0.02	0.744	-8.71E-4	-0.01	0.0024	0.1223	1969162	Cerep_003911	Clc1ccc(CCOC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D14	compound treatment	0.761	-0.0179	-0.24	0.716	-0.0289	-0.39	-0.4489	-0.9723	1969163	Cerep_003912	O=C(OCCN1CCN(Cc2ccccc2OCc3ccccc3)CC1)N4CCC(=CC4)n5c(=O)[nH]c6ccccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D15	compound treatment	0.779	1.29E-4	0.0	0.746	0.00113	0.02	0.0121	0.7818	1969164	Cerep_003913	CC(C)C(NC(=O)OCCc1ccc(C)cc1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D16	compound treatment	0.759	-0.0199	-0.27	0.728	-0.0169	-0.23	-0.3522	-0.9971	1969165	Cerep_003914	COc1ccc(CNC(=O)c2ccc(C)cc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D17	compound treatment	0.797	0.0181	0.24	0.752	0.00713	0.1	0.2417	0.9183	1969166	Cerep_003915	Cc1cccc(C(=O)NNC(=O)OCCN2CCN(Cc3cc4ccccc4o3)CC2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D18	compound treatment	0.772	-0.00687	-0.09	0.721	-0.0239	-0.33	-0.2957	-0.8737	1969167	Cerep_003916	CCN(CCNC(=O)c1ccc(OC)cc1)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D19	compound treatment	0.783	0.00413	0.06	0.74	-0.00487	-0.07	-0.0076	-0.0875	1969168	Cerep_003917	CC1(C)C2CC1C(COC(=O)N3CCc4c(C3)[nH]c5ccccc45)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D20	compound treatment	0.744	-0.0349	-0.47	0.746	0.00113	0.02	-0.3218	-0.6836	1969169	Cerep_003918	Cc1sc(nc1CC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D21	compound treatment	0.81	0.0311	0.42	0.775	0.0301	0.41	0.5875	0.9999	1969170	Cerep_003919	COc1ccc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	D22	compound treatment	0.761	-0.0179	-0.24	0.722	-0.0229	-0.31	-0.391	-0.9919	1969171	Cerep_003920	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NCc3ccc4OCCc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E03	compound treatment	0.795	0.0161	0.22	0.755	0.0101	0.14	0.2515	0.9759	1969172	Cerep_003921	Fc1ccc(cc1)N2CCN(CC2)C(=O)OCC#Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E04	compound treatment	0.754	-0.0249	-0.34	0.737	-0.00787	-0.11	-0.3132	-0.8889	1969173	Cerep_003922	FC(F)(F)Oc1ccccc1COC(=O)NCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E05	compound treatment	0.773	-0.00587	-0.08	0.755	0.0101	0.14	0.0417	0.2616	1969174	Cerep_003923	COc1ccc(CCCOC(=O)NCCc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E06	compound treatment	0.798	0.0191	0.26	0.734	-0.0109	-0.15	0.0776	0.2609	1969175	Cerep_003924	Fc1ccc(CC(=O)N2CCN(CC2)C(=O)OCc3ccc(cc3)c4ccccc4)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E07	compound treatment	0.764	-0.0149	-0.2	0.743	-0.00187	-0.03	-0.1599	-0.7907	1969176	Cerep_003925	CC(C)(C)OC(=O)NCCCOC(=O)N1CCN(CC1)c2cccc3[nH]ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E08	compound treatment	0.817	0.0381	0.51	0.752	0.00713	0.1	0.4325	0.8261	1969177	Cerep_003926	O=C(NCc1csc2ccccc12)OCCN3CCN(Cc4ccccc4OCc5ccccc5)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E09	compound treatment	0.774	-0.00487	-0.07	0.759	0.0141	0.19	0.0898	0.441	1969178	Cerep_003927	CC(C)(C)OC(=O)N(CCOC(=O)NCCc1c[nH]c2ccc(O)cc12)Cc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E10	compound treatment	0.785	0.00613	0.08	0.763	0.0181	0.25	0.2333	0.8949	1969179	Cerep_003928	NS(=O)(=O)c1ccc(CNC(=O)OCCC2CCCCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E11	compound treatment	0.773	-0.00587	-0.08	0.734	-0.0109	-0.15	-0.1608	-0.9569	1969180	Cerep_003929	COc1ccc2c(CCNC(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3)c[nH]c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E12	compound treatment	0.801	0.0221	0.3	0.744	-8.71E-4	-0.01	0.2027	0.6784	1969181	Cerep_003930	COc1ccc2[nH]cc(CCNC(=O)OCCc3ccc(Cl)cc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E13	compound treatment	0.775	-0.00387	-0.05	0.677	-0.0679	-0.93	-0.6914	-0.7458	1969182	Cerep_003931	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCCN3Cc4ccc(OCC=C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E14	compound treatment	0.775	-0.00387	-0.05	0.742	-0.00287	-0.04	-0.0646	-0.9899	1969183	Cerep_003932	CCOc1ccc(cc1)N2CCN(CC2)C(=O)OCCN(C/C=C/c3ccccc3)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E15	compound treatment	0.761	-0.0179	-0.24	0.739	-0.00587	-0.08	-0.2271	-0.8939	1969184	Cerep_003933	COc1ccc(cc1)C(=O)NNC(=O)OCCn2cccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E16	compound treatment	0.777	-0.00187	-0.03	0.735	-0.00987	-0.13	-0.113	-0.8253	1969185	Cerep_003934	Cc1ccc2[nH]cc(CCNC(=O)OCc3c(F)cccc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E17	compound treatment	0.771	-0.00787	-0.11	0.728	-0.0169	-0.23	-0.2378	-0.9384	1969186	Cerep_003935	CC(C)(C)c1ccc(CN2CCN(CC2)C(=O)OCC(Cc3ccccc3)N(Cc4ccccc4)Cc5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E18	compound treatment	0.788	0.00913	0.12	0.745	1.29E-4	0.0	0.0883	0.7171	1969187	Cerep_003936	O=C(NCc1ccc2OCCc2c1)OCCN3CCN(Cc4ccccc4OCc5ccccc5)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E19	compound treatment	0.782	0.00313	0.04	0.767	0.0221	0.3	0.2432	0.7982	1969188	Cerep_003937	Fc1cccc(CCOC(=O)NNC(=O)/C=C/c2ccc(F)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E20	compound treatment	0.791	0.0121	0.16	0.774	0.0291	0.4	0.3966	0.9231	1969189	Cerep_003938	Brc1ccc(CCOC(=O)NC2CCCC2OCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E21	compound treatment	0.786	0.00713	0.1	0.773	0.0281	0.38	0.3392	0.8578	1969190	Cerep_003939	COC(=O)C1CC(CN1C(=O)OCc2cc(OC)c(OC)cc2Cl)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	E22	compound treatment	0.785	0.00613	0.08	0.76	0.0151	0.21	0.2043	0.9194	1969191	Cerep_003940	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCCCc4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F03	compound treatment	0.801	0.0221	0.3	0.775	0.0301	0.41	0.5016	0.9877	1969192	Cerep_003941	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc(Cl)cc3[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F04	compound treatment	0.787	0.00813	0.11	0.726	-0.0189	-0.26	-0.1044	-0.3733	1969193	Cerep_003942	CCCCCCc1ccc(cc1)C(=O)NC(CO)Cc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F05	compound treatment	0.769	-0.00987	-0.13	0.757	0.0121	0.17	0.0228	0.1073	1969194	Cerep_003943	Fc1ccc(COC(=O)N2CCN(CC2)c3ccc(Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F06	compound treatment	0.749	-0.0299	-0.4	0.734	-0.0109	-0.15	-0.3898	-0.9078	1969195	Cerep_003944	O=C(N1CCN(C/C=C/c2ccccc2)CC1)c3nccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F07	compound treatment	0.754	-0.0249	-0.34	0.741	-0.00387	-0.05	-0.2746	-0.8084	1969196	Cerep_003945	COc1cc(OC)c(CN2CCN(CC2)C(=O)OCc3cccc(C)n3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F08	compound treatment	0.766	-0.0129	-0.17	0.72	-0.0249	-0.34	-0.3626	-0.9517	1969197	Cerep_003946	O=C(CC1Cc2ccccc2C1)NNC(=O)c3ccc4nsnc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F09	compound treatment	0.776	-0.00287	-0.04	0.753	0.00813	0.11	0.051	0.4342	1969198	Cerep_003947	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F10	compound treatment	0.757	-0.0219	-0.3	0.714	-0.0309	-0.42	-0.5063	-0.9849	1969199	Cerep_003948	Cc1ccc(CCOC(=O)NNC(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F11	compound treatment	0.786	0.00713	0.1	0.748	0.00313	0.04	0.0982	0.9331	1969200	Cerep_003949	Clc1ccc(cc1)S(=O)(=O)N(CCC(=O)NNC(=O)OCCSCc2ccc3nonc3c2)Cc4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F12	compound treatment	0.746	-0.0329	-0.44	0.696	-0.0489	-0.67	-0.7848	-0.9804	1969201	Cerep_003950	CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c2csc(n2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F13	compound treatment	0.79	0.0111	0.15	0.754	0.00913	0.12	0.1942	0.9957	1969202	Cerep_003951	O=C(NNC(=O)c1csc(CS(=O)(=O)Cc2ccco2)n1)OCCOc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F14	compound treatment	0.751	-0.0279	-0.38	0.731	-0.0139	-0.19	-0.3996	-0.9495	1969203	Cerep_003952	CC1CN(CCN1c2cccc(C)c2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F15	compound treatment	0.783	0.00413	0.06	0.775	0.0301	0.41	0.3299	0.7957	1969204	Cerep_003953	CC(CCOC(=O)N1CCC(CC1)C(=O)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F16	compound treatment	0.77	-0.00887	-0.12	0.749	0.00413	0.06	-0.0448	-0.3389	1969205	Cerep_003954	COC(=O)C(Cc1cn(Cc2ccccc2)cn1)NC(=O)CC3Cc4ccccc4C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F17	compound treatment	0.745	-0.0339	-0.46	0.744	-8.71E-4	-0.01	-0.3315	-0.7253	1969206	Cerep_003955	CC(C)(C)Sc1ccccc1CN2CCCC(COC(=O)N3CCN(CC3)c4sc(cc4[N+](=O)[O-])S(=O)(=O)N)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F18	compound treatment	0.778	-8.71E-4	-0.01	0.747	0.00213	0.03	0.0122	0.3899	1969207	Cerep_003956	Cc1ccc(C)n1C2=C(C=CC2)C(=O)NNC(=O)Cc3nc(sc3C)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F19	compound treatment	0.783	0.00413	0.06	0.753	0.00813	0.11	0.1178	0.9493	1969208	Cerep_003957	CC(C)(C)OC(=O)NC(COC(=O)N1CCc2c(C1)[nH]c3ccccc23)CC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F20	compound treatment	0.778	-8.71E-4	-0.01	0.712	-0.0329	-0.45	-0.3253	-0.7254	1969209	Cerep_003958	Cc1sc(nc1CC(=O)NCCc2cccc(F)c2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F21	compound treatment	0.771	-0.00787	-0.11	0.785	0.0401	0.55	0.3118	0.5594	1969210	Cerep_003959	Cc1ccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	F22	compound treatment	0.766	-0.0129	-0.17	0.741	-0.00387	-0.05	-0.1601	-0.8822	1969211	Cerep_003960	Cc1oc(nc1CC(=O)N2CCCC(O)C2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G03	compound treatment	0.788	0.00913	0.12	0.747	0.00213	0.03	0.1076	0.8505	1969212	Cerep_003961	CCCCCCC#CCCOC(=O)NNC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G04	compound treatment	0.785	0.00613	0.08	0.786	0.0411	0.56	0.455	0.8027	1969213	Cerep_003962	CC(C)(O)C#Cc1ccc(COC(=O)N2CCN(CC2)c3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G05	compound treatment	0.769	-0.00987	-0.13	0.747	0.00213	0.03	-0.0736	-0.5403	1969214	Cerep_003963	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G06	compound treatment	0.784	0.00513	0.07	0.741	-0.00387	-0.05	0.0116	0.1332	1969215	Cerep_003964	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCc3ccccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G07	compound treatment	0.78	0.00113	0.02	0.759	0.0141	0.19	0.147	0.7606	1969216	Cerep_003965	COc1ccc(F)c(CN2CCCC(COC(=O)NCCc3c[nH]c4ccc(C)cc34)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G08	compound treatment	0.766	-0.0129	-0.17	0.747	0.00213	0.03	-0.1023	-0.5809	1969217	Cerep_003966	Cc1cccc(c1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G09	compound treatment	0.79	0.0111	0.15	0.746	0.00113	0.02	0.117	0.7755	1969218	Cerep_003967	[O-][N+](=O)c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)OCCc3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G10	compound treatment	0.786	0.00713	0.1	0.74	-0.00487	-0.07	0.021	0.1799	1969219	Cerep_003968	COc1ccc(CNC(=O)OCCc2ccccc2F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G11	compound treatment	0.761	-0.0179	-0.24	0.75	0.00513	0.07	-0.121	-0.4821	1969220	Cerep_003969	COc1cccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cc(OC)cc(OC)c4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G12	compound treatment	0.782	0.00313	0.04	0.74	-0.00487	-0.07	-0.0171	-0.2176	1969221	Cerep_003970	CC(CCOC(=O)Nc1ccc(cc1)C(C)(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G13	compound treatment	0.769	-0.00987	-0.13	0.728	-0.0169	-0.23	-0.2568	-0.9662	1969222	Cerep_003971	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ccc(C)c(C)c4)CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G14	compound treatment	0.792	0.0131	0.18	0.741	-0.00387	-0.05	0.0879	0.4757	1969223	Cerep_003972	Cc1ccc(N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G15	compound treatment	0.779	1.29E-4	0.0	0.744	-8.71E-4	-0.01	-0.0072	-0.5976	1969224	Cerep_003973	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCC3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G16	compound treatment	0.78	0.00113	0.02	0.735	-0.00987	-0.13	-0.0844	-0.6232	1969225	Cerep_003974	CCOc1ccc(CCOC(=O)N2CCc3c(C2)[nH]c4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G17	compound treatment	0.791	0.0121	0.16	0.762	0.0171	0.23	0.2809	0.9848	1969226	Cerep_003975	FC(F)(F)c1ccc(SCCOC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G18	compound treatment	0.82	0.0411	0.55	0.736	-0.00887	-0.12	0.3068	0.5402	1969227	Cerep_003976	COc1ccc2[nH]cc(CCNC(=O)OCCC3CCCCC3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G19	compound treatment	0.779	1.29E-4	0.0	0.744	-8.71E-4	-0.01	-0.0072	-0.5976	1969228	Cerep_003977	CC1(C)C2CC1C(COC(=O)NC(Cc3c[nH]c4ccccc34)C(=O)OCc5ccccc5)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G20	compound treatment	0.784	0.00513	0.07	0.742	-0.00287	-0.04	0.0212	0.2671	1969229	Cerep_003978	CCN(CC)Cc1cc(NC(=O)OCc2ccc(cc2)C(C)(C)C)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G21	compound treatment	0.792	0.0131	0.18	0.745	1.29E-4	0.0	0.1265	0.7141	1969230	Cerep_003979	OC1CCN(C1)C(=O)OCCc2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	G22	compound treatment	0.782	0.00313	0.04	0.73	-0.0149	-0.2	-0.1136	-0.5482	1969231	Cerep_003980	Cc1cccc(CCOC(=O)NCCc2cccc(F)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H03	compound treatment	0.784	0.00513	0.07	0.75	0.00513	0.07	0.0984	1.0	1969232	Cerep_003981	CC(C)(C)Sc1ccccc1CN2CCN(CC2)C(=O)OCc3c(F)cccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H04	compound treatment	0.746	-0.0329	-0.44	0.734	-0.0109	-0.15	-0.4184	-0.8948	1969233	Cerep_003982	Fc1ccc(cc1)C(CCCN2CCN(CC2)C(=O)c3ccsc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H05	compound treatment	0.775	-0.00387	-0.05	0.748	0.00313	0.04	-0.0068	-0.1003	1969234	Cerep_003983	CN(C)CCCCCCOC(=O)NCc1ccc(cc1)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H06	compound treatment	0.817	0.0381	0.51	0.721	-0.0239	-0.33	0.1335	0.2194	1969235	Cerep_003984	FC(F)(F)Oc1cccc(CNC(=O)CCc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H07	compound treatment	0.79	0.0111	0.15	0.765	0.0201	0.27	0.3002	0.9597	1969236	Cerep_003985	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(Cc5cc6ccccc6o5)CC4)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H08	compound treatment	0.77	-0.00887	-0.12	0.721	-0.0239	-0.33	-0.3148	-0.9077	1969237	Cerep_003986	Cc1sc(nc1CC(=O)N2CCC(CC2)(C#N)c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H09	compound treatment	0.789	0.0101	0.14	0.754	0.00913	0.12	0.1846	0.9989	1969238	Cerep_003987	[O-][N+](=O)c1ccc(CCCCOC(=O)NNC(=O)c2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H10	compound treatment	0.784	0.00513	0.07	0.754	0.00913	0.12	0.1369	0.9616	1969239	Cerep_003988	Cc1cc([nH]n1)C(=O)NNC(=O)CCc2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H11	compound treatment	0.761	-0.0179	-0.24	0.741	-0.00387	-0.05	-0.2078	-0.842	1969240	Cerep_003989	OC1(Cc2ccccc2)CCN(CC1)C(=O)OCCN3CCN(CC3)c4ccc(cn4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H12	compound treatment	0.755	-0.0239	-0.32	0.71	-0.0349	-0.48	-0.564	-0.982	1969241	Cerep_003990	COc1cccc(CN2CCC(C2)NC(=O)CC3Cc4ccccc4C3)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H13	compound treatment	0.763	-0.0159	-0.21	0.752	0.00713	0.1	-0.0827	-0.3516	1969242	Cerep_003991	CCOc1ccsc1C(=O)NNC(=O)OCCn2c(C)ncc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H14	compound treatment	0.763	-0.0159	-0.21	0.741	-0.00387	-0.05	-0.1887	-0.8558	1969243	Cerep_003992	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCCN(Cc4ccccc4F)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H15	compound treatment	0.762	-0.0169	-0.23	0.724	-0.0209	-0.28	-0.3622	-0.9939	1969244	Cerep_003993	Fc1ccc(cc1)C(=O)NNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H16	compound treatment	0.756	-0.0229	-0.31	0.735	-0.00987	-0.13	-0.3134	-0.9309	1969245	Cerep_003994	O=C(CC1Cc2ccccc2C1)N3CCN(C/C=C/c4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H17	compound treatment	0.771	-0.00787	-0.11	0.767	0.0221	0.3	0.1383	0.4323	1969246	Cerep_003995	FC(F)(F)c1cnc(N2CCCN(CC2)C(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H18	compound treatment	0.746	-0.0329	-0.44	0.744	-8.71E-4	-0.01	-0.322	-0.7258	1969247	Cerep_003996	COc1cccc(OC)c1CNC(=O)Cc2nc(sc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H19	compound treatment	0.797	0.0181	0.24	0.775	0.0301	0.41	0.4634	0.9693	1969248	Cerep_003997	O=C(NNC(=O)c1ccccc1n2cccc2)OCCN3CCNC3=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H20	compound treatment	0.77	-0.00887	-0.12	0.711	-0.0339	-0.46	-0.4112	-0.8619	1969249	Cerep_003998	COc1c(cnc2n(C)nc(C)c12)C(=O)NC(C(C)C)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H21	compound treatment	0.797	0.0181	0.24	0.742	-0.00287	-0.04	0.1452	0.5864	1969250	Cerep_003999	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccccc5[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	H22	compound treatment	0.775	-0.00387	-0.05	0.719	-0.0259	-0.35	-0.2864	-0.803	1969251	Cerep_004000	Cc1cc([nH]n1)C(=O)NNC(=O)CC2C(O)C3(C)CCC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I03	compound treatment	0.789	0.0101	0.14	0.765	0.0201	0.27	0.2907	0.9481	1969252	Cerep_004001	COc1ccc(cc1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I04	compound treatment	0.758	-0.0209	-0.28	0.754	0.00913	0.12	-0.1111	-0.3608	1969253	Cerep_004002	CCOc1ccc(CCOC(=O)NNC(=O)c2ccccc2n3cccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I05	compound treatment	0.766	-0.0129	-0.17	0.756	0.0111	0.15	-0.0155	-0.0671	1969254	Cerep_004003	COc1ccc(cc1)C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I06	compound treatment	0.762	-0.0169	-0.23	0.733	-0.0119	-0.16	-0.2754	-0.9861	1969255	Cerep_004004	COc1ccc(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I07	compound treatment	0.763	-0.0159	-0.21	0.765	0.0201	0.27	0.0427	0.1226	1969256	Cerep_004005	Fc1ccccc1CCOC(=O)NC(Cc2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I08	compound treatment	0.802	0.0231	0.31	0.743	-0.00187	-0.03	0.2026	0.6471	1969257	Cerep_004006	Fc1ccccc1CN2CCCC(COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I09	compound treatment	0.762	-0.0169	-0.23	0.728	-0.0169	-0.23	-0.3236	-1.0	1969258	Cerep_004007	COc1ccccc1CCOC(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I10	compound treatment	0.78	0.00113	0.02	0.722	-0.0229	-0.31	-0.2098	-0.6718	1969259	Cerep_004008	Clc1ccc(CNC(=O)OCCc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I11	compound treatment	0.771	-0.00787	-0.11	0.726	-0.0189	-0.26	-0.2571	-0.9234	1969260	Cerep_004009	CCOc1ccccc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5OCOc5c(OC)c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I12	compound treatment	0.764	-0.0149	-0.2	0.734	-0.0109	-0.15	-0.2467	-0.9889	1969261	Cerep_004010	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5cc(Br)ccc5OC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I13	compound treatment	0.758	-0.0209	-0.28	0.724	-0.0209	-0.28	-0.4004	-1.0	1969262	Cerep_004011	CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5OCOc5cc4Cl)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I14	compound treatment	0.804	0.0251	0.34	0.724	-0.0209	-0.28	0.0385	0.0869	1969263	Cerep_004012	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCC3CCN(Cc4cccc(OC)c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I15	compound treatment	0.797	0.0181	0.24	0.726	-0.0189	-0.26	-0.009	-0.0254	1969264	Cerep_004013	O=C(OCC1CCCCCC1)N2CCc3c(C2)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I16	compound treatment	0.781	0.00213	0.03	0.736	-0.00887	-0.12	-0.0652	-0.5247	1969265	Cerep_004014	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)OCCN(CCC#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I17	compound treatment	0.787	0.00813	0.11	0.756	0.0111	0.15	0.1848	0.9873	1969266	Cerep_004015	O=C(OCc1ccc(C#Cc2ccccc2)s1)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I18	compound treatment	0.777	-0.00187	-0.03	0.743	-0.00187	-0.03	-0.0359	-1.0	1969267	Cerep_004016	COc1ccc(CCNC(=O)OCCc2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I19	compound treatment	0.785	0.00613	0.08	0.749	0.00413	0.06	0.0983	0.9825	1969268	Cerep_004017	CCOC(=O)CCCCCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I20	compound treatment	0.769	-0.00987	-0.13	0.756	0.0111	0.15	0.0131	0.0651	1969269	Cerep_004018	[O-][N+](=O)c1ccc(CCCCOC(=O)NCCc2cccc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I21	compound treatment	0.803	0.0241	0.33	0.733	-0.0119	-0.16	0.1157	0.3183	1969270	Cerep_004019	Clc1ccccc1CCOC(=O)NCCNc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	I22	compound treatment	0.824	0.0451	0.61	0.748	0.00313	0.04	0.4607	0.7548	1969271	Cerep_004020	CCOC(=O)C(Cc1ccc(Cl)cc1)NC(=O)OCCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J03	compound treatment	0.793	0.0141	0.19	0.734	-0.0109	-0.15	0.0299	0.124	1969272	Cerep_004021	Cc1cc(C)c(CCOC(=O)NCc2ccc(Cl)cc2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J04	compound treatment	0.78	0.00113	0.02	0.749	0.00413	0.06	0.0506	0.8672	1969273	Cerep_004022	CC(C)C(NC(=O)c1ccc(cc1)n2nc(cc2c3ccccc3)c4ccccc4)C(=O)Nc5ccc6ccccc6c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J05	compound treatment	0.752	-0.0269	-0.36	0.763	0.0181	0.25	-0.0815	-0.1858	1969274	Cerep_004023	C=CCCCOC(=O)NNC(=O)CNS(=O)(=O)c1cccc2nsnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J06	compound treatment	0.758	-0.0209	-0.28	0.752	0.00713	0.1	-0.1304	-0.4376	1969275	Cerep_004024	CSc1sc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J07	compound treatment	0.77	-0.00887	-0.12	0.756	0.0111	0.15	0.0227	0.1173	1969276	Cerep_004025	CC(C)(C)OC(=O)N(CCOC(=O)NNC(=O)c1nccc2ccccc12)Cc3cc4ccccc4c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J08	compound treatment	0.769	-0.00987	-0.13	0.727	-0.0179	-0.24	-0.2665	-0.9596	1969277	Cerep_004026	FC(F)(F)c1c(cnn1c2ccc(Cl)cc2)C(=O)NNC(=O)c3csc(n3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J09	compound treatment	0.754	-0.0249	-0.34	0.751	0.00613	0.08	-0.1782	-0.5152	1969278	Cerep_004027	Cc1cc(C)c(CCOC(=O)NNC(=O)c2cncc(Br)c2)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J10	compound treatment	0.761	-0.0179	-0.24	0.727	-0.0179	-0.24	-0.3428	-1.0	1969279	Cerep_004028	Cn1cccc1C(=O)NNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J11	compound treatment	0.782	0.00313	0.04	0.744	-8.71E-4	-0.01	0.0214	0.489	1969280	Cerep_004029	FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)OCC3CCC=CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J12	compound treatment	0.758	-0.0209	-0.28	0.737	-0.00787	-0.11	-0.275	-0.9126	1969281	Cerep_004030	CSc1sc(C(=O)NNC(=O)CC2Cc3ccccc3C2)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J13	compound treatment	0.764	-0.0149	-0.2	0.732	-0.0129	-0.18	-0.266	-0.9978	1969282	Cerep_004031	COc1cc(Br)c(CN2CCCC(COC(=O)N3CCN(CC3)c4ccc(C)cc4C)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J14	compound treatment	0.779	1.29E-4	0.0	0.739	-0.00587	-0.08	-0.0554	-0.6916	1969283	Cerep_004032	COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCCSCCNC(=O)c3sc4ccccc4c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J15	compound treatment	0.773	-0.00587	-0.08	0.746	0.00113	0.02	-0.0451	-0.5593	1969284	Cerep_004033	COc1ccc(CCCOC(=O)N2CCC(O)C2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J16	compound treatment	0.755	-0.0239	-0.32	0.717	-0.0279	-0.38	-0.4965	-0.9966	1969285	Cerep_004034	CC(=O)Nc1ccc(cc1)C(=O)N2CCN(CCC3CCCCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J17	compound treatment	0.758	-0.0209	-0.28	0.729	-0.0159	-0.22	-0.3521	-0.9916	1969286	Cerep_004035	COc1ccc(CN2CCCC(COC(=O)N3CCN(Cc4ccco4)CC3)C2)cc1OCc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J18	compound treatment	0.751	-0.0279	-0.38	0.703	-0.0419	-0.57	-0.6696	-0.9795	1969287	Cerep_004036	OC(C1CCN(CC1)C(=O)c2ccsc2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J19	compound treatment	0.791	0.0121	0.16	0.762	0.0171	0.23	0.2809	0.9848	1969288	Cerep_004037	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCSCc4ccc5nonc5c4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J20	compound treatment	0.79	0.0111	0.15	0.703	-0.0419	-0.57	-0.2976	-0.504	1969289	Cerep_004038	COc1c(cnc2n(C)nc(C)c12)C(=O)NCC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J21	compound treatment	0.818	0.0391	0.53	0.767	0.0221	0.3	0.5866	0.9648	1969290	Cerep_004039	Fc1ccc(cc1COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	J22	compound treatment	0.768	-0.0109	-0.15	0.735	-0.00987	-0.13	-0.1989	-0.9991	1969291	Cerep_004040	CCCCCNC(=O)c1ccc(cc1)c2ccc(CC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K03	compound treatment	0.802	0.0231	0.31	0.759	0.0141	0.19	0.3569	0.9732	1969292	Cerep_004041	Fc1cccc(CCOC(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K04	compound treatment	0.791	0.0121	0.16	0.776	0.0311	0.42	0.4159	0.9141	1969293	Cerep_004042	Clc1ccc(cc1)C(N2CCN(CC2)C(=O)OCCN(CCC#N)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K05	compound treatment	0.769	-0.00987	-0.13	0.755	0.0101	0.14	0.0035	0.0182	1969294	Cerep_004043	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCCCc4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K06	compound treatment	0.769	-0.00987	-0.13	0.731	-0.0139	-0.19	-0.2279	-0.9852	1969295	Cerep_004044	[O-][N+](=O)c1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)CC2)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K07	compound treatment	0.767	-0.0119	-0.16	0.765	0.0201	0.27	0.0808	0.2544	1969296	Cerep_004045	O=C(OCc1ccccn1)N2CCN(Cc3ccccc3OCc4ccccc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K08	compound treatment	0.808	0.0291	0.39	0.768	0.0231	0.32	0.5009	0.9941	1969297	Cerep_004046	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4ccc([N+](=O)[O-])c(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K09	compound treatment	0.759	-0.0199	-0.27	0.757	0.0121	0.17	-0.0726	-0.2305	1969298	Cerep_004047	CN1CCN(C)C(C1)C(=O)NNC(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K10	compound treatment	0.813	0.0341	0.46	0.758	0.0131	0.18	0.4522	0.9153	1969299	Cerep_004048	COc1ccc(OCCNC(=O)OCCc2ccccc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K11	compound treatment	0.768	-0.0109	-0.15	0.741	-0.00387	-0.05	-0.141	-0.9048	1969300	Cerep_004049	C=CCOc1ccc(CN2CCCCC2COC(=O)NCc3ccc(cc3)c4csnn4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K12	compound treatment	0.797	0.0181	0.24	0.747	0.00213	0.03	0.1935	0.7855	1969301	Cerep_004050	Clc1ccc(COC(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K13	compound treatment	0.759	-0.0199	-0.27	0.735	-0.00987	-0.13	-0.2847	-0.9492	1969302	Cerep_004051	CC1(C)C2CC1C(CNC(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K14	compound treatment	0.784	0.00513	0.07	0.746	0.00113	0.02	0.0598	0.8438	1969303	Cerep_004052	Fc1ccc(CC(=O)N2CCN(CC2)C(=O)OCC3CCCN(Cc4ccc5ccccc5c4)C3)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K15	compound treatment	0.773	-0.00587	-0.08	0.768	0.0231	0.32	0.167	0.5136	1969304	Cerep_004053	O=C(NCCc1ccccn1)OCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K16	compound treatment	0.794	0.0151	0.2	0.764	0.0191	0.26	0.3288	0.9926	1969305	Cerep_004054	CN(C(=O)CN(CCOC(=O)N1CCC(=CC1)n2c(=O)[nH]c3ccccc23)CC(=O)N(C)C(C)(C)Cc4ccccc4)C(C)(C)Cc5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K17	compound treatment	0.772	-0.00687	-0.09	0.723	-0.0219	-0.3	-0.2764	-0.8851	1969306	Cerep_004055	CC(C)(O)C#Cc1ccc(COC(=O)NNC(=O)c2cccnc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K18	compound treatment	0.794	0.0151	0.2	0.738	-0.00687	-0.09	0.0781	0.3476	1969307	Cerep_004056	Fc1cccc(CCNC(=O)OCCc2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K19	compound treatment	0.765	-0.0139	-0.19	0.759	0.0141	0.19	0.0039	0.0146	1969308	Cerep_004057	Fc1cccc(Cl)c1CCOC(=O)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K20	compound treatment	0.796	0.0171	0.23	0.753	0.00813	0.11	0.2418	0.9434	1969309	Cerep_004058	Cc1cc(C)c(CCOC(=O)N2CCN(CC2)c3ccc(F)cc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K21	compound treatment	0.789	0.0101	0.14	0.737	-0.00787	-0.11	0.0207	0.1192	1969310	Cerep_004059	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)c3cccc(C)c3O)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	K22	compound treatment	0.79	0.0111	0.15	0.732	-0.0129	-0.18	-0.018	-0.0777	1969311	Cerep_004060	COc1ccc(cc1)C(=O)NNC(=O)OCCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L03	compound treatment	0.822	0.0431	0.58	0.753	0.00813	0.11	0.4898	0.8269	1969312	Cerep_004061	ClCCCCCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L04	compound treatment	0.765	-0.0139	-0.19	0.729	-0.0159	-0.22	-0.2854	-0.9974	1969313	Cerep_004062	FC(F)(F)Oc1ccccc1C(=O)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L05	compound treatment	0.777	-0.00187	-0.03	0.732	-0.0129	-0.18	-0.142	-0.8006	1969314	Cerep_004063	Cc1ccccc1COC(=O)NNC(=O)CNS(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L06	compound treatment	0.776	-0.00287	-0.04	0.736	-0.00887	-0.12	-0.1129	-0.8891	1969315	Cerep_004064	O=C(NNC(=O)c1cc(nc2ccccc12)c3ccccc3)c4ccc(s4)c5ccccn5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L07	compound treatment	0.76	-0.0189	-0.25	0.739	-0.00587	-0.08	-0.2366	-0.8867	1969316	Cerep_004065	Fc1ccc(/C=C/C(=O)NNC(=O)OCC2CCC=CC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L08	compound treatment	0.755	-0.0239	-0.32	0.713	-0.0319	-0.43	-0.535	-0.9891	1969317	Cerep_004066	O=C(N1CCN(C/C=C/c2ccccc2)CC1)c3csc(n3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L09	compound treatment	0.765	-0.0139	-0.19	0.74	-0.00487	-0.07	-0.1793	-0.9029	1969318	Cerep_004067	COCCCCOC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L10	compound treatment	0.755	-0.0239	-0.32	0.731	-0.0139	-0.19	-0.3615	-0.9678	1969319	Cerep_004068	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3cc(C)c([N+](=O)[O-])c(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L11	compound treatment	0.774	-0.00487	-0.07	0.743	-0.00187	-0.03	-0.0645	-0.9151	1969320	Cerep_004069	COc1ccccc1CCOC(=O)NCC2C(C=C(C)C)C2(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L12	compound treatment	0.759	-0.0199	-0.27	0.721	-0.0239	-0.33	-0.4197	-0.9954	1969321	Cerep_004070	Brc1ccc(NC(=O)CCC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L13	compound treatment	0.791	0.0121	0.16	0.746	0.00113	0.02	0.1266	0.7702	1969322	Cerep_004071	COc1ccc(cc1)N2CCN(CC2C)C(=O)OCc3ccccc3OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L14	compound treatment	0.782	0.00313	0.04	0.712	-0.0329	-0.45	-0.2871	-0.6377	1969323	Cerep_004072	COc1cccc(CN2CCCC(COC(=O)NCc3ccc(cc3)c4csnn4)C2)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L15	compound treatment	0.782	0.00313	0.04	0.756	0.0111	0.15	0.1371	0.8707	1969324	Cerep_004073	CN1CCN(CCCNC(=O)OCCCCc2ccccc2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L16	compound treatment	0.75	-0.0289	-0.39	0.721	-0.0239	-0.33	-0.5056	-0.996	1969325	Cerep_004074	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)C(C3CCCCC3)c4ccccc4)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L17	compound treatment	0.794	0.0151	0.2	0.75	0.00513	0.07	0.1938	0.8981	1969326	Cerep_004075	Oc1ccc2[nH]cc(CCNC(=O)OCc3ccccc3Cc4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L18	compound treatment	0.734	-0.0449	-0.61	0.722	-0.0229	-0.31	-0.6486	-0.9524	1969327	Cerep_004076	COc1ccc(OCCNC(=O)c2cc(C)n(c2C)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L19	compound treatment	0.786	0.00713	0.1	0.719	-0.0259	-0.35	-0.1815	-0.4962	1969328	Cerep_004077	FC(F)(F)Oc1ccccc1COC(=O)NNC(=O)c2ccccc2NC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L20	compound treatment	0.762	-0.0169	-0.23	0.749	0.00413	0.06	-0.1211	-0.5166	1969329	Cerep_004078	COc1c(cnc2n(C)nc(C)c12)C(=O)NC3CCN(Cc4cc(C)n(c4C)c5ccccc5)C3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L21	compound treatment	0.804	0.0251	0.34	0.751	0.00613	0.08	0.2988	0.8558	1969330	Cerep_004079	O=C(NCc1nc2ccccc2[nH]1)OCc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	L22	compound treatment	0.778	-8.71E-4	-0.01	0.733	-0.0119	-0.16	-0.1228	-0.7565	1969331	Cerep_004080	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)C3CC3)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M03	compound treatment	0.78	0.00113	0.02	0.76	0.0151	0.21	0.1566	0.7572	1969332	Cerep_004081	CCOC(=O)CCCCCOC(=O)N(C)CCCN1c2ccccc2CCc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M04	compound treatment	0.819	0.0401	0.54	0.754	0.00913	0.12	0.4708	0.8476	1969333	Cerep_004082	Clc1c(sc2ccccc12)C(=O)NCCSCCOC(=O)N3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M05	compound treatment	0.784	0.00513	0.07	0.754	0.00913	0.12	0.1369	0.9616	1969334	Cerep_004083	NS(=O)(=O)c1ccc(CNC(=O)OCCCCc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M06	compound treatment	0.777	-0.00187	-0.03	0.755	0.0101	0.14	0.0798	0.5684	1969335	Cerep_004084	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M07	compound treatment	0.792	0.0131	0.18	0.777	0.0321	0.44	0.435	0.9206	1969336	Cerep_004085	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(F)cc5F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M08	compound treatment	0.799	0.0201	0.27	0.806	0.0611	0.83	0.7814	0.8914	1969337	Cerep_004086	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5cc(OC)c(OC)cc5[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M09	compound treatment	0.785	0.00613	0.08	0.758	0.0131	0.18	0.1851	0.9384	1969338	Cerep_004087	CCOC(=O)C(Cc1ccccc1)NC(=O)OCCc2cccc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M10	compound treatment	0.803	0.0241	0.33	0.877	0.132	1.8	1.5042	0.8216	1969339	Cerep_004088	Cc1ccccc1N2CCN(CC2)C(=O)OCCc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M11	compound treatment	0.775	-0.00387	-0.05	0.748	0.00313	0.04	-0.0068	-0.1003	1969340	Cerep_004089	COc1ccc(OC)c(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(OC)cc(OC)c4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M12	compound treatment	0.794	0.0151	0.2	0.761	0.0161	0.22	0.2998	0.9993	1969341	Cerep_004090	Cc1cc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M13	compound treatment	0.804	0.0251	0.34	0.751	0.00613	0.08	0.2988	0.8558	1969342	Cerep_004091	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4ccc(Oc5ccccc5)cc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M14	compound treatment	0.835	0.0561	0.76	0.781	0.0361	0.49	0.8838	0.9783	1969343	Cerep_004092	COc1cc(Br)c(CN2CCCC(COC(=O)N3CCN(CC3)C(=O)OCc4ccccc4)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M15	compound treatment	0.742	-0.0369	-0.5	0.752	0.00713	0.1	-0.283	-0.5584	1969344	Cerep_004093	O=C(NNC(=O)c1ccccc1n2cccc2)OCC3CCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M16	compound treatment	0.791	0.0121	0.16	0.738	-0.00687	-0.09	0.0494	0.2622	1969345	Cerep_004094	NS(=O)(=O)c1cc([N+](=O)[O-])c(s1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M17	compound treatment	0.788	0.00913	0.12	0.774	0.0291	0.4	0.3679	0.8848	1969346	Cerep_004095	CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)OCc2nc(cs2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M18	compound treatment	0.789	0.0101	0.14	0.753	0.00813	0.11	0.175	0.9946	1969347	Cerep_004096	COc1ccccc1CCOC(=O)NCCOc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M19	compound treatment	0.773	-0.00587	-0.08	0.747	0.00213	0.03	-0.0355	-0.4206	1969348	Cerep_004097	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccc(F)cc5F)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M20	compound treatment	0.785	0.00613	0.08	0.745	1.29E-4	0.0	0.0597	0.7219	1969349	Cerep_004098	CCCCC#CCCOC(=O)NC(c1ccccc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M21	compound treatment	0.794	0.0151	0.2	0.767	0.0221	0.3	0.3577	0.9819	1969350	Cerep_004099	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCCCNC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	M22	compound treatment	0.816	0.0371	0.5	0.772	0.0271	0.37	0.6158	0.9889	1969351	Cerep_004100	COc1ccc2[nH]cc(CCNC(=O)OCCc3ccc(C)cc3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N03	compound treatment	0.809	0.0301	0.41	0.749	0.00413	0.06	0.3272	0.7974	1969352	Cerep_004101	CC(C)(C)c1cc([nH]n1)C(=O)NNC(=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N04	compound treatment	0.788	0.00913	0.12	0.744	-8.71E-4	-0.01	0.0787	0.6359	1969353	Cerep_004102	COc1cc(OC)cc(c1)C(=O)NC(C)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N05	compound treatment	0.793	0.0141	0.19	0.763	0.0181	0.25	0.3096	0.9917	1969354	Cerep_004103	[O-][N+](=O)c1cc2OCOc2cc1COC(=O)NNC(=O)Cc3ccsc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N06	compound treatment	0.785	0.00613	0.08	0.745	1.29E-4	0.0	0.0597	0.7219	1969355	Cerep_004104	O=C(NNC(=O)c1ccc2nsnc2c1)c3cc(=O)n([nH]3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N07	compound treatment	0.759	-0.0199	-0.27	0.809	0.0641	0.87	0.4288	0.4688	1969356	Cerep_004105	NS(=O)(=O)c1ccc(CNC(=O)OCCc2ccccc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N08	compound treatment	0.747	-0.0319	-0.43	0.748	0.00313	0.04	-0.2739	-0.6338	1879090	Cerep_004106	COc1ccc(cc1)C(=O)NCCc2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N09	compound treatment	0.779	1.29E-4	0.0	0.771	0.0261	0.36	0.2532	0.7105	1969357	Cerep_004107	[O-][N+](=O)c1ccc(NCCNC(=O)OCc2ccc(/C=C/c3ccccc3)cc2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N10	compound treatment	0.77	-0.00887	-0.12	0.717	-0.0279	-0.38	-0.3534	-0.8868	1969358	Cerep_004108	CCCCCC#CCCOC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N11	compound treatment	0.794	0.0151	0.2	0.775	0.0301	0.41	0.4348	0.9479	1969359	Cerep_004109	COc1ccccc1CCOC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N12	compound treatment	0.763	-0.0159	-0.21	0.738	-0.00687	-0.09	-0.2177	-0.9313	1969360	Cerep_004110	OC(C1CCN(CC1)C(=O)CCC(=O)Nc2ccc(Br)cn2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N13	compound treatment	0.809	0.0301	0.41	0.726	-0.0189	-0.26	0.1054	0.2192	1969361	Cerep_004111	[O-][N+](=O)c1cc2OCOc2cc1CN3CCCCC3COC(=O)N4CCN(CC4)c5cccc6[nH]ccc56
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N14	compound treatment	0.815	0.0361	0.49	0.749	0.00413	0.06	0.3845	0.7836	1969362	Cerep_004112	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)C(=O)OCCc4ccc5ccccc5c4)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N15	compound treatment	0.745	-0.0339	-0.46	0.753	0.00813	0.11	-0.2447	-0.5205	1969363	Cerep_004113	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)OCCCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N16	compound treatment	0.778	-8.71E-4	-0.01	0.723	-0.0219	-0.3	-0.2192	-0.7344	1969364	Cerep_004114	COc1cc(CCNC(=O)CCC(=O)Nc2ccc(Br)cn2)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N17	compound treatment	0.804	0.0251	0.34	0.723	-0.0219	-0.3	0.0288	0.0638	1969365	Cerep_004115	O=C(CSCc1nc(cs1)c2ccccc2)NNC(=O)OCc3cccc(OCc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N18	compound treatment	0.767	-0.0119	-0.16	0.73	-0.0149	-0.2	-0.2566	-0.9932	1969366	Cerep_004116	COc1ccc(cc1)C(=O)NNS(=O)(=O)c2cccc3c(cccc23)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N19	compound treatment	0.767	-0.0119	-0.16	0.721	-0.0239	-0.33	-0.3434	-0.9466	1969367	Cerep_004117	FC(F)(F)c1ccc(nc1)N2CCN(CCOC(=O)NNC(=O)/C=C/c3ccco3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N20	compound treatment	0.753	-0.0259	-0.35	0.738	-0.00687	-0.09	-0.3131	-0.8663	1969368	Cerep_004118	CCCCC(C)C(=O)NNC(=O)c1cnn(c1C(F)(F)F)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N21	compound treatment	0.78	0.00113	0.02	0.758	0.0131	0.18	0.1374	0.7645	1969369	Cerep_004119	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5cc(ccc5OC)C(=O)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	N22	compound treatment	0.751	-0.0279	-0.38	0.708	-0.0369	-0.5	-0.6214	-0.9898	1969370	Cerep_004120	CC(N1CCN(CC1)C(=O)c2csc(n2)c3cnccn3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O03	compound treatment	0.778	-8.71E-4	-0.01	0.753	0.00813	0.11	0.0701	0.6286	1969371	Cerep_004121	COc1cc(OC)c(CNC(=O)OCC(C)c2ccccc2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O04	compound treatment	0.787	0.00813	0.11	0.77	0.0251	0.34	0.3198	0.889	1969372	Cerep_004122	COc1cc(Br)c(CN2CCCC(COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O05	compound treatment	0.797	0.0181	0.24	0.763	0.0181	0.25	0.3477	1.0	1969373	Cerep_004123	CCCCCC#CCOC(=O)N1CCN(CC1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O06	compound treatment	0.802	0.0231	0.31	0.754	0.00913	0.12	0.3087	0.9188	1969374	Cerep_004124	CCOc1ccc(Br)cc1NC2CCCCC2COC(=O)N3CCN(CC3)c4cccc5[nH]ccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O07	compound treatment	0.795	0.0161	0.22	0.765	0.0201	0.27	0.3479	0.9934	1969375	Cerep_004125	FC(F)(F)Oc1cccc(COC(=O)N2CCN(Cc3ccccc3Sc4ccc(Cl)cc4)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O08	compound treatment	0.812	0.0331	0.45	0.755	0.0101	0.14	0.4137	0.8844	1969376	Cerep_004126	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O09	compound treatment	0.852	0.0731	0.99	0.807	0.0621	0.85	1.2967	0.9971	1969377	Cerep_004127	Cc1cccc(CCOC(=O)NCCNc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O10	compound treatment	0.766	-0.0129	-0.17	0.74	-0.00487	-0.07	-0.1698	-0.9131	1969378	Cerep_004128	COc1cccc(CCOC(=O)N2CCN(CC2)c3ccccc3C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O11	compound treatment	0.786	0.00713	0.1	0.751	0.00613	0.08	0.1271	0.9976	1969379	Cerep_004129	COc1cc(OC)cc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4c(OC)ccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O12	compound treatment	0.818	0.0391	0.53	0.777	0.0321	0.44	0.6831	0.9957	1969380	Cerep_004130	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5cc(OC)c(OC)cc5[N+](=O)[O-])ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O13	compound treatment	0.762	-0.0169	-0.23	0.741	-0.00387	-0.05	-0.1983	-0.8486	1969381	Cerep_004131	Cc1ncc([N+](=O)[O-])n1CCNC(=O)OCC2CCCN(Cc3ccc4ccccc4c3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O14	compound treatment	0.794	0.0151	0.2	0.765	0.0201	0.27	0.3384	0.9894	1969382	Cerep_004132	CCOc1ccc(cc1)N2CCN(CC2)C(=O)OCCc3cccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O15	compound treatment	0.788	0.00913	0.12	0.747	0.00213	0.03	0.1076	0.8505	1969383	Cerep_004133	COC(=O)c1ccc(COC(=O)NNC(=O)c2ccc(cc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O16	compound treatment	0.797	0.0181	0.24	0.763	0.0181	0.25	0.3477	1.0	1969384	Cerep_004134	Clc1cccc(Cl)c1CN2CCCCC2COC(=O)NCc3csc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O17	compound treatment	0.77	-0.00887	-0.12	0.757	0.0121	0.17	0.0323	0.1583	1969385	Cerep_004135	CN(CCOC(=O)N1CCC2(CC1)N(CNC2=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O18	compound treatment	0.778	-8.71E-4	-0.01	0.747	0.00213	0.03	0.0122	0.3899	1969386	Cerep_004136	Cc1nn(c(C)c1CN2CCC(C2)NC(=O)OCCc3cccc(Cl)c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O19	compound treatment	0.781	0.00213	0.03	0.75	0.00513	0.07	0.0698	0.9227	1969387	Cerep_004137	OC1(CCN(CC1)C(=O)OCc2ccc(cc2F)C(F)(F)F)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O20	compound treatment	0.768	-0.0109	-0.15	0.757	0.0121	0.17	0.0132	0.0599	1969388	Cerep_004138	O=C(OCC#Cc1ccccc1)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O21	compound treatment	0.799	0.0201	0.27	0.782	0.0371	0.51	0.55	0.9574	1969389	Cerep_004139	CC(CNC(=O)OCc1cccc(OCc2ccccc2)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	O22	compound treatment	0.809	0.0301	0.41	0.744	-8.71E-4	-0.01	0.279	0.6861	1969390	Cerep_004140	ClCCCOC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P03	compound treatment	0.809	0.0301	0.41	0.776	0.0311	0.42	0.5876	0.9998	1969391	Cerep_004141	Oc1cccc(c1)C(=O)NNC(=O)OC/C=C/COCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P04	compound treatment	0.764	-0.0149	-0.2	0.738	-0.00687	-0.09	-0.2081	-0.9399	1969392	Cerep_004142	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NCCOc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P05	compound treatment	0.78	0.00113	0.02	0.731	-0.0139	-0.19	-0.123	-0.6481	1969393	Cerep_004143	CCN(CCOC(=O)NNC(=O)c1ccccc1n2cccc2)c3ccc(N=Nc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P06	compound treatment	0.739	-0.0399	-0.54	0.723	-0.0219	-0.3	-0.5912	-0.9613	1969394	Cerep_004144	CC(CNC(=O)CCC(=O)Nc1ccc(Br)cn1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P07	compound treatment	0.772	-0.00687	-0.09	0.757	0.0121	0.17	0.0514	0.2711	1969395	Cerep_004145	COc1ccccc1CNC(=O)OCCCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P08	compound treatment	0.746	-0.0329	-0.44	0.73	-0.0149	-0.2	-0.457	-0.9371	1969396	Cerep_004146	COc1ccc(cc1)C(=O)NC2CCc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P09	compound treatment	0.678	-0.101	-1.36	0.679	-0.0659	-0.9	-1.5974	-0.9797	1969397	Cerep_004147	CCOc1ccsc1C(=O)NNC(=O)OCC2CCC3CC2C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P10	compound treatment	0.071	-0.708	-9.55	0.072	-0.673	-9.18	-13.2407	-0.9998	1969398	Cerep_004148	Clc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P11	compound treatment	0.754	-0.0249	-0.34	0.744	-8.71E-4	-0.01	-0.2457	-0.7317	1969399	Cerep_004149	CCN(CC)Cc1cc(NC(=O)OCCc2cccc(C)c2)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P12	compound treatment	0.737	-0.0419	-0.56	0.741	-0.00387	-0.05	-0.4368	-0.7698	1969400	Cerep_004150	COc1c(cnc2n(C)nc(C)c12)C(=O)NC(C)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P13	compound treatment	0.764	-0.0149	-0.2	0.763	0.0181	0.25	0.0329	0.1035	1969401	Cerep_004151	COc1cc(OC)c(CN2CCCCC2COC(=O)N3CCN(CC3)c4cc(ccn4)C(F)(F)F)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P14	compound treatment	0.757	-0.0219	-0.3	0.732	-0.0129	-0.18	-0.3328	-0.9692	1969402	Cerep_004152	CCOc1cccc(c1)C(=O)NNC(=O)OCc2cccc(OCc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P15	compound treatment	0.79	0.0111	0.15	0.734	-0.0109	-0.15	0.0013	0.0063	1969403	Cerep_004153	Cc1cc([nH]n1)C(=O)NNC(=O)OCc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P16	compound treatment	0.755	-0.0239	-0.32	0.727	-0.0179	-0.24	-0.4	-0.9905	1969404	Cerep_004154	COc1ccc(cc1)C(=O)NCc2cc(OC)cc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P17	compound treatment	0.761	-0.0179	-0.24	0.747	0.00213	0.03	-0.15	-0.6175	1969405	Cerep_004155	Fc1ccccc1COC(=O)NCc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P18	compound treatment	0.755	-0.0239	-0.32	0.716	-0.0289	-0.39	-0.5061	-0.995	1969406	Cerep_004156	COc1ccc(cc1)C(=O)NNC(=O)c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P19	compound treatment	0.792	0.0131	0.18	0.747	0.00213	0.03	0.1458	0.8122	1969407	Cerep_004157	Clc1ncn(Cc2ccc(o2)C(=O)NNC(=O)OCCOc3ccc4ccccc4c3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P20	compound treatment	0.758	-0.0209	-0.28	0.731	-0.0139	-0.19	-0.3329	-0.9813	1969408	Cerep_004158	CCOc1ccc(CCNC(=O)c2ccccc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P21	compound treatment	0.763	-0.0159	-0.21	0.745	1.29E-4	0.0	-0.1502	-0.7013	1969409	Cerep_004159	CCn1c2ccccc2c3cc(CN(CCOC(=O)N4CCN(Cc5ccc6n(CC)c7ccccc7c6c5)CC4)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.538	P22	compound treatment	0.738	-0.0409	-0.55	0.739	-0.00587	-0.08	-0.4465	-0.8014	1969410	Cerep_004160	CCCCCCc1ccc(cc1)C(=O)NNC(=O)Cc2ccsc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A03	compound treatment	0.808	0.0264	0.36	0.748	0.00472	0.06	0.2973	0.8217	1969411	Cerep_004161	COc1ccc(Cl)cc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A04	compound treatment	0.821	0.0394	0.53	0.757	0.0137	0.19	0.508	0.9018	1969412	Cerep_004162	O=C(N/N=C/c1cn(Cc2ccccc2)c3ccccc13)c4cc(nc5ccccc45)C6CC6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A05	compound treatment	0.795	0.0134	0.18	0.725	-0.0183	-0.25	-0.0485	-0.1577	1969413	Cerep_004163	Oc1cc2ccccc2cc1C(=O)N/N=C/c3c[nH]c4cc(OCc5ccccc5)ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A06	compound treatment	0.809	0.0274	0.37	0.722	-0.0213	-0.29	0.0561	0.1194	1969414	Cerep_004164	Clc1cc2OCOc2cc1/C=N/NC(=O)Cc3csc(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A07	compound treatment	0.816	0.0344	0.46	0.764	0.0207	0.28	0.5278	0.9717	1969415	Cerep_004165	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c3csc(CS(=O)(=O)Cc4ccco4)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A08	compound treatment	0.795	0.0134	0.18	0.751	0.00772	0.11	0.2022	0.967	1969416	Cerep_004166	COc1ccc(/C=N/NC(=O)c2cc3ccccc3s2)c(C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A09	compound treatment	0.768	-0.0136	-0.18	0.71	-0.0333	-0.45	-0.4507	-0.9207	1969417	Cerep_004167	[O-][N+](=O)c1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A10	compound treatment	0.781	-6.11E-4	-0.01	0.739	-0.00428	-0.06	-0.0471	-0.7991	1969418	Cerep_004168	O=C(Cc1csc(n1)c2ccccc2)N/N=C/c3cn(Cc4ccccc4)c5ccccc35
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A11	compound treatment	0.769	-0.0126	-0.17	0.719	-0.0243	-0.33	-0.3544	-0.9521	1969419	Cerep_004169	CCCc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A12	compound treatment	0.8	0.0184	0.25	0.762	0.0187	0.26	0.3559	0.9999	1969420	Cerep_004170	Oc1ccc(/C=N/NC(=O)c2cc3ccccc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A13	compound treatment	0.757	-0.0246	-0.33	0.744	7.21E-4	0.01	-0.2278	-0.6859	1969421	Cerep_004171	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A14	compound treatment	0.76	-0.0216	-0.29	0.718	-0.0253	-0.34	-0.4499	-0.9965	1969422	Cerep_004172	Oc1ccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A15	compound treatment	0.769	-0.0126	-0.17	0.728	-0.0153	-0.21	-0.2676	-0.9949	1969423	Cerep_004173	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cccc(F)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A16	compound treatment	0.801	0.0194	0.26	0.748	0.00472	0.06	0.2305	0.8556	1969424	Cerep_004174	O=C(OCc1ccccc1)N2CCN(CC2)S(=O)(=O)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A17	compound treatment	0.792	0.0104	0.14	0.742	-0.00128	-0.02	0.0868	0.6144	1969425	Cerep_004175	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(s2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A18	compound treatment	0.801	0.0194	0.26	0.741	-0.00228	-0.03	0.163	0.6187	1538571	Cerep_004176	Clc1ccc(s1)S(=O)(=O)NCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A19	compound treatment	0.815	0.0334	0.45	0.738	-0.00528	-0.07	0.2676	0.5867	1969426	Cerep_004177	CCCc1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A20	compound treatment	0.812	0.0304	0.41	0.745	0.00172	0.02	0.3065	0.7464	1969427	Cerep_004178	COc1cc(OC)c(CN2CCN(CC2)S(=O)(=O)c3c(C)cccc3Cl)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A21	compound treatment	0.812	0.0304	0.41	0.758	0.0147	0.2	0.4318	0.946	1969428	Cerep_004179	O=C(N/N=C/c1cccc(C#N)c1)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	A22	compound treatment	0.809	0.0274	0.37	0.733	-0.0103	-0.14	0.1622	0.4103	1969429	Cerep_004180	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccc(N(C)C)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B03	compound treatment	0.804	0.0224	0.3	0.753	0.00972	0.13	0.3073	0.9317	1969430	Cerep_004181	COc1ccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B04	compound treatment	0.776	-0.00561	-0.08	0.741	-0.00228	-0.03	-0.0755	-0.9227	1558046	Cerep_004182	Fc1ccc(c(F)c1)S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B05	compound treatment	0.787	0.00539	0.07	0.763	0.0197	0.27	0.2416	0.8671	1969431	Cerep_004183	COc1ccc(/C=N/NC(=O)c2ccc3nonc3c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B06	compound treatment	0.779	-0.00261	-0.04	0.725	-0.0183	-0.25	-0.2012	-0.7991	1969432	Cerep_004184	Fc1ccccc1S(=O)(=O)Nc2ccc3[nH]ncc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B07	compound treatment	0.8	0.0184	0.25	0.729	-0.0143	-0.19	0.0377	0.1196	1969433	Cerep_004185	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccc(O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B08	compound treatment	0.744	-0.0376	-0.51	0.728	-0.0153	-0.21	-0.5061	-0.9227	1969434	Cerep_004186	CCN(CCc1ccccn1)S(=O)(=O)c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B09	compound treatment	0.79	0.00839	0.11	0.733	-0.0103	-0.14	-0.0191	-0.106	1969435	Cerep_004187	CN(C)c1ccc(/C=N/NC(=O)c2cc3ccccc3s2)c4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B10	compound treatment	0.804	0.0224	0.3	0.74	-0.00328	-0.04	0.182	0.5959	1231695	Cerep_004188	Clc1ccccc1S(=O)(=O)N2CCC(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B11	compound treatment	0.768	-0.0136	-0.18	0.753	0.00972	0.13	-0.0361	-0.1594	1969436	Cerep_004189	OC1(CCN(CC1)S(=O)(=O)c2cc(Cl)c(Cl)s2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B12	compound treatment	0.746	-0.0356	-0.48	0.724	-0.0193	-0.26	-0.5256	-0.9597	1155771	Cerep_004190	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B13	compound treatment	0.751	-0.0306	-0.41	0.732	-0.0113	-0.15	-0.4008	-0.9094	1969437	Cerep_004191	Fc1ccc(cc1)C(=O)C2CCN(CC2)S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B14	compound treatment	0.754	-0.0276	-0.37	0.714	-0.0293	-0.4	-0.5457	-0.9994	1969438	Cerep_004192	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCCC2COC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B15	compound treatment	0.763	-0.0186	-0.25	0.751	0.00772	0.11	-0.1031	-0.3786	1427009	Cerep_004193	Clc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc4OCOc4c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B16	compound treatment	0.775	-0.00661	-0.09	0.728	-0.0153	-0.21	-0.2104	-0.9283	1231558	Cerep_004194	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B17	compound treatment	0.79	0.00839	0.11	0.754	0.0107	0.15	0.1834	0.992	1969439	Cerep_004195	OCCOCCNS(=O)(=O)c1ccc(Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B18	compound treatment	0.744	-0.0376	-0.51	0.7	-0.0433	-0.59	-0.7761	-0.9972	1969440	Cerep_004196	COc1ccc(OC)c(CN2CCC(C2)NS(=O)(=O)c3cccc(C)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B19	compound treatment	0.794	0.0124	0.17	0.747	0.00372	0.05	0.1541	0.882	1430748	Cerep_004197	Cc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B20	compound treatment	0.763	-0.0186	-0.25	0.72	-0.0233	-0.32	-0.402	-0.9933	1969441	Cerep_004198	COc1ccc(cc1OC)S(=O)(=O)NC2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B21	compound treatment	0.778	-0.00361	-0.05	0.735	-0.00828	-0.11	-0.1143	-0.9294	1969442	Cerep_004199	CCOc1cccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	B22	compound treatment	0.751	-0.0306	-0.41	0.703	-0.0403	-0.55	-0.6804	-0.9901	1969443	Cerep_004200	CC1(C)CCCN(C1)S(=O)(=O)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C03	compound treatment	0.771	-0.0106	-0.14	0.726	-0.0173	-0.24	-0.2678	-0.9715	1969444	Cerep_004201	Brc1ccccc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C04	compound treatment	0.809	0.0274	0.37	0.754	0.0107	0.15	0.3646	0.9177	1969445	Cerep_004202	CCCOc1ccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C05	compound treatment	0.794	0.0124	0.17	0.741	-0.00228	-0.03	0.0962	0.5659	1969446	Cerep_004203	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C06	compound treatment	0.796	0.0144	0.19	0.776	0.0327	0.45	0.4528	0.9305	1969447	Cerep_004204	COc1cc(/C=N/NC(=O)c2cc3ccccc3s2)cc([N+](=O)[O-])c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C07	compound treatment	0.754	-0.0276	-0.37	0.733	-0.0103	-0.14	-0.3625	-0.9108	1969448	Cerep_004205	CSc1ncc(C(=O)N/N=C/c2csc(c2)[N+](=O)[O-])n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C08	compound treatment	0.789	0.00739	0.1	0.768	0.0247	0.34	0.3089	0.8786	1969449	Cerep_004206	COc1ccc2ccccc2c1/C=N/NC(=O)c3ccccc3NC(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C09	compound treatment	0.768	-0.0136	-0.18	0.745	0.00172	0.02	-0.1132	-0.6118	1969450	Cerep_004207	COc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C10	compound treatment	0.781	-6.11E-4	-0.01	0.756	0.0127	0.17	0.1168	0.6727	1969451	Cerep_004208	CCCOc1ccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C11	compound treatment	0.757	-0.0246	-0.33	0.761	0.0177	0.24	-0.0639	-0.1556	1969452	Cerep_004209	CC(C)c1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C12	compound treatment	0.79	0.00839	0.11	0.771	0.0277	0.38	0.3473	0.8802	1969453	Cerep_004210	COc1ccc(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C13	compound treatment	0.749	-0.0326	-0.44	0.737	-0.00628	-0.09	-0.3716	-0.8292	1922681	Cerep_004211	COc1ccc(cc1)C(=O)N/N=C/c2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C14	compound treatment	0.784	0.00239	0.03	0.748	0.00472	0.06	0.0683	0.9488	1969454	Cerep_004212	COc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C15	compound treatment	0.76	-0.0216	-0.29	0.723	-0.0203	-0.28	-0.4017	-0.9997	1969455	Cerep_004213	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(F)cccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C16	compound treatment	0.781	-6.11E-4	-0.01	0.766	0.0227	0.31	0.2133	0.688	1969456	Cerep_004214	COCCCNS(=O)(=O)c1ccc(C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C17	compound treatment	0.798	0.0164	0.22	0.777	0.0337	0.46	0.4815	0.9437	1969457	Cerep_004215	OC(=O)c1ccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C18	compound treatment	0.768	-0.0136	-0.18	0.761	0.0177	0.24	0.041	0.1352	1969458	Cerep_004216	Clc1ccc(s1)S(=O)(=O)NC2CCN(Cc3ccccc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C19	compound treatment	0.814	0.0324	0.44	0.731	-0.0123	-0.17	0.1906	0.4073	1969459	Cerep_004217	CC(C)c1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C20	compound treatment	0.803	0.0214	0.29	0.748	0.00472	0.06	0.2496	0.8441	1969460	Cerep_004218	Cc1cccc(Cl)c1S(=O)(=O)N2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C21	compound treatment	0.798	0.0164	0.22	0.746	0.00272	0.04	0.1826	0.8144	1969461	Cerep_004219	O=C(N/N=C/c1cccnc1)c2ccccc2CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	C22	compound treatment	0.801	0.0194	0.26	0.742	-0.00128	-0.02	0.1726	0.6585	1969462	Cerep_004220	COc1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)ccc1OCc5ccc(cc5)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D03	compound treatment	0.797	0.0154	0.21	0.761	0.0177	0.24	0.3177	0.9971	1969463	Cerep_004221	O=C(Cc1c[nH]c2ccccc12)N/N=C/c3ccc(OCc4ccccc4)c(OCc5ccccc5)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D04	compound treatment	0.793	0.0114	0.15	0.754	0.0107	0.15	0.212	0.9997	1409873	Cerep_004222	Fc1ccc(c(F)c1)S(=O)(=O)N2CCN(CC2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D05	compound treatment	0.781	-6.11E-4	-0.01	0.741	-0.00228	-0.03	-0.0278	-0.8648	1969464	Cerep_004223	COc1ccc(Cl)cc1C(=O)N/N=C/c2ccc(OCc3ccccc3)c(OCc4ccccc4)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D06	compound treatment	0.776	-0.00561	-0.08	0.749	0.00572	0.08	0.0016	0.0151	1969465	Cerep_004224	OC(C1CCN(CC1)S(=O)(=O)c2ccccc2F)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D07	compound treatment	0.787	0.00539	0.07	0.756	0.0127	0.17	0.1741	0.9255	1969466	Cerep_004225	COc1ccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D08	compound treatment	0.768	-0.0136	-0.18	0.717	-0.0263	-0.36	-0.3832	-0.9518	1969467	Cerep_004226	Cc1nn(c(C)c1CN2CCC(C2)NS(=O)(=O)c3ccc(Br)s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D09	compound treatment	0.761	-0.0206	-0.28	0.725	-0.0183	-0.25	-0.3729	-0.9985	1969468	Cerep_004227	COc1cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)ccc1OCc4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D10	compound treatment	0.771	-0.0106	-0.14	0.735	-0.00828	-0.11	-0.1811	-0.9931	1572476	Cerep_004228	Clc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D11	compound treatment	0.772	-0.00961	-0.13	0.734	-0.00928	-0.13	-0.1812	-0.9999	1969469	Cerep_004229	Clc1cc(sc1Cl)S(=O)(=O)N2CCN(CC2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D12	compound treatment	0.771	-0.0106	-0.14	0.708	-0.0353	-0.48	-0.4414	-0.8794	1969470	Cerep_004230	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC2CCCC2OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D13	compound treatment	0.778	-0.00361	-0.05	0.742	-0.00128	-0.02	-0.0468	-0.9041	1969471	Cerep_004231	FC(F)(F)c1cc(cc(c1)S(=O)(=O)NC2CCN(Cc3ccc4ccccc4c3)C2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D14	compound treatment	0.75	-0.0316	-0.43	0.7	-0.0433	-0.59	-0.7189	-0.9873	1969472	Cerep_004232	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D15	compound treatment	0.774	-0.00761	-0.1	0.736	-0.00728	-0.1	-0.1428	-0.9999	1969473	Cerep_004233	Clc1ccc(cc1)S(=O)(=O)NCCN2CCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D16	compound treatment	0.795	0.0134	0.18	0.733	-0.0103	-0.14	0.0286	0.1251	1628729	Cerep_004234	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCc2cc(OC)ccc2OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D17	compound treatment	0.795	0.0134	0.18	0.737	-0.00628	-0.09	0.0672	0.3361	1142863	Cerep_004235	OCC1CCCN(C1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D18	compound treatment	0.779	-0.00261	-0.04	0.736	-0.00728	-0.1	-0.0951	-0.9029	1969474	Cerep_004236	Cc1cccc(c1)S(=O)(=O)NCCc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D19	compound treatment	0.775	-0.00661	-0.09	0.729	-0.0143	-0.19	-0.2008	-0.9373	1969475	Cerep_004237	OC(C(NS(=O)(=O)c1cc(Cl)cc(Cl)c1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D20	compound treatment	0.759	-0.0226	-0.31	0.741	-0.00228	-0.03	-0.2377	-0.7751	1969476	Cerep_004238	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(Cc3cc4ccccc4o3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D21	compound treatment	0.787	0.00539	0.07	0.743	-2.79E-4	0.0	0.0487	0.6692	1969477	Cerep_004239	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(C)c(OC)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	D22	compound treatment	0.773	-0.00861	-0.12	0.723	-0.0203	-0.28	-0.2777	-0.9258	1969478	Cerep_004240	Cc1cccc(C)c1N2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E03	compound treatment	0.793	0.0114	0.15	0.747	0.00372	0.05	0.1445	0.8932	1933271	Cerep_004241	[O-][N+](=O)c1ccccc1C(=O)N/N=C/c2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E04	compound treatment	0.786	0.00439	0.06	0.755	0.0117	0.16	0.1549	0.9087	1969479	Cerep_004242	COc1cc(OC)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E05	compound treatment	0.788	0.00639	0.09	0.762	0.0187	0.26	0.2415	0.8961	1969480	Cerep_004243	O=C(N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12)/C=C/c4ccc5OCOc5c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E06	compound treatment	0.789	0.00739	0.1	0.742	-0.00128	-0.02	0.0582	0.5747	1969481	Cerep_004244	COc1ccc(Br)cc1/C=N\NC(=O)c2ccccc2NC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E07	compound treatment	0.765	-0.0166	-0.22	0.733	-0.0103	-0.14	-0.2576	-0.9745	1969482	Cerep_004245	[O-][N+](=O)c1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E08	compound treatment	0.826	0.0444	0.6	0.778	0.0347	0.47	0.7582	0.9932	1969483	Cerep_004246	Oc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E09	compound treatment	0.75	-0.0316	-0.43	0.756	0.0127	0.17	-0.1789	-0.3886	1969484	Cerep_004247	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E10	compound treatment	0.756	-0.0256	-0.35	0.772	0.0287	0.39	0.0326	0.0625	1969485	Cerep_004248	COc1cc(OC)c(/C=N/NC(=O)C2CC2c3ccccc3)cc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E11	compound treatment	0.75	-0.0316	-0.43	0.723	-0.0203	-0.28	-0.4971	-0.978	1969486	Cerep_004249	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E12	compound treatment	0.78	-0.00161	-0.02	0.763	0.0197	0.27	0.1748	0.6478	1969487	Cerep_004250	COc1cccc(/C=N/NC(=O)c2ccc3nonc3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E13	compound treatment	0.779	-0.00261	-0.04	0.774	0.0307	0.42	0.2713	0.6454	1969488	Cerep_004251	Cc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E14	compound treatment	0.765	-0.0166	-0.22	0.726	-0.0173	-0.24	-0.3251	-0.9997	1969489	Cerep_004252	COc1cccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E15	compound treatment	0.771	-0.0106	-0.14	0.754	0.0107	0.15	0.0022	0.0105	1969490	Cerep_004253	COc1ccc(cc1)C(=O)N/N=C/c2ccsc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E16	compound treatment	0.769	-0.0126	-0.17	0.729	-0.0143	-0.19	-0.258	-0.9977	1969491	Cerep_004254	O=S(=O)(NC1CCN(Cc2ccc3OCCOc3c2)C1)c4ccc(C#N)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E17	compound treatment	0.785	0.00339	0.05	0.742	-0.00128	-0.02	0.02	0.4086	1969492	Cerep_004255	Clc1cccc(Cl)c1/C=N/NC(=O)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E18	compound treatment	0.787	0.00539	0.07	0.738	-0.00528	-0.07	5.0E-4	0.0049	1969493	Cerep_004256	Clc1ccc(s1)S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E19	compound treatment	0.78	-0.00161	-0.02	0.748	0.00472	0.06	0.0302	0.4437	1969494	Cerep_004257	CC(C)(C)c1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E20	compound treatment	0.792	0.0104	0.14	0.76	0.0167	0.23	0.2603	0.9727	1969495	Cerep_004258	CCn1c2ccccc2c3cc(CN4CCN(CC4)S(=O)(=O)c5c(C)cccc5Cl)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E21	compound treatment	0.779	-0.00261	-0.04	0.747	0.00372	0.05	0.011	0.1776	1969496	Cerep_004259	Cc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	E22	compound treatment	0.812	0.0304	0.41	0.776	0.0327	0.45	0.6054	0.9991	1969497	Cerep_004260	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OCc3ccccc3)cc(OCc4ccccc4)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F03	compound treatment	0.805	0.0234	0.32	0.755	0.0117	0.16	0.3361	0.9503	1969498	Cerep_004261	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccc(O)c(c2)C(=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F04	compound treatment	0.753	-0.0286	-0.39	0.713	-0.0303	-0.41	-0.5649	-0.9994	1969499	Cerep_004262	[O-][N+](=O)c1ccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F05	compound treatment	0.782	3.89E-4	0.01	0.745	0.00172	0.02	0.0203	0.8443	1969500	Cerep_004263	Cc1cccc(CC(CC(=O)O)C(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F06	compound treatment	0.76	-0.0216	-0.29	0.736	-0.00728	-0.1	-0.2763	-0.8973	1969501	Cerep_004264	Fc1ccccc1S(=O)(=O)N2CCN(CCc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F07	compound treatment	0.774	-0.00761	-0.1	0.744	7.21E-4	0.01	-0.0657	-0.6365	1969502	Cerep_004265	COc1cccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F08	compound treatment	0.769	-0.0126	-0.17	0.704	-0.0393	-0.54	-0.499	-0.888	1969503	Cerep_004266	CC(C)c1ccc(CN2CCC(C2)N(C)S(=O)(=O)c3ccc(Br)s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F09	compound treatment	0.766	-0.0156	-0.21	0.734	-0.00928	-0.13	-0.2384	-0.9703	1969504	Cerep_004267	O=C(Nc1ccccc1C(=O)N/N=C/c2cc(OCc3ccccc3)cc(OCc4ccccc4)c2)c5cccs5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F10	compound treatment	0.789	0.00739	0.1	0.734	-0.00928	-0.13	-0.019	-0.1179	1969505	Cerep_004268	[O-][N+](=O)c1ccc(NC(=O)CNS(=O)(=O)c2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F11	compound treatment	0.793	0.0114	0.15	0.742	-0.00128	-0.02	0.0963	0.6228	1969506	Cerep_004269	Clc1cc(sc1Cl)S(=O)(=O)Nc2ccc3OCCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F12	compound treatment	0.768	-0.0136	-0.18	0.712	-0.0313	-0.43	-0.4314	-0.9291	1969507	Cerep_004270	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCCN(Cc3ccc(Cl)c(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F13	compound treatment	0.786	0.00439	0.06	0.734	-0.00928	-0.13	-0.0476	-0.3408	1969508	Cerep_004271	FC(F)(F)c1cc(cc(c1)S(=O)(=O)N2CCN(Cc3ccnc4ccccc34)CC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F14	compound treatment	0.746	-0.0356	-0.48	0.726	-0.0173	-0.24	-0.5063	-0.9462	1969509	Cerep_004272	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F15	compound treatment	0.781	-6.11E-4	-0.01	0.75	0.00672	0.09	0.059	0.6409	1969510	Cerep_004273	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC(=O)N3CCCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F16	compound treatment	0.785	0.00339	0.05	0.758	0.0147	0.2	0.1743	0.8465	1969511	Cerep_004274	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCCOc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F17	compound treatment	0.762	-0.0196	-0.26	0.735	-0.00828	-0.11	-0.2669	-0.9279	1969512	Cerep_004275	CC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F18	compound treatment	0.775	-0.00661	-0.09	0.745	0.00172	0.02	-0.0465	-0.5039	1969513	Cerep_004276	COc1ccc2[nH]cc(CCNS(=O)(=O)c3cccc(C)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F19	compound treatment	0.808	0.0264	0.36	0.75	0.00672	0.09	0.3165	0.8611	1969514	Cerep_004277	Clc1cc(Cl)cc(c1)S(=O)(=O)NCc2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F20	compound treatment	0.763	-0.0186	-0.25	0.713	-0.0303	-0.41	-0.4695	-0.9716	1969515	Cerep_004278	COc1ccc(cc1OC)S(=O)(=O)NCc2ccccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F21	compound treatment	0.764	-0.0176	-0.24	0.768	0.0247	0.34	0.0704	0.1706	1969516	Cerep_004279	Cc1cc(c(C)cc1Cl)S(=O)(=O)N2CCN(CCOCCO)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	F22	compound treatment	0.759	-0.0226	-0.31	0.738	-0.00528	-0.07	-0.2666	-0.8506	1969517	Cerep_004280	FC(F)(F)c1ccc(nc1)N2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G03	compound treatment	0.769	-0.0126	-0.17	0.718	-0.0253	-0.34	-0.3641	-0.947	1969518	Cerep_004281	[O-][N+](=O)c1ccc(C(=O)N/N=C/c2c[nH]c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G04	compound treatment	0.789	0.00739	0.1	0.739	-0.00428	-0.06	0.0292	0.253	1969519	Cerep_004282	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2cccc(Oc3ccc(cc3)C(C)(C)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G05	compound treatment	0.785	0.00339	0.05	0.74	-0.00328	-0.04	7.0E-4	0.0111	1969520	Cerep_004283	Fc1cccc(c1)C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G06	compound treatment	0.784	0.00239	0.03	0.724	-0.0193	-0.26	-0.1631	-0.6158	1969521	Cerep_004284	CC(C)Oc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G07	compound treatment	0.767	-0.0146	-0.2	0.745	0.00172	0.02	-0.1228	-0.6186	1969522	Cerep_004285	[O-][N+](=O)c1cc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cs1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G08	compound treatment	0.774	-0.00761	-0.1	0.76	0.0167	0.23	0.0886	0.3544	1969523	Cerep_004286	Fc1cccc(Cl)c1/C=N/NC(=O)Cc2csc(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G09	compound treatment	0.777	-0.00461	-0.06	0.735	-0.00828	-0.11	-0.1238	-0.9606	1969524	Cerep_004287	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G10	compound treatment	0.763	-0.0186	-0.25	0.727	-0.0163	-0.22	-0.3345	-0.9981	1969525	Cerep_004288	CC(C)(C)c1ccc(Oc2cccc(/C=N/NC(=O)c3cc4ccccc4s3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G11	compound treatment	0.768	-0.0136	-0.18	0.762	0.0187	0.26	0.0507	0.1611	1969526	Cerep_004289	COc1cccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G12	compound treatment	0.79	0.00839	0.11	0.758	0.0147	0.2	0.222	0.9632	1969527	Cerep_004290	[O-][N+](=O)c1ccc(Cl)c(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G13	compound treatment	0.776	-0.00561	-0.08	0.74	-0.00328	-0.04	-0.0851	-0.9684	1969528	Cerep_004291	Fc1cc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G14	compound treatment	0.787	0.00539	0.07	0.732	-0.0113	-0.15	-0.0574	-0.3371	1969529	Cerep_004292	[O-][N+](=O)c1ccc(Cl)c(/C=N/NC(=O)C2CC2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G15	compound treatment	0.783	0.00139	0.02	0.75	0.00672	0.09	0.0781	0.8344	1969530	Cerep_004293	O=C(N/N=C/c1ccccc1C#N)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G16	compound treatment	0.769	-0.0126	-0.17	0.749	0.00572	0.08	-0.0651	-0.348	1969531	Cerep_004294	COc1ccc(OC)c(CN2CCN(CC2)S(=O)(=O)c3ccc(C#N)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G17	compound treatment	0.801	0.0194	0.26	0.779	0.0357	0.49	0.5294	0.9575	1969532	Cerep_004295	[O-][N+](=O)c1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G18	compound treatment	0.809	0.0274	0.37	0.73	-0.0133	-0.18	0.1332	0.3238	1969533	Cerep_004296	Clc1ccc(s1)S(=O)(=O)N2CCC3(CC2)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G19	compound treatment	0.804	0.0224	0.3	0.761	0.0177	0.24	0.3844	0.9939	1969534	Cerep_004297	COc1cccc(/C=N/NC(=O)COc2ccccc2Cl)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G20	compound treatment	0.792	0.0104	0.14	0.761	0.0177	0.24	0.27	0.9664	1969535	Cerep_004298	Cc1cccc(Cl)c1S(=O)(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G21	compound treatment	0.795	0.0134	0.18	0.752	0.00872	0.12	0.2118	0.9794	1969536	Cerep_004299	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(Cl)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	G22	compound treatment	0.775	-0.00661	-0.09	0.743	-2.79E-4	0.0	-0.0658	-0.7366	1969537	Cerep_004300	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H03	compound treatment	0.798	0.0164	0.22	0.741	-0.00228	-0.03	0.1344	0.6018	1969538	Cerep_004301	O=C(N/N=C/C=C/c1ccccc1)c2cc(nc3ccccc23)C4CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H04	compound treatment	0.747	-0.0346	-0.47	0.728	-0.0153	-0.21	-0.4775	-0.9339	1969539	Cerep_004302	CN(C)CCN1CCN(CC1)S(=O)(=O)c2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H05	compound treatment	0.795	0.0134	0.18	0.753	0.00972	0.13	0.2215	0.9884	1969540	Cerep_004303	O=C(N/N=C/C=C/c1ccccc1)c2ccc3nonc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H06	compound treatment	0.743	-0.0386	-0.52	0.737	-0.00628	-0.09	-0.4289	-0.8124	1969541	Cerep_004304	Fc1ccccc1S(=O)(=O)NCCc2c[nH]c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H07	compound treatment	0.793	0.0114	0.15	0.781	0.0377	0.51	0.4724	0.8799	1969542	Cerep_004305	[O-][N+](=O)c1ccc(Cl)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H08	compound treatment	0.767	-0.0146	-0.2	0.717	-0.0263	-0.36	-0.3928	-0.9604	1969543	Cerep_004306	CN(C1CCN(Cc2ccccc2OCc3ccccc3)C1)S(=O)(=O)c4ccc(Br)s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H09	compound treatment	0.792	0.0104	0.14	0.738	-0.00528	-0.07	0.0482	0.3059	1969544	Cerep_004307	Oc1c(/C=N\NC(=O)c2ccccc2NC(=O)c3cccs3)cc(Br)cc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H10	compound treatment	0.762	-0.0196	-0.26	0.747	0.00372	0.05	-0.1512	-0.5613	1969545	Cerep_004308	CN(C)CCN1CCN(CC1)S(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H11	compound treatment	0.774	-0.00761	-0.1	0.747	0.00372	0.05	-0.0367	-0.3207	1969546	Cerep_004309	Clc1cc(sc1Cl)S(=O)(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H12	compound treatment	0.765	-0.0166	-0.22	0.719	-0.0243	-0.33	-0.3926	-0.9819	1969547	Cerep_004310	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H13	compound treatment	0.764	-0.0176	-0.24	0.748	0.00472	0.06	-0.1225	-0.4976	1969548	Cerep_004311	COc1ccc(OC)c(CNS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H14	compound treatment	0.763	-0.0186	-0.25	0.725	-0.0183	-0.25	-0.3538	-1.0	1969549	Cerep_004312	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H15	compound treatment	0.781	-6.11E-4	-0.01	0.707	-0.0363	-0.49	-0.3556	-0.7188	1969550	Cerep_004313	Clc1ccc(cc1)S(=O)(=O)NC2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H16	compound treatment	0.745	-0.0366	-0.49	0.725	-0.0183	-0.25	-0.5255	-0.9499	1969551	Cerep_004314	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCc2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H17	compound treatment	0.781	-6.11E-4	-0.01	0.768	0.0247	0.34	0.2325	0.6896	1969552	Cerep_004315	Oc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H18	compound treatment	0.745	-0.0366	-0.49	0.739	-0.00428	-0.06	-0.3905	-0.7852	1969553	Cerep_004316	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)S(=O)(=O)c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H19	compound treatment	0.798	0.0164	0.22	0.769	0.0257	0.35	0.4043	0.9752	1969554	Cerep_004317	CCN1CCCC1CNS(=O)(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H20	compound treatment	0.791	0.00939	0.13	0.728	-0.0153	-0.21	-0.0578	-0.2369	1200494	Cerep_004318	COc1ccc(cc1OC)S(=O)(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H21	compound treatment	0.804	0.0224	0.3	0.752	0.00872	0.12	0.2977	0.917	1969555	Cerep_004319	O=C(COc1ncn(n1)c2ccccc2)N/N=C/c3cccc(Oc4ccccc4)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	H22	compound treatment	0.778	-0.00361	-0.05	0.713	-0.0303	-0.41	-0.3264	-0.7851	1969556	Cerep_004320	CC1CN(CCN1c2ccc(C)cc2)S(=O)(=O)c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I03	compound treatment	0.806	0.0244	0.33	0.765	0.0217	0.3	0.4421	0.9986	1969557	Cerep_004321	O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I04	compound treatment	0.775	-0.00661	-0.09	0.743	-2.79E-4	0.0	-0.0658	-0.7366	1969558	Cerep_004322	FC(F)(F)c1cccc(Oc2cccc(/C=N/NC(=O)Cc3c[nH]c4ccccc34)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I05	compound treatment	0.762	-0.0196	-0.26	0.751	0.00772	0.11	-0.1126	-0.3955	1969559	Cerep_004323	COc1cc(O)c(/C=N/NC(=O)c2ccc(cc2)N(C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I06	compound treatment	0.773	-0.00861	-0.12	0.752	0.00872	0.12	0.0019	0.0117	1969560	Cerep_004324	COc1cc(/C=N/NC(=O)c2cc3ccccc3s2)ccc1OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I07	compound treatment	0.765	-0.0166	-0.22	0.748	0.00472	0.06	-0.1129	-0.4844	1969561	Cerep_004325	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I08	compound treatment	0.788	0.00639	0.09	0.733	-0.0103	-0.14	-0.0382	-0.232	1969562	Cerep_004326	COc1cc(/C=N/NC(=O)c2cc3ccccc3s2)cc(Br)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I09	compound treatment	0.787	0.00539	0.07	0.746	0.00272	0.04	0.0776	0.9513	1969563	Cerep_004327	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I10	compound treatment	0.77	-0.0116	-0.16	0.738	-0.00528	-0.07	-0.1617	-0.9378	1969564	Cerep_004328	FC(F)(F)c1cccc(Oc2cccc(/C=N/NC(=O)C3CC3c4ccccc4)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I11	compound treatment	0.772	-0.00961	-0.13	0.723	-0.0203	-0.28	-0.2872	-0.9404	1969565	Cerep_004329	[O-][N+](=O)c1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I12	compound treatment	0.79	0.00839	0.11	0.759	0.0157	0.21	0.2316	0.9554	1969566	Cerep_004330	COc1cccc(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I13	compound treatment	0.779	-0.00261	-0.04	0.737	-0.00628	-0.09	-0.0855	-0.923	1969567	Cerep_004331	CCC(=O)Oc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I14	compound treatment	0.799	0.0174	0.23	0.749	0.00572	0.08	0.221	0.8941	1969568	Cerep_004332	COc1cccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I15	compound treatment	0.782	3.89E-4	0.01	0.724	-0.0193	-0.26	-0.1822	-0.6929	1969569	Cerep_004333	CC(=O)Nc1ccc(/C=N/NC(=O)c2ccccc2Oc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I16	compound treatment	0.761	-0.0206	-0.28	0.743	-2.79E-4	0.0	-0.1993	-0.7167	1969570	Cerep_004334	CSCCC(CO)NS(=O)(=O)c1ccc(C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I17	compound treatment	0.8	0.0184	0.25	0.766	0.0227	0.31	0.3945	0.9939	1969571	Cerep_004335	[O-][N+](=O)c1cccc(/C=N/NC(=O)COc2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I18	compound treatment	0.798	0.0164	0.22	0.751	0.00772	0.11	0.2308	0.9424	1969572	Cerep_004336	CCC(C)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I19	compound treatment	0.792	0.0104	0.14	0.755	0.0117	0.16	0.2121	0.9979	1969573	Cerep_004337	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(o2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I20	compound treatment	0.766	-0.0156	-0.21	0.753	0.00972	0.13	-0.0552	-0.2218	1969574	Cerep_004338	COc1ccc(N2CCN(CC2)S(=O)(=O)c3c(C)cccc3Cl)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I21	compound treatment	0.817	0.0354	0.48	0.74	-0.00328	-0.04	0.306	0.6381	1969575	Cerep_004339	CCC(=O)Oc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	I22	compound treatment	0.808	0.0264	0.36	0.749	0.00572	0.08	0.3069	0.8421	1969576	Cerep_004340	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccccc2OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J03	compound treatment	0.803	0.0214	0.29	0.752	0.00872	0.12	0.2881	0.9232	1969577	Cerep_004341	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2cc(Br)cc(Br)c2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J04	compound treatment	0.781	-6.11E-4	-0.01	0.73	-0.0133	-0.18	-0.1339	-0.7385	1969578	Cerep_004342	CC(C)N1CCN(CC1)S(=O)(=O)c2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J05	compound treatment	0.792	0.0104	0.14	0.776	0.0327	0.45	0.4146	0.8865	1969579	Cerep_004343	Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c2cc(Br)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J06	compound treatment	0.76	-0.0216	-0.29	0.745	0.00172	0.02	-0.1896	-0.6481	1969580	Cerep_004344	Fc1ccccc1S(=O)(=O)N2CCC3(CC2)OCCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J07	compound treatment	0.771	-0.0106	-0.14	0.755	0.0117	0.16	0.0118	0.055	1969581	Cerep_004345	COc1cccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J08	compound treatment	0.786	0.00439	0.06	0.729	-0.0143	-0.19	-0.0958	-0.4708	1969582	Cerep_004346	Cc1ccc(cc1)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J09	compound treatment	0.786	0.00439	0.06	0.755	0.0117	0.16	0.1549	0.9087	1969583	Cerep_004347	C=CCOc1ccccc1/C=N/NC(=O)c2cc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J10	compound treatment	0.755	-0.0266	-0.36	0.724	-0.0193	-0.26	-0.4397	-0.9883	1969584	Cerep_004348	CC(C)N1CCN(CC1)S(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J11	compound treatment	0.791	0.00939	0.13	0.754	0.0107	0.15	0.1929	0.9974	1969585	Cerep_004349	CN1CCN(CCCNS(=O)(=O)c2cc(Cl)c(Cl)s2)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J12	compound treatment	0.763	-0.0186	-0.25	0.729	-0.0143	-0.19	-0.3152	-0.9921	1969586	Cerep_004350	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(C)C2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J13	compound treatment	0.766	-0.0156	-0.21	0.741	-0.00228	-0.03	-0.1709	-0.8028	1969587	Cerep_004351	FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)N2CCN(CCc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J14	compound treatment	0.766	-0.0156	-0.21	0.722	-0.0213	-0.29	-0.3541	-0.9876	1666893	Cerep_004352	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(OC)cc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J15	compound treatment	0.786	0.00439	0.06	0.739	-0.00428	-0.06	6.0E-4	0.0073	1969588	Cerep_004353	COc1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J16	compound treatment	0.758	-0.0236	-0.32	0.705	-0.0383	-0.52	-0.5943	-0.9719	1969589	Cerep_004354	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J17	compound treatment	0.784	0.00239	0.03	0.736	-0.00728	-0.1	-0.0474	-0.4542	1969590	Cerep_004355	Clc1ccc(cc1)S(=O)(=O)N2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J18	compound treatment	0.761	-0.0206	-0.28	0.702	-0.0413	-0.56	-0.5946	-0.9471	1969591	Cerep_004356	Cc1cccc(c1)S(=O)(=O)NCCN2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J19	compound treatment	0.814	0.0324	0.44	0.76	0.0167	0.23	0.4702	0.954	1969592	Cerep_004357	[O-][N+](=O)c1ccc(NCCNS(=O)(=O)c2cc(Cl)cc(Cl)c2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J20	compound treatment	0.794	0.0124	0.17	0.698	-0.0453	-0.62	-0.3184	-0.4978	1969593	Cerep_004358	COCC1CCCN1S(=O)(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J21	compound treatment	0.808	0.0264	0.36	0.755	0.0117	0.16	0.3647	0.9347	1969594	Cerep_004359	Cc1ccc(Oc2cccc(/C=N/NC(=O)c3ccc4nonc4c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	J22	compound treatment	0.755	-0.0266	-0.36	0.723	-0.0203	-0.28	-0.4494	-0.9917	1969595	Cerep_004360	COc1ccccc1NS(=O)(=O)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K03	compound treatment	0.807	0.0254	0.34	0.758	0.0147	0.2	0.3841	0.9676	1969596	Cerep_004361	COc1cscc1C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K04	compound treatment	0.792	0.0104	0.14	0.759	0.0157	0.21	0.2507	0.9788	1969597	Cerep_004362	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2cccc(Oc3ccc(Cl)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K05	compound treatment	0.773	-0.00861	-0.12	0.734	-0.00928	-0.13	-0.1716	-0.9991	1969598	Cerep_004363	COc1cc(O)c(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K06	compound treatment	0.811	0.0294	0.4	0.756	0.0127	0.17	0.403	0.9313	1969599	Cerep_004364	COc1cc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc(OC)c1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K07	compound treatment	0.762	-0.0196	-0.26	0.742	-0.00128	-0.02	-0.1994	-0.7521	1969600	Cerep_004365	COc1ccc(cc1)C(=O)N/N=C/c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K08	compound treatment	0.791	0.00939	0.13	0.758	0.0147	0.2	0.2315	0.9753	1969601	Cerep_004366	COc1cc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc(OC)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K09	compound treatment	0.764	-0.0176	-0.24	0.75	0.00672	0.09	-0.1032	-0.4052	1969602	Cerep_004367	CC(=O)Oc1ccc(/C=N/NC(=O)CC2Sc3ccccc3NC2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K10	compound treatment	0.81	0.0284	0.38	0.769	0.0257	0.35	0.5188	0.999	1969603	Cerep_004368	Clc1ccc(Oc2cccc(/C=N/NC(=O)c3cc4ccccc4s3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K11	compound treatment	0.767	-0.0146	-0.2	0.754	0.0107	0.15	-0.036	-0.1467	1969604	Cerep_004369	COc1ccc(cc1)C(=O)N/N=C/c2cccc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K12	compound treatment	0.781	-6.11E-4	-0.01	0.746	0.00272	0.04	0.0204	0.5369	1969605	Cerep_004370	COc1cc(/C=N/NC(=O)c2ccc3nonc3c2)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K13	compound treatment	0.773	-0.00861	-0.12	0.723	-0.0203	-0.28	-0.2777	-0.9258	1969606	Cerep_004371	CC(=O)Oc1cccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K14	compound treatment	0.78	-0.00161	-0.02	0.729	-0.0143	-0.19	-0.1531	-0.7812	1969607	Cerep_004372	COc1cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K15	compound treatment	0.8	0.0184	0.25	0.789	0.0457	0.62	0.6163	0.9184	1969608	Cerep_004373	Clc1cccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K16	compound treatment	0.791	0.00939	0.13	0.883	0.14	1.91	1.4368	0.7525	1490870	Cerep_004374	O=S(=O)(N1CCN(Cc2ccccc2)CC1)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K17	compound treatment	0.805	0.0234	0.32	0.729	-0.0143	-0.19	0.0854	0.2304	1969609	Cerep_004375	CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(cc2)S(=O)(=O)N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K18	compound treatment	0.8	0.0184	0.25	0.752	0.00872	0.12	0.2595	0.9433	1969610	Cerep_004376	Clc1ccc(s1)S(=O)(=O)NCCCn2ccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K19	compound treatment	0.776	-0.00561	-0.08	0.76	0.0167	0.23	0.1077	0.4483	1969611	Cerep_004377	Cc1cccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K20	compound treatment	0.795	0.0134	0.18	0.753	0.00972	0.13	0.2215	0.9884	1969612	Cerep_004378	CC(N1CCN(CC1)S(=O)(=O)c2c(C)cccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K21	compound treatment	0.799	0.0174	0.23	0.767	0.0237	0.32	0.3946	0.9876	1969613	Cerep_004379	CC(=O)Oc1cccc(/C=N/NC(=O)COc2ccccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	K22	compound treatment	0.78	-0.00161	-0.02	0.751	0.00772	0.11	0.0591	0.5495	1969614	Cerep_004380	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2c(O)ccc3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L03	compound treatment	0.812	0.0304	0.41	0.752	0.00872	0.12	0.374	0.8761	1969615	Cerep_004381	Oc1ccc(Br)cc1/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L04	compound treatment	0.764	-0.0176	-0.24	0.713	-0.0303	-0.41	-0.46	-0.9655	1969616	Cerep_004382	COc1cc(OC)c(CN2CCN(CC2)S(=O)(=O)c3ccc(F)cc3F)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L05	compound treatment	0.804	0.0224	0.3	0.74	-0.00328	-0.04	0.182	0.5959	1969617	Cerep_004383	Oc1ccc(Br)cc1/C=N/NC(=O)COc2ncn(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L06	compound treatment	0.769	-0.0126	-0.17	0.735	-0.00828	-0.11	-0.2001	-0.9802	1969618	Cerep_004384	Fc1ccccc1S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L07	compound treatment	0.773	-0.00861	-0.12	0.743	-2.79E-4	0.0	-0.0848	-0.7299	1969619	Cerep_004385	COc1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)c(cc1OC)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L08	compound treatment	0.76	-0.0216	-0.29	0.724	-0.0193	-0.26	-0.3921	-0.9987	1969620	Cerep_004386	COc1ccc(cc1F)C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Br)s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L09	compound treatment	0.775	-0.00661	-0.09	0.751	0.00772	0.11	0.0114	0.0825	1969621	Cerep_004387	Oc1ccc2ccccc2c1/C=N\NC(=O)c3ccccc3NC(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L10	compound treatment	0.765	-0.0166	-0.22	0.736	-0.00728	-0.1	-0.2286	-0.9329	1969622	Cerep_004388	COc1cc(OC)c(CN2CCN(CC2)S(=O)(=O)c3ccccc3Cl)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L11	compound treatment	0.784	0.00239	0.03	0.731	-0.0123	-0.17	-0.0956	-0.5607	1969623	Cerep_004389	OCCOCCN1CCN(CC1)S(=O)(=O)c2cc(Cl)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L12	compound treatment	0.76	-0.0216	-0.29	0.721	-0.0223	-0.3	-0.421	-0.9998	1614251	Cerep_004390	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N(CCN(C)C)Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L13	compound treatment	0.783	0.00139	0.02	0.741	-0.00228	-0.03	-0.0087	-0.2405	1969624	Cerep_004391	CC(C)(C)OC(=O)NC1CCN(C1)S(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L14	compound treatment	0.767	-0.0146	-0.2	0.714	-0.0293	-0.4	-0.4217	-0.9471	1969625	Cerep_004392	CCCCc1ccc(NS(=O)(=O)c2ccc(cc2)C(C)(C)CC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L15	compound treatment	0.797	0.0154	0.21	0.751	0.00772	0.11	0.2212	0.9505	1969626	Cerep_004393	CC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L16	compound treatment	0.759	-0.0226	-0.31	0.715	-0.0283	-0.39	-0.4884	-0.9933	1969627	Cerep_004394	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCCN2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L17	compound treatment	0.793	0.0114	0.15	0.749	0.00572	0.08	0.1638	0.9506	1685879	Cerep_004395	Clc1ccc(cc1)S(=O)(=O)NCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L18	compound treatment	0.755	-0.0266	-0.36	0.737	-0.00628	-0.09	-0.3144	-0.8519	1283001	Cerep_004396	CC1CN(CC(C)O1)S(=O)(=O)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L19	compound treatment	0.799	0.0174	0.23	0.735	-0.00828	-0.11	0.086	0.3305	1969628	Cerep_004397	CCN(CCNS(=O)(=O)c1cc(Cl)cc(Cl)c1)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L20	compound treatment	0.767	-0.0146	-0.2	0.745	0.00172	0.02	-0.1228	-0.6186	1969629	Cerep_004398	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)C(C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L21	compound treatment	0.805	0.0234	0.32	0.752	0.00872	0.12	0.3072	0.9111	1969630	Cerep_004399	COc1ccc(Oc2cccc(/C=N/NC(=O)c3ccc4nonc4c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	L22	compound treatment	0.776	-0.00561	-0.08	0.742	-0.00128	-0.02	-0.0659	-0.8478	1969631	Cerep_004400	COc1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M03	compound treatment	0.78	-0.00161	-0.02	0.755	0.0117	0.16	0.0976	0.6054	1969632	Cerep_004401	O=C(Nc1ccccc1C(=O)N/N=C/c2c[nH]c3cc(OCc4ccccc4)ccc23)c5cccs5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M04	compound treatment	0.813	0.0314	0.42	0.772	0.0287	0.39	0.5764	0.9992	1969633	Cerep_004402	Oc1cc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M05	compound treatment	0.788	0.00639	0.09	0.76	0.0167	0.23	0.2222	0.9114	1969634	Cerep_004403	O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c3nc(no3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M06	compound treatment	0.799	0.0174	0.23	0.755	0.0117	0.16	0.2789	0.9825	1969635	Cerep_004404	CSc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M07	compound treatment	0.801	0.0194	0.26	0.772	0.0287	0.39	0.4619	0.9807	1969636	Cerep_004405	[O-][N+](=O)c1ccccc1/C=N\NC(=O)CC2Sc3ccccc3NC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M08	compound treatment	0.801	0.0194	0.26	0.779	0.0357	0.49	0.5294	0.9575	1969637	Cerep_004406	COc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M09	compound treatment	0.772	-0.00961	-0.13	0.747	0.00372	0.05	-0.0558	-0.4008	1969638	Cerep_004407	COc1ccc(cc1)C(=O)N/N=C/c2cccc(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M10	compound treatment	0.802	0.0204	0.28	0.768	0.0247	0.34	0.4329	0.9949	1969639	Cerep_004408	Oc1cc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)ccc1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M11	compound treatment	0.781	-6.11E-4	-0.01	0.75	0.00672	0.09	0.059	0.6409	1969640	Cerep_004409	Cc1cc(Cl)ccc1OCC(=O)N/N=C/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M12	compound treatment	0.78	-0.00161	-0.02	0.744	7.21E-4	0.01	-0.0084	-0.3529	1969641	Cerep_004410	COc1cc(Br)c(/C=N/NC(=O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M13	compound treatment	0.785	0.00339	0.05	0.74	-0.00328	-0.04	7.0E-4	0.0111	1969642	Cerep_004411	O=C(CC1Sc2ccccc2NC1=O)N/N=C/c3ccoc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M14	compound treatment	0.813	0.0314	0.42	0.767	0.0237	0.32	0.5282	0.9912	1969643	Cerep_004412	COc1ccc(Cl)cc1C(=O)N/N=C/c2cc(OC)c(OC)cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M15	compound treatment	0.762	-0.0196	-0.26	0.735	-0.00828	-0.11	-0.2669	-0.9279	1969644	Cerep_004413	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C\c2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M16	compound treatment	0.809	0.0274	0.37	0.732	-0.0113	-0.15	0.1525	0.3811	1969645	Cerep_004414	CN(C)CCNS(=O)(=O)c1ccc(C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M17	compound treatment	0.797	0.0154	0.21	0.748	0.00472	0.06	0.1923	0.8848	1969646	Cerep_004415	Fc1cccc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M18	compound treatment	0.787	0.00539	0.07	0.732	-0.0113	-0.15	-0.0574	-0.3371	1969647	Cerep_004416	Clc1ccc(s1)S(=O)(=O)Nc2ccc3[nH]ncc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M19	compound treatment	0.792	0.0104	0.14	0.759	0.0157	0.21	0.2507	0.9788	1969648	Cerep_004417	Clc1ccccc1OCC(=O)N/N=C/c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M20	compound treatment	0.794	0.0124	0.17	0.75	0.00672	0.09	0.183	0.96	1969649	Cerep_004418	COCC1CCCN1S(=O)(=O)c2c(C)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M21	compound treatment	0.808	0.0264	0.36	0.776	0.0327	0.45	0.5672	0.9937	1969650	Cerep_004419	NS(=O)(=O)c1ccc(cc1)C(=O)N/N=C/c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	M22	compound treatment	0.817	0.0354	0.48	0.758	0.0147	0.2	0.4795	0.9259	1969651	Cerep_004420	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccc3OCOc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N03	compound treatment	0.817	0.0354	0.48	0.76	0.0167	0.23	0.4988	0.9428	1969652	Cerep_004421	CCCCCCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2cc(OC)ccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N04	compound treatment	0.77	-0.0116	-0.16	0.734	-0.00928	-0.13	-0.2002	-0.9944	1969653	Cerep_004422	CC(C)(C)Sc1ccccc1CN2CCN(CC2)S(=O)(=O)c3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N05	compound treatment	0.803	0.0214	0.29	0.76	0.0167	0.23	0.3653	0.9932	1969654	Cerep_004423	COc1ccc(O)c(/C=N/NC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N06	compound treatment	0.768	-0.0136	-0.18	0.734	-0.00928	-0.13	-0.2193	-0.9835	1969655	Cerep_004424	Fc1ccccc1S(=O)(=O)NC2CCN(Cc3ccccc3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N07	compound treatment	0.773	-0.00861	-0.12	0.801	0.0577	0.79	0.4744	0.5963	1969656	Cerep_004425	COc1cc(Br)c(/C=N/NC(=O)Cc2c[nH]c3ccccc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N08	compound treatment	0.739	-0.0426	-0.57	0.738	-0.00528	-0.07	-0.4574	-0.7895	1969657	Cerep_004426	Fc1ccc(CNS(=O)(=O)c2ccc(Br)s2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N09	compound treatment	0.762	-0.0196	-0.26	0.718	-0.0253	-0.34	-0.4308	-0.9915	1969658	Cerep_004427	O=C(Nc1ccccc1C(=O)N/N=C/c2ccc3OCOc3c2)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N10	compound treatment	0.77	-0.0116	-0.16	0.695	-0.0483	-0.66	-0.5763	-0.8516	1969659	Cerep_004428	CC(C)(C)Sc1ccccc1CN2CCN(CC2)S(=O)(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N11	compound treatment	0.78	-0.00161	-0.02	0.746	0.00272	0.04	0.0109	0.2527	1969660	Cerep_004429	CC(=O)NC1CCN(C1)S(=O)(=O)c2cc(Cl)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N12	compound treatment	0.781	-6.11E-4	-0.01	0.731	-0.0123	-0.17	-0.1242	-0.741	1969661	Cerep_004430	CCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(C)(C)CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N13	compound treatment	0.821	0.0394	0.53	0.712	-0.0313	-0.43	0.0741	0.1088	1969662	Cerep_004431	COc1cc(CCNS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N14	compound treatment	0.796	0.0144	0.19	0.743	-2.79E-4	0.0	0.1346	0.6931	1714736	Cerep_004432	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N15	compound treatment	0.728	-0.0536	-0.72	0.739	-0.00428	-0.06	-0.5527	-0.7617	1969663	Cerep_004433	Cc1ncc([N+](=O)[O-])n1CCNS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N16	compound treatment	0.791	0.00939	0.13	0.736	-0.00728	-0.1	0.0194	0.1204	1969664	Cerep_004434	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC(C2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N17	compound treatment	0.813	0.0314	0.42	0.72	-0.0233	-0.32	0.075	0.1416	1670579	Cerep_004435	Clc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N18	compound treatment	0.767	-0.0146	-0.2	0.725	-0.0183	-0.25	-0.3156	-0.9932	1969665	Cerep_004436	Cc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3c(Cl)cncc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N19	compound treatment	0.787	0.00539	0.07	0.713	-0.0303	-0.41	-0.2406	-0.5738	1969666	Cerep_004437	Clc1cc(Cl)cc(c1)S(=O)(=O)NCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N20	compound treatment	0.771	-0.0106	-0.14	0.735	-0.00828	-0.11	-0.1811	-0.9931	1645177	Cerep_004438	COc1ccc(N2CCN(CC2)S(=O)(=O)c3ccc(OC)c(OC)c3)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N21	compound treatment	0.795	0.0134	0.18	0.766	0.0227	0.31	0.3468	0.967	1969667	Cerep_004439	COc1cc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)ccc1OC(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	N22	compound treatment	0.749	-0.0326	-0.44	0.704	-0.0393	-0.54	-0.6898	-0.9952	1969668	Cerep_004440	Clc1cccc(c1Cl)S(=O)(=O)N2CCN(Cc3ccsc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O03	compound treatment	0.791	0.00939	0.13	0.758	0.0147	0.2	0.2315	0.9753	1969669	Cerep_004441	O=C(N/N=C/c1c[nH]c2cc(OCc3ccccc3)ccc12)c4csc(CS(=O)(=O)Cc5ccco5)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O04	compound treatment	0.778	-0.00361	-0.05	0.775	0.0317	0.43	0.2714	0.6235	1969670	Cerep_004442	COc1ccc(/C=N/NC(=O)c2cc(nc3ccccc23)C4CC4)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O05	compound treatment	0.803	0.0214	0.29	0.763	0.0197	0.27	0.3942	0.9994	1969671	Cerep_004443	O=C(Nc1ccccc1C(=O)N/N=C/c2cccc(OCc3ccccc3)c2)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O06	compound treatment	0.808	0.0264	0.36	0.779	0.0357	0.49	0.5962	0.9881	1969672	Cerep_004444	Oc1cccc(/C=N/NC(=O)c2cc3ccccc3s2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O07	compound treatment	0.783	0.00139	0.02	0.759	0.0157	0.21	0.1648	0.766	1969673	Cerep_004445	COC(=O)c1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O08	compound treatment	0.811	0.0294	0.4	0.773	0.0297	0.41	0.5669	0.9999	1969674	Cerep_004446	COc1ccccc1/C=N/NC(=O)c2cc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O09	compound treatment	0.851	0.0694	0.94	0.788	0.0447	0.61	1.0931	0.9784	1969675	Cerep_004447	CCC(=O)Nc1cccc(c1)C(=O)N/N=C/c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O10	compound treatment	0.773	-0.00861	-0.12	0.734	-0.00928	-0.13	-0.1716	-0.9991	1969676	Cerep_004448	COc1ccc(/C=N/NC(=O)Cc2csc(n2)c3ccccc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O11	compound treatment	0.804	0.0224	0.3	0.758	0.0147	0.2	0.3555	0.9803	1969677	Cerep_004449	CCn1c2ccccc2c3cc(/C=N/NC(=O)CC4Sc5ccccc5NC4=O)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O12	compound treatment	0.802	0.0204	0.28	0.76	0.0167	0.23	0.3557	0.9957	1969678	Cerep_004450	CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O13	compound treatment	0.777	-0.00461	-0.06	0.725	-0.0183	-0.25	-0.2202	-0.8573	1969679	Cerep_004451	COc1ccc(cc1)C(=O)N/N=C/c2cc(C)cc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O14	compound treatment	0.795	0.0134	0.18	0.763	0.0197	0.27	0.3179	0.9812	1969680	Cerep_004452	CCOc1ccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O15	compound treatment	0.803	0.0214	0.29	0.754	0.0107	0.15	0.3074	0.9504	1969681	Cerep_004453	COC(=O)c1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O16	compound treatment	0.801	0.0194	0.26	0.736	-0.00728	-0.1	0.1148	0.4102	1969682	Cerep_004454	O=S(=O)(NCc1ccncc1)c2ccc(C#N)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O17	compound treatment	0.784	0.00239	0.03	0.763	0.0197	0.27	0.2129	0.7862	1969683	Cerep_004455	O=C(N/N=C/c1ccncc1)c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O18	compound treatment	0.797	0.0154	0.21	0.76	0.0167	0.23	0.308	0.9989	1671743	Cerep_004456	Clc1ccc(s1)S(=O)(=O)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O19	compound treatment	0.806	0.0244	0.33	0.763	0.0197	0.27	0.4228	0.995	1969684	Cerep_004457	CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccc(cc4)S(=O)(=O)N)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O20	compound treatment	0.806	0.0244	0.33	0.766	0.0227	0.31	0.4517	0.9995	1969685	Cerep_004458	Cc1cccc(Cl)c1S(=O)(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O21	compound treatment	0.818	0.0364	0.49	0.786	0.0427	0.58	0.7591	0.9964	1969686	Cerep_004459	Cc1cc(C)cc(/C=N/NC(=O)c2ccccc2CCc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	O22	compound treatment	0.806	0.0244	0.33	0.754	0.0107	0.15	0.336	0.9333	1969687	Cerep_004460	COc1cc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P03	compound treatment	0.789	0.00739	0.1	0.755	0.0117	0.16	0.1835	0.9742	1969688	Cerep_004461	CSCCC(NC(=O)c1ccc(cc1)C(F)(F)F)C(=O)N/N=C/c2ccc(O)cc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P04	compound treatment	0.766	-0.0156	-0.21	0.729	-0.0143	-0.19	-0.2866	-0.9992	1969689	Cerep_004462	Fc1ccc(c(F)c1)S(=O)(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P05	compound treatment	0.803	0.0214	0.29	0.754	0.0107	0.15	0.3074	0.9504	1969690	Cerep_004463	Oc1ccc(/C=N/NC(=O)\C=C\c2ccc3OCOc3c2)c(O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P06	compound treatment	0.752	-0.0296	-0.4	0.729	-0.0143	-0.19	-0.4202	-0.9454	1969691	Cerep_004464	Fc1ccccc1S(=O)(=O)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P07	compound treatment	0.759	-0.0226	-0.31	0.729	-0.0143	-0.19	-0.3534	-0.9765	1969692	Cerep_004465	CCOc1ccc(/C=N/NC(=O)C(CCSC)NC(=O)c2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P08	compound treatment	0.752	-0.0296	-0.4	0.726	-0.0173	-0.24	-0.4491	-0.9683	1969693	Cerep_004466	Fc1cccc(F)c1CNS(=O)(=O)c2ccc(Br)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P09	compound treatment	0.709	-0.0726	-0.98	0.727	-0.0163	-0.22	-0.8496	-0.8459	1969694	Cerep_004467	COc1cc(/C=N/NC(=O)c2cc3ccccc3s2)cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P10	compound treatment	0.107	-0.675	-9.1	0.139	-0.604	-8.24	-12.262	-0.9988	1969695	Cerep_004468	Clc1ccccc1S(=O)(=O)N2CCN(Cc3ccc(OCC=C)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P11	compound treatment	0.763	-0.0186	-0.25	0.742	-0.00128	-0.02	-0.1899	-0.7544	1969696	Cerep_004469	NC(=O)C(Cc1ccccc1)NS(=O)(=O)c2cc(Cl)c(Cl)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P12	compound treatment	0.731	-0.0506	-0.68	0.733	-0.0103	-0.14	-0.5819	-0.8349	1969697	Cerep_004470	CCC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3cc(nc4ccc(C)cc34)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P13	compound treatment	0.775	-0.00661	-0.09	0.751	0.00772	0.11	0.0114	0.0825	1969698	Cerep_004471	FC(F)(F)c1cc(cc(c1)S(=O)(=O)NCCc2ccc(OCc3ccccc3)c(OCc4ccccc4)c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P14	compound treatment	0.769	-0.0126	-0.17	0.72	-0.0233	-0.32	-0.3448	-0.9573	1969699	Cerep_004472	CCn1c2ccccc2c3cc(CN4CCN(CC4)S(=O)(=O)c5ccc(cc5)C(C)(C)CC)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P15	compound treatment	0.782	3.89E-4	0.01	0.722	-0.0213	-0.29	-0.2015	-0.6942	1969700	Cerep_004473	CN(CCCNS(=O)(=O)c1ccc(Cl)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P16	compound treatment	0.773	-0.00861	-0.12	0.73	-0.0133	-0.18	-0.2102	-0.977	1596701	Cerep_004474	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCCc2cc(OC)cc(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P17	compound treatment	0.778	-0.00361	-0.05	0.744	7.21E-4	0.01	-0.0275	-0.5533	1224203	Cerep_004475	COc1ccc(OC)c(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P18	compound treatment	0.734	-0.0476	-0.64	0.695	-0.0483	-0.66	-0.9197	-0.9999	1969701	Cerep_004476	Cc1cccc(c1)S(=O)(=O)N2CCN(CC2)c3ncccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P19	compound treatment	0.786	0.00439	0.06	0.737	-0.00628	-0.09	-0.0187	-0.1794	1969702	Cerep_004477	OCCCN1CCN(CC1)S(=O)(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P20	compound treatment	0.771	-0.0106	-0.14	0.709	-0.0343	-0.47	-0.4318	-0.8832	1969703	Cerep_004478	CCCCc1ccc(NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P21	compound treatment	0.763	-0.0186	-0.25	0.738	-0.00528	-0.07	-0.2284	-0.8746	1969704	Cerep_004479	COc1cc(/C=N/NC(=O)COc2ncn(n2)c3ccccc3)cc(O)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.539	P22	compound treatment	0.735	-0.0466	-0.63	0.743	-2.79E-4	0.0	-0.4473	-0.7114	1969705	Cerep_004480	COc1ccc(F)c(CN2CCN(CC2)S(=O)(=O)c3cccc(Cl)c3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A03	compound treatment	0.799	0.0104	0.14	0.776	0.03	0.41	0.3885	0.8975	1969706	Cerep_004481	CCN(CC)CCN(CC)S(=O)(=O)c1cccc2nonc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A04	compound treatment	0.834	0.0454	0.61	0.777	0.031	0.42	0.732	0.9838	1969707	Cerep_004482	Cc1cc(nn1C)C(=O)NNC(=O)/C=C/c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A05	compound treatment	0.797	0.00836	0.11	0.748	0.00204	0.03	0.0994	0.8561	1969708	Cerep_004483	CC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c2ccccc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A06	compound treatment	0.834	0.0454	0.61	0.741	-0.00496	-0.07	0.3849	0.6252	1969709	Cerep_004484	Cc1onc(c1C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3C(C)(C)C)C(C)(C)C)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A07	compound treatment	0.799	0.0104	0.14	0.774	0.028	0.38	0.3692	0.9068	1969710	Cerep_004485	CC(=O)NC1CCN(C1)S(=O)(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A08	compound treatment	0.825	0.0364	0.49	0.755	0.00904	0.12	0.434	0.8582	1969711	Cerep_004486	O=C(CCCCCNC(=O)OCc1ccccc1)N2CCC3(CC2)N(CNC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A09	compound treatment	0.807	0.0184	0.25	0.74	-0.00596	-0.08	0.1177	0.4515	1969712	Cerep_004487	COc1ccc(Cl)cc1S(=O)(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A10	compound treatment	0.8	0.0114	0.15	0.751	0.00504	0.07	0.157	0.9347	1969713	Cerep_004488	Cc1cc([nH]n1)C(=O)NNC(=O)C(CC2CCCCC2)NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A11	compound treatment	0.796	0.00736	0.1	0.74	-0.00596	-0.08	0.0128	0.0994	1969714	Cerep_004489	Cc1cccc(Cl)c1S(=O)(=O)N2CCN(CC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A12	compound treatment	0.857	0.0684	0.92	0.806	0.06	0.82	1.2311	0.9982	1969715	Cerep_004490	Clc1ccc2[nH]cc(CCNC(=O)c3cc(=O)n([nH]3)c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A13	compound treatment	0.775	-0.0136	-0.18	0.74	-0.00596	-0.08	-0.1876	-0.9324	1969716	Cerep_004491	FC(F)(F)Oc1ccccc1S(=O)(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A14	compound treatment	0.791	0.00236	0.03	0.726	-0.02	-0.27	-0.1699	-0.6202	1969717	Cerep_004492	COc1cccc(CNC(=O)Cc2nc(sc2C)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A15	compound treatment	0.788	-6.43E-4	-0.01	0.733	-0.013	-0.18	-0.1311	-0.7409	1969718	Cerep_004493	CN(Cc1cccnc1)S(=O)(=O)c2ccc(cc2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A16	compound treatment	0.85	0.0614	0.83	0.795	0.049	0.67	1.0582	0.9944	1969719	Cerep_004494	Fc1ccc(/C=C/C(=O)NNC(=O)c2cc(=O)n([nH]2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A17	compound treatment	0.781	-0.00764	-0.1	0.744	-0.00196	-0.03	-0.0918	-0.8617	1969720	Cerep_004495	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(c3ccc(Cl)cc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A18	compound treatment	0.823	0.0344	0.46	0.763	0.017	0.23	0.4921	0.949	1969721	Cerep_004496	COC(=O)C(NC(=O)c1cc(=O)n([nH]1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A19	compound treatment	0.799	0.0104	0.14	0.758	0.012	0.16	0.2149	0.9968	1969722	Cerep_004497	CCOC(=O)N1CCN(CC1)S(=O)(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A20	compound treatment	0.807	0.0184	0.25	0.753	0.00704	0.1	0.243	0.915	1969723	Cerep_004498	CC(C)(C)OC(=O)C(NC(=O)c1ccc(s1)c2ccccn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A21	compound treatment	0.794	0.00536	0.07	0.759	0.013	0.18	0.1769	0.9213	1969724	Cerep_004499	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NC2CC3CCC2(C)C3(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	A22	compound treatment	0.798	0.00936	0.13	0.753	0.00704	0.1	0.1572	0.9909	1969725	Cerep_004500	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)NC3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B03	compound treatment	0.821	0.0324	0.44	0.771	0.025	0.34	0.5502	0.9926	1969726	Cerep_004501	COc1cc(nc2ccccc12)C(=O)NNC(=O)c3ccccc3COC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B04	compound treatment	0.789	3.57E-4	0.0	0.744	-0.00196	-0.03	-0.0155	-0.5701	1969727	Cerep_004502	CC(C)(C)c1ccc(COC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OCc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B05	compound treatment	0.807	0.0184	0.25	0.775	0.029	0.4	0.4552	0.9744	1969728	Cerep_004503	CC(=O)Nc1ccc(cc1NC(=O)C)C(=O)NNC(=O)C2=C(CC=C2)n3c(C)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B06	compound treatment	0.796	0.00736	0.1	0.733	-0.013	-0.18	-0.0547	-0.2701	1969729	Cerep_004504	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)OCc5ccc(C)cc5C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B07	compound treatment	0.81	0.0214	0.29	0.739	-0.00696	-0.09	0.1367	0.4505	1969730	Cerep_004505	CCOC(=O)c1cc(C#N)c(nc1C(F)(F)F)N2CCN(CC2)C(=O)c3ccc(CSc4ccccn4)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B08	compound treatment	0.76	-0.0286	-0.39	0.731	-0.015	-0.2	-0.4174	-0.9554	1969731	Cerep_004506	CN(C)c1ccc(CCOC(=O)NNC(=O)/C=C/c2ccco2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B09	compound treatment	0.803	0.0144	0.19	0.736	-0.00996	-0.14	0.041	0.1732	1969732	Cerep_004507	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NCc3ccccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B10	compound treatment	0.81	0.0214	0.29	0.732	-0.014	-0.19	0.0692	0.2003	1969733	Cerep_004508	CSc1sc(cc1c2nc(C)cs2)C(=O)NNC(=O)OCC3CCCN3Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B11	compound treatment	0.784	-0.00464	-0.06	0.76	0.014	0.19	0.0911	0.4523	1969734	Cerep_004509	COC(=O)C(Cc1ccccc1)NC(=O)Cc2nc(oc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B12	compound treatment	0.775	-0.0136	-0.18	0.72	-0.026	-0.35	-0.3804	-0.9536	1969735	Cerep_004510	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCCN3CCN(Cc4cc5ccccc5o4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B13	compound treatment	0.785	-0.00364	-0.05	0.736	-0.00996	-0.14	-0.1307	-0.9056	1969736	Cerep_004511	COCC(Cc1ccccc1)NC(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B14	compound treatment	0.79	0.00136	0.02	0.737	-0.00896	-0.12	-0.0734	-0.5944	1969737	Cerep_004512	Cc1ccc(COC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B15	compound treatment	0.769	-0.0196	-0.26	0.751	0.00504	0.07	-0.1387	-0.5068	1969738	Cerep_004513	CC(=O)Nc1ccc(cc1)C(=O)NC(CCCCNC(=O)OCc2ccccc2)C(=O)OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B16	compound treatment	0.797	0.00836	0.11	0.729	-0.017	-0.23	-0.0838	-0.3257	1969739	Cerep_004514	Clc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B17	compound treatment	0.811	0.0224	0.3	0.763	0.017	0.23	0.3776	0.9917	1969740	Cerep_004515	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)C(NC(=O)Cc2c[nH]c3ccccc23)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B18	compound treatment	0.761	-0.0276	-0.37	0.701	-0.045	-0.61	-0.6972	-0.9716	1969741	Cerep_004516	CC(NC(=O)OCCCc1cccnc1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B19	compound treatment	0.81	0.0214	0.29	0.748	0.00204	0.03	0.2234	0.7719	1969742	Cerep_004517	COc1ccc(C(=O)NNC(=O)c2cnn(c2C(F)(F)F)c3ccc(cc3)[N+](=O)[O-])c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B20	compound treatment	0.787	-0.00164	-0.02	0.733	-0.013	-0.18	-0.1406	-0.7896	1969743	Cerep_004518	O=C(NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)OCC4(CC5CC6CC(C5)C4)C6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B21	compound treatment	0.789	3.57E-4	0.0	0.725	-0.021	-0.29	-0.1987	-0.6951	1969744	Cerep_004519	Cc1nn(nc1C(=O)NNC(=O)Cc2nc(sc2C)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	B22	compound treatment	0.756	-0.0326	-0.44	0.697	-0.049	-0.67	-0.7834	-0.9796	1969745	Cerep_004520	CCOc1ccsc1C(=O)NNC(=O)OCC2CCCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C03	compound treatment	0.792	0.00336	0.05	0.771	0.025	0.34	0.2735	0.7939	1969746	Cerep_004521	O=S(=O)(N1CCC1)c2cccc3nonc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C04	compound treatment	0.845	0.0564	0.76	0.771	0.025	0.34	0.7791	0.9348	1969747	Cerep_004522	CCCCC(NC(=O)C)C(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C05	compound treatment	0.82	0.0314	0.42	0.757	0.011	0.15	0.4056	0.9033	1969748	Cerep_004523	Cc1cc(c(C)cc1Cl)S(=O)(=O)N2CCN(CCO)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C06	compound treatment	0.825	0.0364	0.49	0.784	0.038	0.52	0.7137	0.9996	1969749	Cerep_004524	CC/1=C(CC(=O)N2CCN(C/C=C/c3ccccc3)CC2)c4cc(F)ccc4\C1=C/c5ccc(cc5)S(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C07	compound treatment	0.796	0.00736	0.1	0.758	0.012	0.16	0.1863	0.9709	1969750	Cerep_004525	NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2cccs2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C08	compound treatment	0.833	0.0444	0.6	0.799	0.053	0.72	0.9346	0.9956	1969751	Cerep_004526	CC(=O)NCCNC(=O)c1ccc(cc1)n2nc(cc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C09	compound treatment	0.791	0.00236	0.03	0.746	4.39E-5	0.0	0.0229	0.7203	1969752	Cerep_004527	COc1ccc(Cl)cc1S(=O)(=O)N2CCN(CC2)c3ncccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C10	compound treatment	0.81	0.0214	0.29	0.761	0.015	0.21	0.3488	0.9861	1969753	Cerep_004528	CC(C)(C)OC(=O)NC(CC(=O)N1CCN(C/C=C/c2ccccc2)CC1)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C11	compound treatment	0.793	0.00436	0.06	0.783	0.037	0.51	0.3988	0.7841	1969754	Cerep_004529	COc1ccc(OCCNS(=O)(=O)c2c(C)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C12	compound treatment	0.824	0.0354	0.48	0.768	0.022	0.3	0.5498	0.9752	1969755	Cerep_004530	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)N3CCC(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C13	compound treatment	0.78	-0.00864	-0.12	0.748	0.00204	0.03	-0.0627	-0.5233	1368970	Cerep_004531	COc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C14	compound treatment	0.79	0.00136	0.02	0.752	0.00604	0.08	0.0712	0.8436	1969756	Cerep_004532	CN(C)c1ccc(CN2CCC(C2)NC(=O)c3ccc(CSc4ccccn4)o3)c5ccccc15
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C15	compound treatment	0.77	-0.0186	-0.25	0.734	-0.012	-0.16	-0.2931	-0.978	1969757	Cerep_004533	CN(C1CCN(Cc2ccccc2C(F)(F)F)C1)S(=O)(=O)c3ccc(cc3)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C16	compound treatment	0.798	0.00936	0.13	0.788	0.042	0.57	0.4947	0.8426	1969758	Cerep_004534	NC(=O)CC(NC(=O)CCC(=O)Nc1ccc(Br)cn1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C17	compound treatment	0.799	0.0104	0.14	0.772	0.026	0.36	0.3499	0.9169	1969759	Cerep_004535	COc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C18	compound treatment	0.814	0.0254	0.34	0.782	0.036	0.49	0.5894	0.9843	1969760	Cerep_004536	CS(=O)(=O)c1ccccc1C(=O)NNC(=O)CCC(=O)Nc2ccc(Br)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C19	compound treatment	0.809	0.0204	0.27	0.755	0.00904	0.12	0.2814	0.9347	1969761	Cerep_004537	CCOC(=O)C1CCN(CC1)S(=O)(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C20	compound treatment	0.793	0.00436	0.06	0.755	0.00904	0.12	0.1288	0.9426	1969762	Cerep_004538	CN(C)CCCN(CCCN(C)C)C(=O)C1CCN(CC1)c2ccc(cn2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C21	compound treatment	0.789	3.57E-4	0.0	0.741	-0.00496	-0.07	-0.0444	-0.655	1969763	Cerep_004539	CCc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(F)c(Br)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	C22	compound treatment	0.795	0.00636	0.09	0.746	4.39E-5	0.0	0.0611	0.712	1969764	Cerep_004540	Clc1ccc(CCNC(=O)c2ccc3[nH]nnc3c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D03	compound treatment	0.844	0.0554	0.75	0.802	0.056	0.76	1.0685	0.9999	1969765	Cerep_004541	COc1ccc(Br)cc1CCNC(=O)c2cc(=O)n([nH]2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D04	compound treatment	0.8	0.0114	0.15	0.761	0.015	0.21	0.2534	0.9897	1969766	Cerep_004542	[O-][N+](=O)c1ccc(CCCCOC(=O)N2CCN(CC2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D05	compound treatment	0.808	0.0194	0.26	0.762	0.016	0.22	0.3394	0.9961	1969767	Cerep_004543	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)c3ccc(cc3)C(F)(F)F)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D06	compound treatment	0.776	-0.0126	-0.17	0.738	-0.00796	-0.11	-0.1973	-0.9761	1969768	Cerep_004544	CC(COC(=O)NCc1ccc(cc1)N(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D07	compound treatment	0.803	0.0144	0.19	0.773	0.027	0.37	0.3977	0.9548	1969769	Cerep_004545	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)N3CCC(O)(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D08	compound treatment	0.787	-0.00164	-0.02	0.734	-0.012	-0.16	-0.131	-0.7959	1969770	Cerep_004546	CCOc1ccsc1C(=O)NNC(=O)OCC23OC(C)(C)OC3C4OC(C)(C)OC4CO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D09	compound treatment	0.801	0.0124	0.17	0.729	-0.017	-0.23	-0.0456	-0.16	1969771	Cerep_004547	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)CCCCCNC(=O)OCc3ccccc3)c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D10	compound treatment	0.775	-0.0136	-0.18	0.732	-0.014	-0.19	-0.2647	-0.9999	1969772	Cerep_004548	FC(F)(F)c1ccc(cc1)N2CCN(CC2)C(=O)OCCN3CCN(CCCN4c5ccccc5Sc6ccc(cc46)C(F)(F)F)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D11	compound treatment	0.793	0.00436	0.06	0.74	-0.00596	-0.08	-0.0159	-0.1582	1969773	Cerep_004549	CCN(CC)CCC(=O)NNC(=O)c1cnn(c1C(F)(F)F)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D12	compound treatment	0.77	-0.0186	-0.25	0.705	-0.041	-0.56	-0.5728	-0.9351	1969774	Cerep_004550	COc1ccc(F)c(CN2CCCC(COC(=O)N3CCN(CC3)c4cc(OC)cc(OC)c4)C2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D13	compound treatment	0.794	0.00536	0.07	0.745	-9.56E-4	-0.01	0.0419	0.5703	1969775	Cerep_004551	COC(=O)C(NC(=O)CC1Cc2ccccc2C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D14	compound treatment	0.783	-0.00564	-0.08	0.709	-0.037	-0.5	-0.4102	-0.8048	1969776	Cerep_004552	CC(C)(C)OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D15	compound treatment	0.798	0.00936	0.13	0.736	-0.00996	-0.14	-0.0067	-0.0363	1969777	Cerep_004553	O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)c2ccc3nsnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D16	compound treatment	0.793	0.00436	0.06	0.72	-0.026	-0.35	-0.2087	-0.5817	1969778	Cerep_004554	CN(C)CCN1CCN(CC1)C(=O)OCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D17	compound treatment	0.802	0.0134	0.18	0.734	-0.012	-0.16	0.0121	0.0499	1969779	Cerep_004555	Fc1cc(CNC(=O)c2ccsc2)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D18	compound treatment	0.803	0.0144	0.19	0.735	-0.011	-0.15	0.0313	0.128	1969780	Cerep_004556	COc1ccc2[nH]cc(CCNC(=O)OCCCCc3ccc(cc3)[N+](=O)[O-])c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D19	compound treatment	0.79	0.00136	0.02	0.722	-0.024	-0.33	-0.218	-0.6664	1969781	Cerep_004557	CCc1ccc(cc1)c2ccc(cc2)C(=O)NNC(=O)c3c(C)noc3c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D20	compound treatment	0.766	-0.0226	-0.31	0.745	-9.56E-4	-0.01	-0.2252	-0.7366	1969782	Cerep_004558	CC(COC(=O)NCCc1ccc(O)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D21	compound treatment	0.797	0.00836	0.11	0.748	0.00204	0.03	0.0994	0.8561	1969783	Cerep_004559	O=C(NNC(=O)c1ccc2nsnc2c1)c3ccoc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	D22	compound treatment	0.778	-0.0106	-0.14	0.721	-0.025	-0.34	-0.3422	-0.9264	1969784	Cerep_004560	Cc1nc(sc1C(=O)NNC(=O)OCCC2=CCC3CC2C3(C)C)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E03	compound treatment	0.803	0.0144	0.19	0.778	0.032	0.44	0.4459	0.933	1969785	Cerep_004561	CN(C1CCN(Cc2ccc(cc2)c3ccccc3)C1)S(=O)(=O)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E04	compound treatment	0.831	0.0424	0.57	0.802	0.056	0.76	0.9445	0.9897	1969786	Cerep_004562	CC(OCc1ccccc1)C(NC(=O)c2cc(=O)n([nH]2)c3ccccc3)C(=O)OCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E05	compound treatment	0.817	0.0284	0.38	0.764	0.018	0.25	0.4445	0.9772	1969787	Cerep_004563	CN(C(=O)CN1CCN(CC1)S(=O)(=O)c2cc(C)c(Cl)cc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E06	compound treatment	0.809	0.0204	0.27	0.741	-0.00496	-0.07	0.1464	0.5177	1969788	Cerep_004564	FC(F)(F)Oc1ccccc1CNC(=O)c2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E07	compound treatment	0.809	0.0204	0.27	0.763	0.017	0.23	0.3585	0.9966	1969789	Cerep_004565	NC(=O)C(Cc1ccccc1)NS(=O)(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E08	compound treatment	0.834	0.0454	0.61	0.749	0.00304	0.04	0.462	0.7533	1969790	Cerep_004566	CC(C(=O)NNC(=O)c1ccc(cc1)n2nc(cc2C(C)(C)C)C(C)(C)C)n3nnc(n3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E09	compound treatment	0.787	-0.00164	-0.02	0.75	0.00404	0.06	0.0233	0.3924	1969791	Cerep_004567	COc1ccc(Cl)cc1S(=O)(=O)N2CCN(CC2)c3cc(Cl)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E10	compound treatment	0.78	-0.00864	-0.12	0.769	0.023	0.31	0.1398	0.417	1969792	Cerep_004568	O=C(CCN(Cc1ccco1)S(=O)(=O)c2cccc3nsnc23)NNC(=O)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E11	compound treatment	0.752	-0.0366	-0.49	0.728	-0.018	-0.24	-0.5227	-0.9475	1969793	Cerep_004569	Cc1cccc(Cl)c1S(=O)(=O)NCc2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E12	compound treatment	0.796	0.00736	0.1	0.77	0.024	0.33	0.302	0.8817	1969794	Cerep_004570	COc1cccc(CN2CCC(C2)NC(=O)CCn3cc(nc3C)[N+](=O)[O-])c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E13	compound treatment	0.789	3.57E-4	0.0	0.752	0.00604	0.08	0.0617	0.7472	1969795	Cerep_004571	Cc1ccc(N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3Cl)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E14	compound treatment	0.764	-0.0246	-0.33	0.724	-0.022	-0.3	-0.4468	-0.9986	1969796	Cerep_004572	COc1ccc(CCN(C)C(=O)c2ccc(s2)c3ccccn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E15	compound treatment	0.788	-6.43E-4	-0.01	0.744	-0.00196	-0.03	-0.025	-0.891	1969797	Cerep_004573	CCOc1ccccc1CN2CCC(C2)N(C)S(=O)(=O)c3ccc(cc3)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E16	compound treatment	0.787	-0.00164	-0.02	0.739	-0.00696	-0.09	-0.0827	-0.8494	1969798	Cerep_004574	CSc1sc(C(=O)NNC(=O)CCn2cc(nc2C)[N+](=O)[O-])c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E17	compound treatment	0.778	-0.0106	-0.14	0.728	-0.018	-0.24	-0.2747	-0.9676	1969799	Cerep_004575	COc1ccc(cc1)S(=O)(=O)N(C)C2CCN(Cc3cc4ccccc4o3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E18	compound treatment	0.799	0.0104	0.14	0.749	0.00304	0.04	0.1282	0.8792	1969800	Cerep_004576	COc1cccc(c1)C(=O)NNC(=O)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E19	compound treatment	0.784	-0.00464	-0.06	0.753	0.00704	0.1	0.0236	0.2061	1969801	Cerep_004577	Clc1cc(Cl)cc(c1)S(=O)(=O)NC2CCN(Cc3ccc4ccccc4c3)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E20	compound treatment	0.798	0.00936	0.13	0.757	0.011	0.15	0.1958	0.9962	1969802	Cerep_004578	COc1ccc(N2CCN(CC2)C(=O)Cc3nc(sc3C)c4ccccc4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E21	compound treatment	0.787	-0.00164	-0.02	0.755	0.00904	0.12	0.0715	0.5709	1969803	Cerep_004579	Fc1cccc(c1)S(=O)(=O)NCCc2ccc(OCc3ccccc3)c(OCc4ccccc4)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	E22	compound treatment	0.799	0.0104	0.14	0.757	0.011	0.15	0.2053	0.9993	1969804	Cerep_004580	CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(=O)NNC(=O)c3cc(nc4ccccc34)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F03	compound treatment	0.803	0.0144	0.19	0.764	0.018	0.25	0.3109	0.993	1969805	Cerep_004581	CC(C)C(NC(=O)CCC(=O)Nc1ccc(Br)cn1)C(=O)OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F04	compound treatment	0.768	-0.0206	-0.28	0.73	-0.016	-0.22	-0.3508	-0.9925	1969806	Cerep_004582	CCCCCC#CCOC(=O)N1CCN(CC1)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F05	compound treatment	0.823	0.0344	0.46	0.766	0.02	0.27	0.521	0.9683	1969807	Cerep_004583	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)CC(CC(=O)C3CC3)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F06	compound treatment	0.779	-0.00964	-0.13	0.756	0.01	0.14	0.0049	0.0257	1969808	Cerep_004584	Fc1ccc(/C=C/C(=O)NNC(=O)OCCc2cccc(Br)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F07	compound treatment	0.79	0.00136	0.02	0.756	0.01	0.14	0.1098	0.7946	1969809	Cerep_004585	O=C(N1CCC=CC1)c2ccc(s2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F08	compound treatment	0.784	-0.00464	-0.06	0.721	-0.025	-0.34	-0.2849	-0.8234	1969810	Cerep_004586	CC1(C)C2CC1C(=CC2)CCOC(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F09	compound treatment	0.775	-0.0136	-0.18	0.728	-0.018	-0.24	-0.3033	-0.9901	1969811	Cerep_004587	Cc1noc(c1C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5)c6ccc(cc6)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F10	compound treatment	0.79	0.00136	0.02	0.725	-0.021	-0.29	-0.1891	-0.6604	1969812	Cerep_004588	COc1ccc2ccccc2c1CN3CCCCC3COC(=O)N4CCN(CC4)c5sc(cc5[N+](=O)[O-])S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F11	compound treatment	0.788	-6.43E-4	-0.01	0.714	-0.032	-0.44	-0.3143	-0.721	1969813	Cerep_004589	CCc1ccc(cc1)c2ccc(cc2)C(=O)NNC(=O)c3sc(nc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F12	compound treatment	0.764	-0.0246	-0.33	0.708	-0.038	-0.52	-0.6011	-0.9771	1969814	Cerep_004590	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)c3ccc(O)cc3)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F13	compound treatment	0.81	0.0214	0.29	0.718	-0.028	-0.38	-0.0658	-0.1378	1969815	Cerep_004591	CC(C)C(NC(=O)c1ccc(NC(=O)C)cc1)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F14	compound treatment	0.756	-0.0326	-0.44	0.726	-0.02	-0.27	-0.5038	-0.9732	1969816	Cerep_004592	OC1(CCN(CC1)C(=O)OCc2ccc(F)cc2F)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F15	compound treatment	0.795	0.00636	0.09	0.756	0.01	0.14	0.1575	0.9746	1969817	Cerep_004593	CSc1sc(C(=O)NNC(=O)c2cc(=O)n([nH]2)c3ccccc3)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F16	compound treatment	0.798	0.00936	0.13	0.747	0.00104	0.01	0.0993	0.7819	1969818	Cerep_004594	Cc1cccc(CCOC(=O)NC(Cc2ccccc2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F17	compound treatment	0.776	-0.0126	-0.17	0.732	-0.014	-0.19	-0.2552	-0.9985	1969819	Cerep_004595	O=C(Nc1ccccc1C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5)c6cccs6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F18	compound treatment	0.779	-0.00964	-0.13	0.726	-0.02	-0.27	-0.2844	-0.9429	1969820	Cerep_004596	CCCCCC#CCOC(=O)NNC(=O)c1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F19	compound treatment	0.805	0.0164	0.22	0.736	-0.00996	-0.14	0.06	0.2317	1969821	Cerep_004597	CCC(C)C(=O)NCCOc1ccc(OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F20	compound treatment	0.779	-0.00964	-0.13	0.723	-0.023	-0.31	-0.3133	-0.9243	1969822	Cerep_004598	COc1cc(CCNC(=O)OCCc2cccc(Br)c2)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F21	compound treatment	0.79	0.00136	0.02	0.772	0.026	0.36	0.2641	0.7426	1969823	Cerep_004599	Clc1ccc(CCNC(=O)CCc2c[nH]c3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	F22	compound treatment	0.767	-0.0216	-0.29	0.714	-0.032	-0.44	-0.5146	-0.981	1969824	Cerep_004600	O=C(NNC(=O)c1cccnc1)OCC(Cc2ccccc2)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G03	compound treatment	0.794	0.00536	0.07	0.738	-0.00796	-0.11	-0.0256	-0.1965	1969825	Cerep_004601	FC(F)(F)c1cnc(N2CCN(CC2)S(=O)(=O)c3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G04	compound treatment	0.84	0.0514	0.69	0.773	0.027	0.37	0.7507	0.9564	1969826	Cerep_004602	CC1=NN(C(=O)C1)c2ccc(cc2)C(=O)NCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G05	compound treatment	0.792	0.00336	0.05	0.757	0.011	0.15	0.1385	0.8808	1969827	Cerep_004603	Cc1cc(c(C)cc1Cl)S(=O)(=O)N2CCN(CC2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G06	compound treatment	0.821	0.0324	0.44	0.743	-0.00296	-0.04	0.2802	0.6391	1969828	Cerep_004604	Fc1ccc(CC(=O)N2CCN(CC2)C(=O)CC(CC(=O)C3CC3)c4ccc(Br)cc4)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G07	compound treatment	0.794	0.00536	0.07	0.727	-0.019	-0.26	-0.1317	-0.4906	1969829	Cerep_004605	O=S(=O)(N1CCN(CCC2CCCCC2)CC1)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G08	compound treatment	0.797	0.00836	0.11	0.738	-0.00796	-0.11	0.003	0.0192	1969830	Cerep_004606	Cc1nc(cs1)c2c(C)onc2C(=O)NNC(=O)c3cn[nH]c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G09	compound treatment	0.797	0.00836	0.11	0.751	0.00504	0.07	0.1284	0.9719	1969831	Cerep_004607	COc1ccc(Cl)cc1S(=O)(=O)NCCSCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G10	compound treatment	0.771	-0.0176	-0.24	0.735	-0.011	-0.15	-0.2739	-0.9748	1969832	Cerep_004608	OCCN1CCN(CC1)C(=O)CCC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G11	compound treatment	0.782	-0.00664	-0.09	0.751	0.00504	0.07	-0.0147	-0.1304	1969833	Cerep_004609	Cc1cccc(Cl)c1S(=O)(=O)NC(Cc2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G12	compound treatment	0.801	0.0124	0.17	0.755	0.00904	0.12	0.2051	0.989	1969834	Cerep_004610	CN(C)CCCN(C)C(=O)C(CCC(=O)N)NC(=O)OCC1c2ccccc2-c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G13	compound treatment	0.763	-0.0256	-0.35	0.73	-0.016	-0.22	-0.3985	-0.975	1969835	Cerep_004611	COc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(F)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G14	compound treatment	0.796	0.00736	0.1	0.754	0.00804	0.11	0.1477	0.9988	1969836	Cerep_004612	CS(=O)(=O)NNC(=O)CCC(=O)c1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G15	compound treatment	0.78	-0.00864	-0.12	0.752	0.00604	0.08	-0.0242	-0.1693	1969837	Cerep_004613	CC(=O)c1ccc(cc1)S(=O)(=O)NCCCN2CCCC2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G16	compound treatment	0.782	-0.00664	-0.09	0.758	0.012	0.16	0.0528	0.282	1969838	Cerep_004614	O=C(CCC(=O)c1ccccc1)NNC(=O)c2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G17	compound treatment	0.792	0.00336	0.05	0.757	0.011	0.15	0.1385	0.8808	1969839	Cerep_004615	COc1ccc(cc1)S(=O)(=O)N(C)C2CCN(Cc3ccc(cc3)C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G18	compound treatment	0.818	0.0294	0.4	0.732	-0.014	-0.19	0.1455	0.3311	1969840	Cerep_004616	FC(F)(F)c1cccc(CCNC(=O)CCc2c[nH]c3ccccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G19	compound treatment	0.809	0.0204	0.27	0.762	0.016	0.22	0.3489	0.9937	1969841	Cerep_004617	Fc1cccc(F)c1S(=O)(=O)NCCc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G20	compound treatment	0.799	0.0104	0.14	0.747	0.00104	0.01	0.1089	0.7751	1969842	Cerep_004618	O=C(CNC(=O)c1cccnc1)NCC2CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G21	compound treatment	0.791	0.00236	0.03	0.759	0.013	0.18	0.1483	0.8205	1969843	Cerep_004619	CC1(C)C2CCC1(C)C(C2)NS(=O)(=O)c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	G22	compound treatment	0.781	-0.00764	-0.1	0.745	-9.56E-4	-0.01	-0.0821	-0.7902	1969844	Cerep_004620	Cc1sc(nc1CC(=O)NC2CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H03	compound treatment	0.79	0.00136	0.02	0.748	0.00204	0.03	0.0327	0.9792	1969845	Cerep_004621	[O-][N+](=O)c1ccc(cc1)n2ncc(C(=O)NNC(=O)C3CCCN3Sc4ncccc4[N+](=O)[O-])c2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H04	compound treatment	0.762	-0.0266	-0.36	0.737	-0.00896	-0.12	-0.3405	-0.897	1969846	Cerep_004622	CN(C)CC(C)(C)CNC(=O)OCC#Cc1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H05	compound treatment	0.822	0.0334	0.45	0.763	0.017	0.23	0.4826	0.9527	1969847	Cerep_004623	CSc1sc(C(=O)NNC(=O)Cc2nc(sc2C)c3ccc(Cl)cc3)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H06	compound treatment	0.751	-0.0376	-0.51	0.74	-0.00596	-0.08	-0.4165	-0.8099	1969848	Cerep_004624	CC(=CCC(COC(=O)NNC(=O)/C=C/c1ccc(F)cc1Cl)C(=C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H07	compound treatment	0.809	0.0204	0.27	0.764	0.018	0.25	0.3682	0.9985	1969849	Cerep_004625	FC(F)(F)c1ccc(nc1)N2CCC(CC2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H08	compound treatment	0.765	-0.0236	-0.32	0.695	-0.051	-0.69	-0.7169	-0.9376	1969850	Cerep_004626	O=C(NCCc1ccccn1)OCC(Cc2ccccc2)N(Cc3ccccc3)Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H09	compound treatment	0.8	0.0114	0.15	0.744	-0.00196	-0.03	0.0895	0.5753	1969851	Cerep_004627	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)c3ccccc3OC(F)(F)F)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H10	compound treatment	0.778	-0.0106	-0.14	0.734	-0.012	-0.16	-0.2168	-0.998	1969852	Cerep_004628	COc1ccc(OC)c(CN2CCCCC2COC(=O)N3CCN(CC3)c4sc(cc4[N+](=O)[O-])S(=O)(=O)N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H11	compound treatment	0.78	-0.00864	-0.12	0.751	0.00504	0.07	-0.0338	-0.2498	1969853	Cerep_004629	CCC(C)C(=O)NNC(=O)CCN(Cc1ccco1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H12	compound treatment	0.776	-0.0126	-0.17	0.706	-0.04	-0.54	-0.5059	-0.8861	1969854	Cerep_004630	FC(F)(F)c1ccc(CN2CCCCC2COC(=O)N3CCC(=CC3)n4c(=O)[nH]c5ccccc45)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H13	compound treatment	0.78	-0.00864	-0.12	0.743	-0.00296	-0.04	-0.1109	-0.8993	1969855	Cerep_004631	Cc1cc([nH]n1)C(=O)NNC(=O)C(C2CCCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H14	compound treatment	0.773	-0.0156	-0.21	0.736	-0.00996	-0.14	-0.2452	-0.9773	1969856	Cerep_004632	COc1ccc2ccccc2c1CN3CCN(CC3)C(=O)OCc4cccc(OC(F)(F)F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H15	compound treatment	0.782	-0.00664	-0.09	0.709	-0.037	-0.5	-0.4197	-0.82	1969857	Cerep_004633	NS(=O)(=O)c1ccc(CNC(=O)CCC(=O)Nc2ccc(Br)cn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H16	compound treatment	0.762	-0.0266	-0.36	0.723	-0.023	-0.31	-0.4755	-0.9976	1969858	Cerep_004634	Clc1ccc(cc1)C(=O)C2CCN(CC2)C(=O)OCCc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H17	compound treatment	0.786	-0.00264	-0.04	0.771	0.025	0.34	0.2163	0.6299	1969859	Cerep_004635	CC(NC(=O)C1CCN(CC1)c2ccc(cn2)C(F)(F)F)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H18	compound treatment	0.743	-0.0456	-0.62	0.726	-0.02	-0.27	-0.6278	-0.9326	1969860	Cerep_004636	O=C(NC1CCCCNC1=O)OCC#Cc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H19	compound treatment	0.795	0.00636	0.09	0.759	0.013	0.18	0.1864	0.944	1969861	Cerep_004637	CN(CCCNC(=O)C1CCN(CC1)c2ccc(cn2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H20	compound treatment	0.79	0.00136	0.02	0.728	-0.018	-0.24	-0.1602	-0.6524	1969862	Cerep_004638	CC(=CCC(COC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3ccccc3)C(=C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H21	compound treatment	0.794	0.00536	0.07	0.739	-0.00696	-0.09	-0.016	-0.1339	1969863	Cerep_004639	CSc1sc(C(=O)NNC(=O)c2ccc3[nH]nnc3c2)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	H22	compound treatment	0.774	-0.0146	-0.2	0.72	-0.026	-0.35	-0.39	-0.9621	1969864	Cerep_004640	FC(F)(F)c1ccc(SCCOC(=O)NNC(=O)c2ccc(cc2)c3ccccc3)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I03	compound treatment	0.799	0.0104	0.14	0.773	0.027	0.37	0.3596	0.9118	1969865	Cerep_004641	COC(=O)c1csc2c(cc(nc12)N3CCN(CC3)S(=O)(=O)c4ccccc4Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I04	compound treatment	0.759	-0.0296	-0.4	0.749	0.00304	0.04	-0.2534	-0.6303	1969866	Cerep_004642	CC(C(=O)NNC(=O)CCc1nc2ccccc2n1C)n3nnc(n3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I05	compound treatment	0.785	-0.00364	-0.05	0.74	-0.00596	-0.08	-0.0922	-0.971	1969867	Cerep_004643	Cc1cc(c(C)cc1Cl)S(=O)(=O)N2CCN(C/C=C/c3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I06	compound treatment	0.816	0.0274	0.37	0.767	0.021	0.29	0.4639	0.9923	1969868	Cerep_004644	Cc1nc(cs1)c2noc(n2)C(=O)NNC(=O)CC(c3ccccc3)(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I07	compound treatment	0.772	-0.0166	-0.22	0.748	0.00204	0.03	-0.1391	-0.6146	1969869	Cerep_004645	COc1cc(CN2CCN(CC2)S(=O)(=O)c3cccs3)cc4OCOc41
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I08	compound treatment	0.808	0.0194	0.26	0.739	-0.00696	-0.09	0.1176	0.4232	1969870	Cerep_004646	CSc1sc(C(=O)NNC(=O)CCCCCNC(=O)OCc2ccccc2)c3CCCC4(SCCS4)c13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I09	compound treatment	0.778	-0.0106	-0.14	0.753	0.00704	0.1	-0.0336	-0.1945	1969871	Cerep_004647	CC(NS(=O)(=O)c1cc(Br)ccc1Br)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I10	compound treatment	0.796	0.00736	0.1	0.738	-0.00796	-0.11	-0.0065	-0.0444	1969872	Cerep_004648	CC(NC(=O)c1ccc(C)cc1)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I11	compound treatment	0.768	-0.0206	-0.28	0.727	-0.019	-0.26	-0.3797	-0.9993	1969873	Cerep_004649	Cc1cccc(Cl)c1S(=O)(=O)NCCN2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I12	compound treatment	0.795	0.00636	0.09	0.764	0.018	0.25	0.2346	0.9004	1969874	Cerep_004650	CC(C)(C)OC(=O)C(NC(=O)c1ccoc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I13	compound treatment	0.768	-0.0206	-0.28	0.754	0.00804	0.11	-0.1194	-0.3988	1969875	Cerep_004651	Cc1ccc(F)cc1S(=O)(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I14	compound treatment	0.799	0.0104	0.14	0.748	0.00204	0.03	0.1185	0.8318	1969876	Cerep_004652	CC(C)(C)OC(=O)NC(CCCCNC(=O)c1cccnc1)C(=O)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I15	compound treatment	0.775	-0.0136	-0.18	0.727	-0.019	-0.26	-0.3129	-0.9861	1969877	Cerep_004653	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I16	compound treatment	0.758	-0.0306	-0.41	0.749	0.00304	0.04	-0.263	-0.6329	1969878	Cerep_004654	CC(C)(C)OC(=O)N1CCCC1C(=O)NNC(=O)c2ccco2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I17	compound treatment	0.8	0.0114	0.15	0.758	0.012	0.16	0.2245	0.9994	1969879	Cerep_004655	COc1ccc(cc1)S(=O)(=O)N(C)C2CCN(Cc3cc4OCOc4cc3Cl)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I18	compound treatment	0.798	0.00936	0.13	0.75	0.00404	0.06	0.1283	0.931	1969880	Cerep_004656	CCOC(=O)CC(=O)NNC(=O)c1ccc2[nH]nnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I19	compound treatment	0.755	-0.0336	-0.45	0.752	0.00604	0.08	-0.2627	-0.5694	1969881	Cerep_004657	CCN(CCNS(=O)(=O)c1c(F)cccc1F)c2cccc(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I20	compound treatment	0.773	-0.0156	-0.21	0.757	0.011	0.15	-0.0427	-0.1648	1969882	Cerep_004658	NC(=O)C1CCN(CC1)C(=O)c2csc(n2)c3cnccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I21	compound treatment	0.818	0.0294	0.4	0.763	0.017	0.23	0.4444	0.9677	1969883	Cerep_004659	CN(C1CCN(Cc2ccc(cc2)c3ccccc3)C1)S(=O)(=O)c4ccc(F)cc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	I22	compound treatment	0.806	0.0174	0.23	0.753	0.00704	0.1	0.2335	0.9226	1969884	Cerep_004660	O=C(NC1CCN(Cc2ccc(cc2)N3CCCC3)C1)c4ccc(CSc5ccccn5)o4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J03	compound treatment	0.847	0.0584	0.79	0.772	0.026	0.36	0.8078	0.9353	1969885	Cerep_004661	CCCCCCc1ccc(cc1)C(=O)NCc2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J04	compound treatment	0.792	0.00336	0.05	0.746	4.39E-5	0.0	0.0325	0.7164	1969886	Cerep_004662	COc1ccc(CC(=O)NNC(=O)OC/C=C/C#C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J05	compound treatment	0.773	-0.0156	-0.21	0.776	0.03	0.41	0.1405	0.3048	1969887	Cerep_004663	O=C(NNC(=O)c1cc(nc2ccccc12)c3ccccc3)c4ccoc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J06	compound treatment	0.761	-0.0276	-0.37	0.747	0.00104	0.01	-0.2536	-0.6796	1969888	Cerep_004664	CC1(C)C2CC1C(=CC2)COC(=O)N3CCC(O)(CC3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J07	compound treatment	0.797	0.00836	0.11	0.757	0.011	0.15	0.1862	0.9898	1969889	Cerep_004665	Cc1sc(nc1CC(=O)NCc2ccc(cc2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J08	compound treatment	0.798	0.00936	0.13	0.736	-0.00996	-0.14	-0.0067	-0.0363	1969890	Cerep_004666	Cc1cc(COC(=O)NNC(=O)c2sc(nc2C)c3ccc(cc3)C(F)(F)F)no1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J09	compound treatment	0.779	-0.00964	-0.13	0.74	-0.00596	-0.08	-0.1494	-0.9743	1969891	Cerep_004667	Cc1cc([nH]n1)C(=O)NNC(=O)c2ccccc2OC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J10	compound treatment	0.75	-0.0386	-0.52	0.711	-0.035	-0.48	-0.7057	-0.999	1969892	Cerep_004668	FC(F)(F)c1ccnc(c1)N2CCN(CC2)C(=O)OCC3CCCCN3Cc4ccc(OCC=C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J11	compound treatment	0.793	0.00436	0.06	0.747	0.00104	0.01	0.0516	0.8537	1969893	Cerep_004669	Cc1oc(nc1CC(=O)NCCc2c[nH]c3ccc(O)cc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J12	compound treatment	0.769	-0.0196	-0.26	0.735	-0.011	-0.15	-0.293	-0.9632	1969894	Cerep_004670	COc1ccc(CNC(=O)OCc2cccc(OCc3ccccc3)c2)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J13	compound treatment	0.764	-0.0246	-0.33	0.725	-0.021	-0.29	-0.4371	-0.9972	1969895	Cerep_004671	CC(O)CNC(=O)c1cc(nc2ccccc12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J14	compound treatment	0.793	0.00436	0.06	0.74	-0.00596	-0.08	-0.0159	-0.1582	1969896	Cerep_004672	[O-][N+](=O)c1ccc(COC(=O)C2CCCN2C(=O)OCc3ccc(c(F)c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J15	compound treatment	0.789	3.57E-4	0.0	0.74	-0.00596	-0.08	-0.054	-0.664	1969897	Cerep_004673	Cc1onc(c1C(=O)NNC(=O)Cc2nc(sc2C)c3ccccc3)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J16	compound treatment	0.758	-0.0306	-0.41	0.723	-0.023	-0.31	-0.5137	-0.9906	1969898	Cerep_004674	CC(CCOC(=O)NCCOc1ccccc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J17	compound treatment	0.785	-0.00364	-0.05	0.733	-0.013	-0.18	-0.1597	-0.8707	1969899	Cerep_004675	CCOC(=O)N1CCN(CC1)C(=O)CC2=C(C)/C(=C/c3ccc(cc3)S(=O)C)/c4ccc(F)cc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J18	compound treatment	0.762	-0.0266	-0.36	0.702	-0.044	-0.6	-0.678	-0.9701	1969900	Cerep_004676	CCCCCCC#CCCOC(=O)Nc1cc(ccc1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J19	compound treatment	0.814	0.0254	0.34	0.762	0.016	0.22	0.3966	0.9767	1969901	Cerep_004677	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J20	compound treatment	0.784	-0.00464	-0.06	0.694	-0.052	-0.71	-0.5453	-0.7666	1969902	Cerep_004678	Cc1ccccc1N2CCN(CC2)C(=O)OCCn3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J21	compound treatment	0.811	0.0224	0.3	0.761	0.015	0.21	0.3583	0.9824	1969903	Cerep_004679	Cc1sc(nc1CC(=O)NNC(=O)Cn2cnc(Cl)c2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	J22	compound treatment	0.75	-0.0386	-0.52	0.73	-0.016	-0.22	-0.5225	-0.9249	1969904	Cerep_004680	O=C(OCc1ccc(C#Cc2ccccc2)s1)N3CCN(CC3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K03	compound treatment	0.827	0.0384	0.52	0.756	0.01	0.14	0.4628	0.8645	1969905	Cerep_004681	CC(C)(C)c1cc2nc(cc(N3CCN(CC3)S(=O)(=O)c4ccccc4Cl)n2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K04	compound treatment	0.809	0.0204	0.27	0.764	0.018	0.25	0.3682	0.9985	1969906	Cerep_004682	CC(C)(C)OC(=O)NC(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)N1CCCN(CC1)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K05	compound treatment	0.766	-0.0226	-0.31	0.741	-0.00496	-0.07	-0.2638	-0.8432	1969907	Cerep_004683	Cc1cc(c(C)cc1Cl)S(=O)(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K06	compound treatment	0.782	-0.00664	-0.09	0.752	0.00604	0.08	-0.0051	-0.0418	1969908	Cerep_004684	Cc1csc(C(=O)NNC(=O)c2ccc(CSc3ccccn3)o2)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K07	compound treatment	0.755	-0.0336	-0.45	0.753	0.00704	0.1	-0.253	-0.5454	1969909	Cerep_004685	Brc1ccccc1CNS(=O)(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K08	compound treatment	0.79	0.00136	0.02	0.751	0.00504	0.07	0.0616	0.8652	1969910	Cerep_004686	Cc1csc(C(=O)NNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K09	compound treatment	0.764	-0.0246	-0.33	0.748	0.00204	0.03	-0.2154	-0.6456	1969911	Cerep_004687	Cc1ccc(C)c(c1)N2CCN(CC2)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K10	compound treatment	0.817	0.0284	0.38	0.782	0.036	0.49	0.6181	0.9923	1969912	Cerep_004688	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)C5CCN(CC5)C(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K11	compound treatment	0.772	-0.0166	-0.22	0.738	-0.00796	-0.11	-0.2355	-0.9443	1347199	Cerep_004689	COc1ccc(cc1OC)S(=O)(=O)N(CCC#N)CC2CCCO2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K12	compound treatment	0.802	0.0134	0.18	0.757	0.011	0.15	0.2339	0.996	1969913	Cerep_004690	CCn1c2ccccc2c3cc(CN4CCN(CC4)C(=O)CCCCNC(=O)OC(C)(C)C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K13	compound treatment	0.754	-0.0346	-0.47	0.733	-0.013	-0.18	-0.4554	-0.9115	1969914	Cerep_004691	Cc1ccc(F)cc1S(=O)(=O)N2CCN(CC2)c3ncccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K14	compound treatment	0.779	-0.00964	-0.13	0.732	-0.014	-0.19	-0.2266	-0.9828	1969915	Cerep_004692	O=C(NCc1cccnc1)c2ccoc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K15	compound treatment	0.77	-0.0186	-0.25	0.773	0.027	0.37	0.0829	0.1858	1969916	Cerep_004693	CN(C)CC(C)(C)CNS(=O)(=O)c1ccc(cc1)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K16	compound treatment	0.789	3.57E-4	0.0	0.762	0.016	0.22	0.1581	0.7225	1969917	Cerep_004694	COC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])NC(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K17	compound treatment	0.78	-0.00864	-0.12	0.742	-0.00396	-0.05	-0.1206	-0.9387	1969918	Cerep_004695	COc1ccc(cc1)S(=O)(=O)N2CCC(=CC2)n3c(=O)[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K18	compound treatment	0.812	0.0234	0.32	0.751	0.00504	0.07	0.2714	0.8416	1969919	Cerep_004696	Cc1sc(nc1CC(=O)NNC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K19	compound treatment	0.805	0.0164	0.22	0.762	0.016	0.22	0.3107	1.0	1969920	Cerep_004697	Fc1cccc(F)c1S(=O)(=O)NCCc2ccncc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K20	compound treatment	0.794	0.00536	0.07	0.764	0.018	0.25	0.2251	0.8777	1969921	Cerep_004698	CCCCCCc1ccc(cc1)C(=O)NNC(=O)Cn2cnc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K21	compound treatment	0.784	-0.00464	-0.06	0.75	0.00404	0.06	-0.0053	-0.0634	1201895	Cerep_004699	COc1cccc(c1)C(C)NS(=O)(=O)c2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	K22	compound treatment	0.78	-0.00864	-0.12	0.744	-0.00196	-0.03	-0.1013	-0.847	1969922	Cerep_004700	COc1cccc(CN(Cc2ccco2)C(=O)CCc3nc4ccccc4n3C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L03	compound treatment	0.813	0.0244	0.33	0.746	4.39E-5	0.0	0.2328	0.7084	1969923	Cerep_004701	O=C(CCCCCNC(=O)OCc1ccccc1)NNC(=O)c2ccccc2NC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L04	compound treatment	0.769	-0.0196	-0.26	0.721	-0.025	-0.34	-0.428	-0.9923	1969924	Cerep_004702	Cc1csc2c(SCC(=O)NNC(=O)OC/C=C/COCc3ccccc3)ncnc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L05	compound treatment	0.799	0.0104	0.14	0.732	-0.014	-0.19	-0.0358	-0.1515	1969925	Cerep_004703	O=C(CCc1c[nH]c2ccccc12)N3CCN(CC3)C(c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L06	compound treatment	0.766	-0.0226	-0.31	0.732	-0.014	-0.19	-0.3506	-0.9741	1969926	Cerep_004704	FC(F)(F)c1ccccc1CCOC(=O)NNC(=O)CNS(=O)(=O)c2cccc3nsnc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L07	compound treatment	0.79	0.00136	0.02	0.751	0.00504	0.07	0.0616	0.8652	1969927	Cerep_004705	CC(C)C(NC(=O)c1ccc(CSc2ccccn2)o1)C(=O)Nc3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L08	compound treatment	0.762	-0.0266	-0.36	0.712	-0.034	-0.46	-0.5816	-0.9922	1969928	Cerep_004706	O=C(NCCc1c[nH]cn1)OCc2ccc(C#Cc3ccccc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L09	compound treatment	0.827	0.0384	0.52	0.77	0.024	0.33	0.5977	0.9758	1969929	Cerep_004707	CCOC(=O)CNC(=O)c1cc(OC)cc(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L10	compound treatment	0.774	-0.0146	-0.2	0.726	-0.02	-0.27	-0.3321	-0.9876	1969930	Cerep_004708	COc1cc(CN2CCN(CCOC(=O)N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-])CC2)cc5OCOc51
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L11	compound treatment	0.791	0.00236	0.03	0.739	-0.00696	-0.09	-0.0446	-0.4457	1969931	Cerep_004709	COc1ccc(C(=O)NNC(=O)c2sc(SC)c3c2CCCC43SCCS4)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L12	compound treatment	0.786	-0.00264	-0.04	0.745	-9.56E-4	-0.01	-0.0344	-0.907	1969932	Cerep_004710	Oc1ccc2[nH]cc(CCNC(=O)OCc3ccc(cc3)c4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L13	compound treatment	0.806	0.0174	0.23	0.739	-0.00696	-0.09	0.0985	0.3899	1969933	Cerep_004711	CC(C)(C)OC(=O)NCCC(=O)N1CCC(CC1)C(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L14	compound treatment	0.777	-0.0116	-0.16	0.734	-0.012	-0.16	-0.2263	-0.9998	1969934	Cerep_004712	COc1ccc(cc1F)C(=O)N2CCN(CC2)C(=O)OCCn3nc(cc3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L15	compound treatment	0.798	0.00936	0.13	0.741	-0.00496	-0.07	0.0415	0.2896	1965433	Cerep_004713	Cc1nn(Cc2nnn(CC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)c(C)c1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L16	compound treatment	0.768	-0.0206	-0.28	0.739	-0.00696	-0.09	-0.264	-0.8973	1969935	Cerep_004714	O=C(NC1CCCC1OCc2ccccc2)OCCCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L17	compound treatment	0.788	-6.43E-4	-0.01	0.752	0.00604	0.08	0.0521	0.6293	1969936	Cerep_004715	COc1cc(OC)cc(c1)C(=O)NCc2cccc(C)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L18	compound treatment	0.75	-0.0386	-0.52	0.724	-0.022	-0.3	-0.5803	-0.9653	1969937	Cerep_004716	Cc1ccccc1N2CCN(CC2)C(=O)OC/C=C/COCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L19	compound treatment	0.828	0.0394	0.53	0.752	0.00604	0.08	0.4337	0.8072	1969938	Cerep_004717	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NCCc3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L20	compound treatment	0.758	-0.0306	-0.41	0.737	-0.00896	-0.12	-0.3787	-0.8785	1969939	Cerep_004718	CC1(C)C2CC1C(=CC2)COC(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L21	compound treatment	0.802	0.0134	0.18	0.743	-0.00296	-0.04	0.0989	0.5357	1969940	Cerep_004719	Fc1cc(CNC(=O)CNC(=O)c2cccnc2)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	L22	compound treatment	0.776	-0.0126	-0.17	0.731	-0.015	-0.2	-0.2648	-0.996	1969941	Cerep_004720	O=C(NNC(=O)c1ccccc1n2cccc2)OCc3nccn3Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M03	compound treatment	0.787	-0.00164	-0.02	0.762	0.016	0.22	0.139	0.6322	1969942	Cerep_004721	Clc1ccccc1S(=O)(=O)N2CCN(CC2)c3nccnc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M04	compound treatment	0.818	0.0294	0.4	0.77	0.024	0.33	0.5119	0.9956	1969943	Cerep_004722	O=C(CCCCCNC(=O)OCc1ccccc1)NCCc2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M05	compound treatment	0.791	0.00236	0.03	0.757	0.011	0.15	0.129	0.8379	1969944	Cerep_004723	Cc1cc(c(C)cc1Cl)S(=O)(=O)NCCCN2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M06	compound treatment	0.784	-0.00464	-0.06	0.754	0.00804	0.11	0.0333	0.2634	1969945	Cerep_004724	Cc1onc(C(=O)NNC(=O)CCc2nc3ccccc3n2C)c1c4csc(n4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M07	compound treatment	0.789	3.57E-4	0.0	0.757	0.011	0.15	0.1099	0.7294	1969946	Cerep_004725	FC(F)(F)c1cc(cc(c1)S(=O)(=O)NCC2(CC3CC4CC(C3)C2)C4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M08	compound treatment	0.796	0.00736	0.1	0.777	0.031	0.42	0.3695	0.8499	1969947	Cerep_004726	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)Cc3csc4nc(nn34)c5ccccc5)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M09	compound treatment	0.77	-0.0186	-0.25	0.72	-0.026	-0.35	-0.4281	-0.986	1969948	Cerep_004727	CC1CN(CCN1c2cccc(C)c2)S(=O)(=O)c3cc(Br)ccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M10	compound treatment	0.795	0.00636	0.09	0.746	4.39E-5	0.0	0.0611	0.712	1969949	Cerep_004728	CC(CNC(=O)c1cc(C)n(C)n1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M11	compound treatment	0.781	-0.00764	-0.1	0.751	0.00504	0.07	-0.0243	-0.1958	1969950	Cerep_004729	Clc1cccc(c1Cl)S(=O)(=O)NCCC(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M12	compound treatment	0.778	-0.0106	-0.14	0.747	0.00104	0.01	-0.0915	-0.6339	1969951	Cerep_004730	CCOC(=O)NNC(=O)c1ccc2[nH]nnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M13	compound treatment	0.749	-0.0396	-0.53	0.746	4.39E-5	0.0	-0.3777	-0.7063	1969952	Cerep_004731	Cc1ccc(Cl)cc1N2CCN(CC2)S(=O)(=O)c3cc(F)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M14	compound treatment	0.804	0.0154	0.21	0.758	0.012	0.16	0.2626	0.9934	1969953	Cerep_004732	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)CCCCNC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M15	compound treatment	0.742	-0.0466	-0.63	0.733	-0.013	-0.18	-0.5699	-0.8719	1969954	Cerep_004733	COc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(cc3)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M16	compound treatment	0.804	0.0154	0.21	0.737	-0.00896	-0.12	0.0601	0.2501	1969955	Cerep_004734	CSc1sc(C(=O)NNC(=O)C2CC(C)C3CCCC23)c4CCCC5(SCCS5)c14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M17	compound treatment	0.794	0.00536	0.07	0.752	0.00604	0.08	0.1094	0.9979	1969956	Cerep_004735	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)Cc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M18	compound treatment	0.78	-0.00864	-0.12	0.734	-0.012	-0.16	-0.1977	-0.9865	1969957	Cerep_004736	CSCCC(CO)NC(=O)CNC(=O)c1cccnc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M19	compound treatment	0.795	0.00636	0.09	0.781	0.035	0.48	0.3986	0.8209	1969958	Cerep_004737	OC1(CCN(CC1)S(=O)(=O)c2c(F)cccc2F)c3ccc(Cl)c(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M20	compound treatment	0.807	0.0184	0.25	0.756	0.01	0.14	0.272	0.961	1969959	Cerep_004738	[O-][N+](=O)c1ccc(NC(=O)C(Cc2ccccc2)NC(=O)c3ccsc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M21	compound treatment	0.801	0.0124	0.17	0.77	0.024	0.33	0.3497	0.9508	1969960	Cerep_004739	Fc1ccc(c(F)c1)S(=O)(=O)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	M22	compound treatment	0.798	0.00936	0.13	0.764	0.018	0.25	0.2632	0.9519	1969961	Cerep_004740	CCCCCCc1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(OC)cc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N03	compound treatment	0.823	0.0344	0.46	0.756	0.01	0.14	0.4246	0.8785	1969962	Cerep_004741	O=C(Nc1ccc2ccccc2c1)C(Cc3c[nH]c4ccccc34)NC(=O)c5ccc(cc5)n6nc(cc6c7ccccc7)c8ccccc8
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N04	compound treatment	0.784	-0.00464	-0.06	0.738	-0.00796	-0.11	-0.121	-0.9659	1969963	Cerep_004742	Cc1csc(C(=O)NNC(=O)OCCc2cccc(F)c2)c1n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N05	compound treatment	0.802	0.0134	0.18	0.759	0.013	0.18	0.2532	1.0	1969964	Cerep_004743	O=C(NCCN1CCOCC1)c2ccc3[nH]nnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N06	compound treatment	0.789	3.57E-4	0.0	0.745	-9.56E-4	-0.01	-0.0058	-0.418	1969965	Cerep_004744	CCC(COC(=O)NNC(=O)c1ccc(cc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N07	compound treatment	0.76	-0.0286	-0.39	0.779	0.033	0.45	0.0454	0.0765	1969966	Cerep_004745	Cn1c(CCC(=O)NNC(=O)c2ccccc2OC(F)(F)F)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N08	compound treatment	0.723	-0.0656	-0.89	0.722	-0.024	-0.33	-0.8572	-0.9081	1969967	Cerep_004746	O=C(OCc1nccn1Cc2ccccc2)N3CCc4c(C3)[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N09	compound treatment	0.751	-0.0376	-0.51	0.702	-0.044	-0.6	-0.7829	-0.9966	1969968	Cerep_004747	Cc1cc(no1)c2onc(C)c2C(=O)NNC(=O)CCCCC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N10	compound treatment	0.761	-0.0276	-0.37	0.693	-0.053	-0.72	-0.7743	-0.9527	1969969	Cerep_004748	COc1cccc(CN2CCN(CCOC(=O)N3CCN(CC3)c4cccc5[nH]ccc45)CC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N11	compound treatment	0.797	0.00836	0.11	0.744	-0.00196	-0.03	0.0609	0.5253	1969970	Cerep_004749	CCc1ccc(cc1)c2ccc(cc2)C(=O)N3CCN(CC3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N12	compound treatment	0.781	-0.00764	-0.1	0.735	-0.011	-0.15	-0.1785	-0.9836	1969971	Cerep_004750	Fc1cccc(Cl)c1COC(=O)N2CCN(CC2)c3ncnc4sccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N13	compound treatment	0.811	0.0224	0.3	0.716	-0.03	-0.41	-0.0756	-0.1488	1969972	Cerep_004751	Cc1ccc(cc1)C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N14	compound treatment	0.819	0.0304	0.41	0.75	0.00404	0.06	0.3286	0.7951	1969973	Cerep_004752	COc1cc(Cl)c(COC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N15	compound treatment	0.742	-0.0466	-0.63	0.745	-9.56E-4	-0.01	-0.4542	-0.7216	1969974	Cerep_004753	Clc1ncn(Cc2ccc(o2)C(=O)NNC(=O)c3csc(n3)c4cnccn4)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N16	compound treatment	0.799	0.0104	0.14	0.743	-0.00296	-0.04	0.0703	0.4834	1969975	Cerep_004754	COc1ccc(CCCOC(=O)NCCc2cccc(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N17	compound treatment	0.812	0.0234	0.32	0.735	-0.011	-0.15	0.1172	0.336	1969976	Cerep_004755	CC(=CC1C(CNC(=O)CC(CC(=O)C2CC2)c3ccc(Br)cc3)C1(C)C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N18	compound treatment	0.775	-0.0136	-0.18	0.724	-0.022	-0.3	-0.3419	-0.9727	1969977	Cerep_004756	CN(CCCN1c2ccccc2CCc3ccccc13)C(=O)OCCc4cccc(F)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N19	compound treatment	0.759	-0.0296	-0.4	0.709	-0.037	-0.5	-0.6391	-0.9934	1969978	Cerep_004757	CCCCCCc1ccc(cc1)C(=O)NNC(=O)Cc2csc3nc(nn23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N20	compound treatment	0.77	-0.0186	-0.25	0.732	-0.014	-0.19	-0.3124	-0.9905	1969979	Cerep_004758	OC(C1CCN(CC1)C(=O)OCC2CCCCCC2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N21	compound treatment	0.836	0.0474	0.64	0.807	0.061	0.83	1.0404	0.9915	1969980	Cerep_004759	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c3sccc3NC(=O)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	N22	compound treatment	0.749	-0.0396	-0.53	0.718	-0.028	-0.38	-0.6477	-0.9862	1969981	Cerep_004760	COc1cc(Br)c(CN2CCCC(COC(=O)NNC(=O)c3ccccc3C)C2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O03	compound treatment	0.788	-6.43E-4	-0.01	0.751	0.00504	0.07	0.0425	0.6131	1969982	Cerep_004761	COc1cc(OC)cc(c1)N2CCN(CC2)S(=O)(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O04	compound treatment	0.791	0.00236	0.03	0.79	0.044	0.6	0.4472	0.7435	1969983	Cerep_004762	NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(cc2)n3nc(cc3c4ccccc4)c5ccccc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O05	compound treatment	0.792	0.00336	0.05	0.759	0.013	0.18	0.1578	0.8597	1969984	Cerep_004763	OC1(CNS(=O)(=O)c2ccc(Cl)cc2)CCCCC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O06	compound treatment	0.794	0.00536	0.07	0.773	0.027	0.37	0.3119	0.8299	1969985	Cerep_004764	CC(N1CCN(CC1)C(=O)C(CCCN(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O07	compound treatment	0.765	-0.0236	-0.32	0.761	0.015	0.21	-0.0805	-0.2122	1245741	Cerep_004765	COc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(Cl)ccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O08	compound treatment	0.81	0.0214	0.29	0.771	0.025	0.34	0.4452	0.9964	1969986	Cerep_004766	COC(=O)CCCC(=O)NNC(=O)c1cnn(c1C(F)(F)F)c2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O09	compound treatment	0.87	0.0814	1.1	0.799	0.053	0.72	1.2876	0.9795	1969987	Cerep_004767	Cc1ccc2nc(cc(N3CCN(CC3)S(=O)(=O)c4c(C)cccc4Cl)c2c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O10	compound treatment	0.782	-0.00664	-0.09	0.734	-0.012	-0.16	-0.1787	-0.9603	1969988	Cerep_004768	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)c5ccccc5COC(=O)c6ccccc6)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O11	compound treatment	0.785	-0.00364	-0.05	0.754	0.00804	0.11	0.0428	0.3562	1969989	Cerep_004769	FC(F)(F)Oc1ccccc1S(=O)(=O)N2CCN(CC2)c3nc(ns3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O12	compound treatment	0.801	0.0124	0.17	0.762	0.016	0.22	0.2726	0.991	1969990	Cerep_004770	CN1CCN(CCCNC(=O)C2Cc3ccccc3CN2C(=O)OC(C)(C)C)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O13	compound treatment	0.763	-0.0256	-0.35	0.742	-0.00396	-0.05	-0.2828	-0.8076	1969991	Cerep_004771	CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CCN3CCOCC3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O14	compound treatment	0.795	0.00636	0.09	0.773	0.027	0.37	0.3214	0.8489	1969992	Cerep_004772	COC(=O)C(Cc1ccccc1)NC(=O)c2ccccc2COC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O15	compound treatment	0.811	0.0224	0.3	0.769	0.023	0.31	0.4355	0.9998	1969993	Cerep_004773	COc1ccc(cc1)S(=O)(=O)NCC2COc3ccccc3O2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O16	compound treatment	0.794	0.00536	0.07	0.742	-0.00396	-0.05	0.013	0.1437	1969994	Cerep_004774	COC(=O)C(Cc1ccc(Cl)cc1)NC(=O)c2ccccc2COC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O17	compound treatment	0.772	-0.0166	-0.22	0.751	0.00504	0.07	-0.1101	-0.469	1969995	Cerep_004775	CN1CCCC1CCNS(=O)(=O)c2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O18	compound treatment	0.784	-0.00464	-0.06	0.753	0.00704	0.1	0.0236	0.2061	1969996	Cerep_004776	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)N3CCN(CC3)c4cnccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O19	compound treatment	0.771	-0.0176	-0.24	0.731	-0.015	-0.2	-0.3125	-0.997	1969997	Cerep_004777	CCC(C)(C)c1ccc(cc1)S(=O)(=O)NCC2(CC3CC4CC(C3)C2)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O20	compound treatment	0.773	-0.0156	-0.21	0.756	0.01	0.14	-0.0524	-0.2082	1969998	Cerep_004778	O=C(NCCc1ccc(Oc2ccccc2)cc1)c3ccc(cc3)n4nc(cc4c5ccccc5)c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O21	compound treatment	0.795	0.00636	0.09	0.776	0.03	0.41	0.3503	0.837	1369628	Cerep_004779	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCCC2=CCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	O22	compound treatment	0.799	0.0104	0.14	0.746	4.39E-5	0.0	0.0992	0.7101	1969999	Cerep_004780	CC(C)C(NC(=O)Cc1c[nH]c2ccccc12)C(=O)NCCc3ccc(cc3)S(=O)(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P03	compound treatment	0.784	-0.00464	-0.06	0.751	0.00504	0.07	0.0043	0.0467	1970000	Cerep_004781	CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NNC(=O)Cc3ccsc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P04	compound treatment	0.763	-0.0256	-0.35	0.74	-0.00596	-0.08	-0.302	-0.85	1970001	Cerep_004782	COc1ccc(CC(=O)NNC(=O)OCC2CCC3CC2C3(C)C)c(OC)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P05	compound treatment	0.778	-0.0106	-0.14	0.751	0.00504	0.07	-0.0529	-0.3322	1970002	Cerep_004783	Cc1sc(nc1CC(=O)N2CCN(CC2)c3c(C)cccc3C)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P06	compound treatment	0.758	-0.0306	-0.41	0.736	-0.00996	-0.14	-0.3883	-0.8924	1970003	Cerep_004784	OC(C1CCN(CC1)C(=O)OCC2CCCCO2)(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P07	compound treatment	0.762	-0.0266	-0.36	0.729	-0.017	-0.23	-0.4177	-0.9772	1970004	Cerep_004785	CCCCCCc1ccc(cc1)C(=O)NNC(=O)c2csc(CS(=O)(=O)Cc3ccco3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P08	compound treatment	0.765	-0.0236	-0.32	0.729	-0.017	-0.23	-0.389	-0.9875	1970005	Cerep_004786	Clc1ccc(cc1)c2csc(COC(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P09	compound treatment	0.692	-0.0966	-1.3	0.693	-0.053	-0.72	-1.4325	-0.9612	1970006	Cerep_004787	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)NCc3c(OC)cccc3OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P10	compound treatment	0.045	-0.744	-10.03	0.114	-0.632	-8.62	-13.1874	-0.9971	1970007	Cerep_004788	CC(C)(C)OC(=O)N1CCCC1COC(=O)N2CCN(CC2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P11	compound treatment	0.761	-0.0276	-0.37	0.743	-0.00296	-0.04	-0.2922	-0.779	1970008	Cerep_004789	CCC(C)C(=O)NCc1cc(OC)ccc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P12	compound treatment	0.749	-0.0396	-0.53	0.731	-0.015	-0.2	-0.5224	-0.9127	1970009	Cerep_004790	CCn1c2ccccc2c3cc(CN4CCC(C4)NC(=O)OCc5ccc(C)cc5C)ccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P13	compound treatment	0.769	-0.0196	-0.26	0.746	4.39E-5	0.0	-0.187	-0.7055	1970010	Cerep_004791	O=C(CC1Cc2ccccc2C1)NCc3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P14	compound treatment	0.769	-0.0196	-0.26	0.725	-0.021	-0.29	-0.3894	-0.9993	1970011	Cerep_004792	Fc1ccccc1CCOC(=O)NNC(=O)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P15	compound treatment	0.778	-0.0106	-0.14	0.718	-0.028	-0.38	-0.3711	-0.911	1970012	Cerep_004793	CCCCCCc1ccc(cc1)C(=O)NC2CCN(Cc3c(OC)cc(OC)cc3OC)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P16	compound treatment	0.762	-0.0266	-0.36	0.725	-0.021	-0.29	-0.4562	-0.9935	1970013	Cerep_004794	CC(C)(C)c1ccc(O)c(NC(=O)OCCCCCc2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P17	compound treatment	0.781	-0.00764	-0.1	0.741	-0.00496	-0.07	-0.1207	-0.979	1970014	Cerep_004795	COC(=O)CCc1c(C)nn(c1C)c2ccc(cc2)C(=O)N3CCN(CC3)c4nccnc4C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P18	compound treatment	0.75	-0.0386	-0.52	0.703	-0.043	-0.59	-0.7828	-0.9983	1970015	Cerep_004796	CC1(C)C2CC1C(COC(=O)NNC(=O)/C=C/c3ccc(F)cc3Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P19	compound treatment	0.771	-0.0176	-0.24	0.741	-0.00496	-0.07	-0.2161	-0.8734	1970016	Cerep_004797	Fc1ccc(cc1)C(CCCN2CCN(CC2)C(=O)CNC(=O)c3cccnc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P20	compound treatment	0.769	-0.0196	-0.26	0.713	-0.033	-0.45	-0.5052	-0.9683	1970017	Cerep_004798	CCC(COC(=O)N1CCC2(CC1)N(CNC2=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P21	compound treatment	0.763	-0.0256	-0.35	0.734	-0.012	-0.16	-0.3599	-0.9411	1970018	Cerep_004799	OCCOCCNC(=O)c1ccc(s1)c2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.540	P22	compound treatment	0.745	-0.0436	-0.59	0.742	-0.00396	-0.05	-0.4545	-0.7687	1970019	Cerep_004800	CN(CCOC(=O)NNC(=O)c1ccc(cc1)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A03	compound treatment	1.058	-0.00901	-0.12	1.269	-0.0155	-0.21	-0.235	-0.9658	1713246	Bionet1_000401	Clc1ccc(Oc2ccc(c3ccnn3c4ccccc4)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A04	compound treatment	1.109	0.042	0.57	1.354	0.0695	0.95	1.0711	0.9697	1908051	Bionet1_000402	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A05	compound treatment	1.035	-0.032	-0.43	1.304	0.0195	0.27	-0.1169	-0.2303	1333379	Bionet1_000403	Clc1cccc(Cl)c1Cn2cccc(NC(=O)c3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A06	compound treatment	1.041	-0.026	-0.35	1.303	0.0185	0.25	-0.0693	-0.1602	1908052	Bionet1_000404	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A07	compound treatment	1.034	-0.033	-0.45	1.23	-0.0545	-0.74	-0.84	-0.9701	1645116	Bionet1_000405	CC(C)(C)C(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A08	compound treatment	1.079	0.012	0.16	1.333	0.0485	0.66	0.5825	0.8547	1908053	Bionet1_000406	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A09	compound treatment	1.027	-0.04	-0.54	1.209	-0.0755	-1.03	-1.1092	-0.9547	1908054	Bionet1_000407	FC(F)(F)C(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A10	compound treatment	1.082	0.015	0.2	1.257	-0.0275	-0.37	-0.1217	-0.2861	1908055	Bionet1_000408	COc1ccc(NC(=O)c2ccc(OS(=O)(=O)N(C)C)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A11	compound treatment	1.065	-0.00201	-0.03	1.246	-0.0385	-0.52	-0.39	-0.7427	1185767	Bionet1_000409	Cc1ccc(cc1)C(=O)Nc2cccn(Cc3c(Cl)cccc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A12	compound treatment	1.099	0.032	0.43	1.313	0.0285	0.39	0.5804	0.9987	1908056	Bionet1_000410	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A13	compound treatment	1.006	-0.061	-0.82	1.266	-0.0185	-0.25	-0.7599	-0.883	1563361	Bionet1_000411	CCCCC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A14	compound treatment	1.053	-0.014	-0.19	1.327	0.0425	0.58	0.2766	0.4533	1908057	Bionet1_000412	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A15	compound treatment	1.037	-0.03	-0.4	1.281	-0.00345	-0.05	-0.3196	-0.7841	1525668	Bionet1_000413	CC(C)CC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A16	compound treatment	1.064	-0.00301	-0.04	1.322	0.0375	0.51	0.3333	0.649	1908058	Bionet1_000414	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A17	compound treatment	1.057	-0.01	-0.14	1.32	0.0355	0.48	0.2473	0.4914	1273797	Bionet1_000415	CCN(CC)C(=O)c1cc(Cl)cn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A18	compound treatment	1.113	0.046	0.62	1.353	0.0685	0.93	1.0997	0.9802	1908059	Bionet1_000416	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A19	compound treatment	1.057	-0.01	-0.14	1.242	-0.0425	-0.58	-0.5048	-0.8492	1221672	Bionet1_000417	CN(C)CCNC(=O)c1cc(Cl)cn(Cc2ccc(Cl)cc2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A20	compound treatment	1.076	0.00899	0.12	1.289	0.00455	0.06	0.1296	0.9514	1908060	Bionet1_000418	COc1ccc(NC(=O)c2ccccc2OS(=O)(=O)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A21	compound treatment	1.117	0.05	0.67	1.274	-0.0105	-0.14	0.3761	0.5456	1691757	Bionet1_000419	Clc1ccc(NC(=O)c2cn(c3ccccc3)c(=O)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	A22	compound treatment	1.062	-0.00501	-0.07	1.265	-0.0195	-0.27	-0.2354	-0.8598	1908061	Bionet1_000420	Clc1ccc(CO/N=C\NC(=S)Nc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B03	compound treatment	1.069	0.00199	0.03	1.233	-0.0515	-0.7	-0.4772	-0.6795	1908062	Bionet1_000421	Clc1ccc(COn2c(nc3ccccc23)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B04	compound treatment	1.007	-0.06	-0.81	1.286	0.00155	0.02	-0.5575	-0.6885	1602414	Bionet1_000422	Fc1ccccc1c2nnc3c4ccccc4nc(Oc5ccccc5)n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B05	compound treatment	1.093	0.026	0.35	1.241	-0.0435	-0.59	-0.1711	-0.2485	1908063	Bionet1_000423	Fc1cccc(Cl)c1COn2c(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B06	compound treatment	1.05	-0.017	-0.23	1.259	-0.0255	-0.35	-0.4077	-0.9798	1908064	Bionet1_000424	Cc1cc(C)cc(COn2c(nc3ncccc23)c4ccc(Cl)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B07	compound treatment	1.089	0.022	0.3	1.305	0.0205	0.28	0.4079	0.9996	1908065	Bionet1_000425	FC(F)(F)c1cccc(COn2c(nc3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B08	compound treatment	1.056	-0.011	-0.15	1.33	0.0455	0.62	0.3341	0.5233	1908066	Bionet1_000426	Clc1ccc(/C=N/Nc2nc(Cl)nc3ccccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B09	compound treatment	1.049	-0.018	-0.24	1.307	0.0225	0.31	0.0456	0.1164	1908067	Bionet1_000427	Clc1ccc(COn2c(nc3ccccc23)c4ccccc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B10	compound treatment	1.034	-0.033	-0.45	1.272	-0.0125	-0.17	-0.435	-0.9127	1908068	Bionet1_000428	Clc1nc(N/N=C/c2ccc(Br)cc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B11	compound treatment	1.054	-0.013	-0.18	1.301	0.0165	0.23	0.0354	0.124	1908069	Bionet1_000429	Clc1ccc(cc1)c2nc3ccccc3n2OCc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B12	compound treatment	1.011	-0.056	-0.76	1.325	0.0405	0.55	-0.1433	-0.1531	1908070	Bionet1_000430	Clc1nc2ccccc2c3nnc(c4ccc(Br)cc4)n13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B13	compound treatment	1.069	0.00199	0.03	1.282	-0.00245	-0.03	-0.0047	-0.109	1908071	Bionet1_000431	Clc1ccc(COn2c(nc3ccccc23)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B14	compound treatment	1.045	-0.022	-0.3	1.261	-0.0235	-0.32	-0.4361	-0.9993	1661291	Bionet1_000432	Fc1ccccc1c2nnc3c4ccccc4nc(Nc5ccccc5)n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B15	compound treatment	1.076	0.00899	0.12	1.256	-0.0285	-0.39	-0.1886	-0.4639	1908072	Bionet1_000433	Fc1cccc(Cl)c1COn2c(nc3ccccc23)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B16	compound treatment	1.041	-0.026	-0.35	1.34	0.0555	0.76	0.2875	0.3444	1908073	Bionet1_000434	Cc1cc(C)cc(COn2c(nc3ccc(Cl)cc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B17	compound treatment	1.069	0.00199	0.03	1.253	-0.0315	-0.43	-0.2843	-0.6615	1908074	Bionet1_000435	Cc1ccc(cc1)c2nc3ccccc3n2OCc4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B18	compound treatment	1.04	-0.027	-0.36	1.223	-0.0615	-0.84	-0.8502	-0.9304	1908075	Bionet1_000436	Cn1nc(c(COC(=O)Nc2ccc(Cl)cc2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B19	compound treatment	1.049	-0.018	-0.24	1.277	-0.00745	-0.1	-0.2437	-0.9252	1908076	Bionet1_000437	Cc1ccc(cc1)c2nc3ccccc3n2OCc4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B20	compound treatment	1.043	-0.024	-0.32	1.294	0.00955	0.13	-0.137	-0.3924	1908077	Bionet1_000438	Cn1nc(c(COC(=O)c2ccc(Cl)cc2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B21	compound treatment	1.046	-0.021	-0.28	1.319	0.0345	0.47	0.1327	0.2413	1908078	Bionet1_000439	Cc1ccc(cc1)c2nc3ccccc3n2OCc4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	B22	compound treatment	1.044	-0.023	-0.31	1.291	0.00655	0.09	-0.1564	-0.4842	1908079	Bionet1_000440	Cn1nc(c(COC(=O)Nc2cccc(Cl)c2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C03	compound treatment	1.073	0.00599	0.08	1.257	-0.0275	-0.37	-0.2076	-0.542	1134484	Bionet1_000441	Clc1ccc(NC(=O)c2cn(Cc3cccnc3)c(=O)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C04	compound treatment	1.083	0.016	0.22	1.255	-0.0295	-0.4	-0.1315	-0.2884	1908080	Bionet1_000442	CS/C(=C(/C(=O)\C=C\c1ccccc1)\c2ccccc2)/Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C05	compound treatment	1.048	-0.019	-0.26	1.262	-0.0225	-0.31	-0.3979	-0.9961	1908081	Bionet1_000443	FC(F)(F)Oc1ccc(NNC(=O)c2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C06	compound treatment	1.087	0.02	0.27	1.281	-0.00345	-0.05	0.1574	0.5749	1908082	Bionet1_000444	COc1ccc(cc1)C2CC(=O)C(=C(Nc3ccccc3)S2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C07	compound treatment	1.068	9.91E-4	0.01	1.316	0.0315	0.43	0.3136	0.7287	1908083	Bionet1_000445	FC(F)(F)Oc1ccc(NNC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C08	compound treatment	1.083	0.016	0.22	1.34	0.0555	0.76	0.6881	0.8737	1908084	Bionet1_000446	Cc1ccc(cc1)C2CC(=O)C(=C(Nc3ccccc3)S2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C09	compound treatment	1.067	-9.4E-6	0.0	1.25	-0.0345	-0.47	-0.3323	-0.7073	1908085	Bionet1_000447	FC(F)(F)Oc1ccc(NNC(=O)c2ccccc2C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C10	compound treatment	1.045	-0.022	-0.3	1.283	-0.00145	-0.02	-0.224	-0.7527	1908086	Bionet1_000448	FC(F)(F)c1nnc2c(Sc3ccccc3)nc4ccc(Cl)cc4n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C11	compound treatment	1.05	-0.017	-0.23	1.328	0.0435	0.59	0.2576	0.4047	1732143	Bionet1_000449	CC(C)OC(=O)c1cc(Cl)c(=O)n(Cc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C12	compound treatment	1.099	0.032	0.43	1.33	0.0455	0.62	0.7443	0.9842	1908087	Bionet1_000450	C1CN(CCN1C(c2ccccc2)c3ccccc3)C4=Nc5ccccc5CS4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C13	compound treatment	1.099	0.032	0.43	1.291	0.00655	0.09	0.3683	0.8357	1908088	Bionet1_000451	CCCCOC(=O)c1cc(Cl)c(=O)n(Cc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C14	compound treatment	1.094	0.027	0.36	1.34	0.0555	0.76	0.7931	0.9437	1908089	Bionet1_000452	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C15	compound treatment	1.059	-0.00801	-0.11	1.249	-0.0355	-0.48	-0.4183	-0.8443	1206331	Bionet1_000453	Clc1ccc(Cn2cc(cc(Cl)c2=O)C(=O)OCC#C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C16	compound treatment	1.078	0.011	0.15	1.348	0.0635	0.87	0.7176	0.8162	1908090	Bionet1_000454	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C17	compound treatment	1.042	-0.025	-0.34	1.323	0.0385	0.53	0.1331	0.2131	1241150	Bionet1_000455	Clc1ccc(C(=O)Oc2cccnc2I)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C18	compound treatment	1.055	-0.012	-0.16	1.342	0.0575	0.78	0.4403	0.5495	1908091	Bionet1_000456	CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C19	compound treatment	1.049	-0.018	-0.24	1.296	0.0115	0.16	-0.0605	-0.2089	1908092	Bionet1_000457	[O-][N+](=O)c1ccc(NC(=O)Oc2cccnc2I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C20	compound treatment	1.081	0.014	0.19	1.262	-0.0225	-0.31	-0.0831	-0.2309	1908093	Bionet1_000458	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C21	compound treatment	1.107	0.04	0.54	1.263	-0.0215	-0.29	0.1746	0.2845	1908094	Bionet1_000459	[O-][N+](=O)c1ccc(CONC(=O)N/C=N/OCc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	C22	compound treatment	1.115	0.048	0.65	1.369	0.0845	1.15	1.273	0.9628	1908095	Bionet1_000460	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D03	compound treatment	1.068	9.91E-4	0.01	1.299	0.0145	0.2	0.1497	0.753	1908096	Bionet1_000461	COc1ccc(cc1)c2nc3ccccc3n2OCc4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D04	compound treatment	1.051	-0.016	-0.22	1.294	0.00955	0.13	-0.0607	-0.2406	1908097	Bionet1_000462	Cc1ccc(COn2c(nc3ccc(cc23)[N+](=O)[O-])c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D05	compound treatment	1.072	0.00499	0.07	1.345	0.0605	0.83	0.6314	0.7622	1908098	Bionet1_000463	COc1ccc(cc1)c2nc3ccccc3n2OCc4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D06	compound treatment	1.011	-0.056	-0.76	1.292	0.00755	0.1	-0.4615	-0.6052	1908099	Bionet1_000464	Cc1cc(C)cc(COn2c(nc3ccc(cc23)[N+](=O)[O-])c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D07	compound treatment	1.081	0.014	0.19	1.249	-0.0355	-0.48	-0.2084	-0.4015	1590670	Bionet1_000465	COC(=O)c1nn(c2ccccc2)c(=O)cc1Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D08	compound treatment	1.006	-0.061	-0.82	1.271	-0.0135	-0.18	-0.7117	-0.844	1908100	Bionet1_000466	CCOC(=O)C(C)On1c(nc2ccc(cc12)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D09	compound treatment	1.054	-0.013	-0.18	1.302	0.0175	0.24	0.0451	0.1519	1141529	Bionet1_000467	COC(=O)c1nn(c2ccc(OC)cc2)c(=O)cc1Sc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D10	compound treatment	1.037	-0.03	-0.4	1.277	-0.00745	-0.1	-0.3581	-0.858	1908101	Bionet1_000468	Cc1ccc(COn2c(nc3ccc(cc23)[N+](=O)[O-])c4cccc(Cl)c4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D11	compound treatment	1.053	-0.014	-0.19	1.27	-0.0145	-0.2	-0.273	-0.9998	1908102	Bionet1_000469	COC(=O)c1sc2cc(=O)n(nc2c1O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D12	compound treatment	1.058	-0.00901	-0.12	1.254	-0.0305	-0.42	-0.3796	-0.8773	1908103	Bionet1_000470	CCOC(=O)CSc1nc(Cc2ccc(Cl)cc2)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D13	compound treatment	1.101	0.034	0.46	1.237	-0.0475	-0.65	-0.1333	-0.1681	1310906	Bionet1_000471	COC(=O)c1nn(c2ccc(OC)cc2)c(=O)cc1Sc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D14	compound treatment	1.07	0.00299	0.04	1.228	-0.0565	-0.77	-0.5158	-0.6691	1728366	Bionet1_000472	Clc1ccc(Cc2nc(NCc3ccccc3)c4ccccc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D15	compound treatment	1.02	-0.047	-0.63	1.27	-0.0145	-0.2	-0.5878	-0.8851	1330713	Bionet1_000473	COC(=O)CSc1cc(=O)n(nc1C(=O)OC)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D16	compound treatment	1.039	-0.028	-0.38	1.268	-0.0165	-0.22	-0.4259	-0.969	1663469	Bionet1_000474	Clc1ccc(c2nnc3c4ccccc4nc(N5CCCCC5)n23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D17	compound treatment	1.102	0.035	0.47	1.213	-0.0715	-0.97	-0.3552	-0.3281	1908104	Bionet1_000475	COC(=O)c1sc2cc(=O)n(nc2c1N)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D18	compound treatment	1.079	0.012	0.16	1.287	0.00255	0.03	0.1389	0.8397	1700185	Bionet1_000476	Clc1ccc(cc1Cl)c2nnc3c4ccccc4nc(N5CCOCC5)n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D19	compound treatment	1.07	0.00299	0.04	1.333	0.0485	0.66	0.4966	0.7488	1489949	Bionet1_000477	COC(=O)c1nn(c2ccc(OC)cc2)c(=O)cc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D20	compound treatment	1.059	-0.00801	-0.11	1.267	-0.0175	-0.24	-0.2447	-0.9362	1908105	Bionet1_000478	CN1C(=O)N(C)C(=O)C(=CNNc2ncc(cc2Cl)C(F)(F)F)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D21	compound treatment	1.087	0.02	0.27	1.293	0.00855	0.12	0.2731	0.9296	1625642	Bionet1_000479	COc1ccc(cc1)n2nc(C(=O)NN)c(Sc3ccc(C)cc3)cc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	D22	compound treatment	1.023	-0.044	-0.59	1.294	0.00955	0.13	-0.3278	-0.5393	1908106	Bionet1_000480	Cc1snc(SCc2ncc(cc2Cl)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E03	compound treatment	1.05	-0.017	-0.23	1.281	-0.00345	-0.05	-0.1956	-0.8349	1908107	Bionet1_000481	Clc1ccc(NC(=O)c2cc(Cl)c(=O)n(Cc3ccccc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E04	compound treatment	1.044	-0.023	-0.31	1.263	-0.0215	-0.29	-0.4264	-0.9996	1908108	Bionet1_000482	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E05	compound treatment	1.039	-0.028	-0.38	1.269	-0.0155	-0.21	-0.4162	-0.962	1657485	Bionet1_000483	Clc1cc(cn(Cc2ccccc2)c1=O)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E06	compound treatment	1.058	-0.00901	-0.12	1.283	-0.00145	-0.02	-0.1	-0.8118	1908109	Bionet1_000484	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E07	compound treatment	1.055	-0.012	-0.16	1.28	-0.00445	-0.06	-0.1575	-0.9103	1712706	Bionet1_000485	Fc1ccc(NC(=O)c2cc(Cl)c(=O)n(Cc3ccccc3)c2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E08	compound treatment	1.088	0.021	0.28	1.242	-0.0425	-0.58	-0.2091	-0.3245	1908110	Bionet1_000486	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E09	compound treatment	1.045	-0.022	-0.3	1.285	5.45E-4	0.01	-0.2047	-0.6892	1169784	Bionet1_000487	Clc1ccc(Cn2cc(cc(Cl)c2=O)C(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E10	compound treatment	1.093	0.026	0.35	1.314	0.0295	0.4	0.5328	0.9976	1908111	Bionet1_000488	COc1ccc(NC(=O)c2cccc(OS(=O)(=O)N(C)C)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E11	compound treatment	1.071	0.00399	0.05	1.31	0.0255	0.35	0.2844	0.8068	1447132	Bionet1_000489	Clc1ccc(Cn2cc(cc(Cl)c2=O)C(=O)NCc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E12	compound treatment	1.066	-0.00101	-0.01	1.325	0.0405	0.55	0.3813	0.6895	1908112	Bionet1_000490	CN(C)S(=O)(=O)Oc1cccc(c1)C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E13	compound treatment	1.059	-0.00801	-0.11	1.257	-0.0275	-0.37	-0.3411	-0.8755	1442566	Bionet1_000491	CN(C)CCNC(=O)c1cc(Cl)c(=O)n(Cc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E14	compound treatment	1.055	-0.012	-0.16	1.281	-0.00345	-0.05	-0.1479	-0.8764	1908113	Bionet1_000492	CN(C)S(=O)(=O)Oc1ccc(cc1Cl)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E15	compound treatment	1.099	0.032	0.43	1.286	0.00155	0.02	0.3201	0.7408	1666594	Bionet1_000493	Clc1ccc(Cn2cc(cc(Cl)c2=O)C(=O)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E16	compound treatment	1.077	0.00999	0.13	1.261	-0.0235	-0.32	-0.1309	-0.377	1908114	Bionet1_000494	CN(C)S(=O)(=O)Oc1ccc(cc1Cl)C(=O)Nc2cccc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E17	compound treatment	1.073	0.00599	0.08	1.328	0.0435	0.59	0.477	0.796	1644458	Bionet1_000495	CN1CCN(CC1)C(=O)c2cc(Cl)c(=O)n(Cc3ccc(Cl)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E18	compound treatment	1.048	-0.019	-0.26	1.359	0.0745	1.02	0.5375	0.5127	1908115	Bionet1_000496	CN(C)S(=O)(=O)Oc1ccc(cc1Cl)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E19	compound treatment	1.091	0.024	0.32	1.312	0.0275	0.38	0.4945	0.9972	1517230	Bionet1_000497	Clc1ccc(NC(=O)CC(=O)Nc2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E20	compound treatment	1.109	0.042	0.57	1.401	0.117	1.59	1.5243	0.9035	1908116	Bionet1_000498	CN(C)S(=O)(=O)Oc1ccc(Cl)cc1C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E21	compound treatment	1.109	0.042	0.57	1.344	0.0595	0.81	0.9747	0.9845	1908117	Bionet1_000499	CNC(=S)NNC(=O)c1cccn(Cc2cccc(c2)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	E22	compound treatment	1.087	0.02	0.27	1.28	-0.00445	-0.06	0.1477	0.5344	1908118	Bionet1_000500	FC(F)(F)c1nnc2c(Sc3ccc(Cl)cc3)nc4ccccc4n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F03	compound treatment	1.055	-0.012	-0.16	1.244	-0.0405	-0.55	-0.5046	-0.8777	1908119	Bionet1_000501	COC(=O)c1nn(c2cccc(c2)C(F)(F)F)c(=O)cc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F04	compound treatment	1.041	-0.026	-0.35	1.229	-0.0555	-0.76	-0.7828	-0.939	1908120	Bionet1_000502	CC(C)C(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)c(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F05	compound treatment	1.06	-0.00701	-0.09	1.291	0.00655	0.09	-0.0038	-0.0288	1726222	Bionet1_000503	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Oc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F06	compound treatment	1.052	-0.015	-0.2	1.204	-0.0805	-1.1	-0.919	-0.8237	1908121	Bionet1_000504	FC(F)(F)c1cccc(CN2C(=O)/C(=N\OC(=O)C3CC3)/c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F07	compound treatment	1.063	-0.00401	-0.05	1.275	-0.00945	-0.13	-0.1294	-0.9256	1658078	Bionet1_000505	COC(=O)c1nn(c2ccc(OC)cc2)c(=O)cc1Oc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F08	compound treatment	1.063	-0.00401	-0.05	1.32	0.0355	0.48	0.3045	0.6243	1908122	Bionet1_000506	ClCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F09	compound treatment	1.034	-0.033	-0.45	1.229	-0.0555	-0.76	-0.8496	-0.9681	1622633	Bionet1_000507	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Sc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F10	compound treatment	1.036	-0.031	-0.42	1.242	-0.0425	-0.58	-0.7052	-0.9873	1908123	Bionet1_000508	CC(C)C(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F11	compound treatment	1.087	0.02	0.27	1.227	-0.0575	-0.78	-0.3633	-0.4385	1247584	Bionet1_000509	Clc1ccc(c(Cl)c1)n2nc(C#N)c(Oc3ccccc3)cc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F12	compound treatment	1.031	-0.036	-0.49	1.217	-0.0675	-0.92	-0.9939	-0.9555	1908124	Bionet1_000510	CCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F13	compound treatment	1.08	0.013	0.18	1.266	-0.0185	-0.25	-0.054	-0.1762	1140024	Bionet1_000511	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Oc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F14	compound treatment	1.047	-0.02	-0.27	1.207	-0.0775	-1.06	-0.9377	-0.8602	1908125	Bionet1_000512	N/C(=N\Nc1ncc(cc1Cl)C(F)(F)F)/CSc2ccccn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F15	compound treatment	1.069	0.00199	0.03	1.337	0.0525	0.72	0.5257	0.7331	1720398	Bionet1_000513	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Sc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F16	compound treatment	1.056	-0.011	-0.15	1.281	-0.00345	-0.05	-0.1383	-0.8878	1908126	Bionet1_000514	Fc1cccc(Cl)c1COn2c(nc3ccc(Cl)cc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F17	compound treatment	1.091	0.024	0.32	1.278	-0.00645	-0.09	0.1666	0.4968	1273407	Bionet1_000515	COC(=O)c1nn(c2ccccc2)c(=O)cc1Oc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F18	compound treatment	1.052	-0.015	-0.2	1.224	-0.0605	-0.82	-0.7261	-0.8554	1908127	Bionet1_000516	Cc1ccc(CN2C(=O)/C(=N\OC(=O)CCCCl)/c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F19	compound treatment	1.023	-0.044	-0.59	1.245	-0.0395	-0.54	-0.8003	-0.9988	1368159	Bionet1_000517	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Sc3ncccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F20	compound treatment	1.078	0.011	0.15	1.309	0.0245	0.33	0.3415	0.9329	1908128	Bionet1_000518	CC(C)CC(=O)O/N=C/1\C(=O)N(Cc2ccc(C)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F21	compound treatment	1.058	-0.00901	-0.12	1.295	0.0105	0.14	0.0157	0.0836	1908129	Bionet1_000519	COC(=O)c1nn(c2ccc(Cl)cc2)c(=O)cc1Sc3cccc[n+]3[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	F22	compound treatment	1.005	-0.062	-0.84	1.373	0.0885	1.21	0.2623	0.1785	1908130	Bionet1_000520	CCCCC(=O)O/N=C/1\C(=O)N(Cc2ccc(C)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G03	compound treatment	1.059	-0.00801	-0.11	1.247	-0.0375	-0.51	-0.4376	-0.8381	1908131	Bionet1_000521	CNC(=S)NNC(=O)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G04	compound treatment	1.067	-9.4E-6	0.0	1.265	-0.0195	-0.27	-0.1877	-0.7074	1908132	Bionet1_000522	COc1ccc(Sc2nc3ccccc3n4c(nnc24)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G05	compound treatment	0.986	-0.081	-1.09	1.234	-0.0505	-0.69	-1.2593	-0.9751	1908133	Bionet1_000523	Cn1c(S)nnc1c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G06	compound treatment	1.113	0.046	0.62	1.27	-0.0145	-0.2	0.2993	0.4598	1908134	Bionet1_000524	Nc1c(cnn1c2ccc(Cc3ccc(Cl)cc3Cl)nn2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G07	compound treatment	1.059	-0.00801	-0.11	1.359	0.0745	1.02	0.6424	0.6284	1908135	Bionet1_000525	Cn1c(S)nnc1c2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G08	compound treatment	1.075	0.00799	0.11	1.287	0.00255	0.03	0.1008	0.8898	1117855	Bionet1_000526	COc1ccc(NC(=O)c2cccn(Cc3ccccc3Cl)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G09	compound treatment	1.078	0.011	0.15	1.344	0.0595	0.81	0.679	0.8226	1908136	Bionet1_000527	CNC(=S)NNC(=O)c1cccn(Cc2ccc(Cl)cc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G10	compound treatment	1.088	0.021	0.28	1.341	0.0565	0.77	0.7455	0.9075	1471885	Bionet1_000528	COc1ccc(NC(=O)c2cccn(Cc3ccccc3Cl)c2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G11	compound treatment	1.063	-0.00401	-0.05	1.272	-0.0125	-0.17	-0.1583	-0.8883	1908137	Bionet1_000529	CCNC(=S)NNC(=O)c1cccn(Cc2ccc(Cl)cc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G12	compound treatment	1.107	0.04	0.54	1.293	0.00855	0.12	0.4639	0.8405	1908138	Bionet1_000530	Cn1nc(c(/C=N/O)c1SCc2ccccc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G13	compound treatment	1.082	0.015	0.2	1.263	-0.0215	-0.29	-0.0639	-0.1796	1599000	Bionet1_000531	CCn1c(S)nnc1c2cccn(Cc3ccc(Cl)cc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G14	compound treatment	1.082	0.015	0.2	1.295	0.0105	0.14	0.2447	0.986	1908139	Bionet1_000532	Cn1nc(c(/C=N/O)c1SCc2ccc(Cl)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G15	compound treatment	1.115	0.048	0.65	1.266	-0.0185	-0.25	0.2799	0.4029	1553217	Bionet1_000533	Sc1nnc(c2cccn(Cc3ccc(Cl)cc3Cl)c2=O)n1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G16	compound treatment	1.076	0.00899	0.12	1.273	-0.0115	-0.16	-0.0247	-0.1248	1908140	Bionet1_000534	Cn1nc(c(/C=N/O)c1SCc2ccc(cc2)C(C)(C)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G17	compound treatment	1.05	-0.017	-0.23	1.349	0.0645	0.88	0.4601	0.5058	1908141	Bionet1_000535	CSc1nnc(c2cccn(Cc3ccc(Cl)cc3Cl)c2=O)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G18	compound treatment	1.082	0.015	0.2	1.284	-4.55E-4	-0.01	0.1386	0.6851	1908142	Bionet1_000536	CO/N=C/c1c(Sc2ccccc2C(=O)OC)n(C)nc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G19	compound treatment	1.06	-0.00701	-0.09	1.28	-0.00445	-0.06	-0.1098	-0.9771	1908143	Bionet1_000537	[O-][N+](=O)/C(=C/Nc1cc(Cl)cc(Cl)c1)/C2OC(=O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G20	compound treatment	1.086	0.019	0.26	1.32	0.0355	0.48	0.5239	0.9556	1908144	Bionet1_000538	COC(=O)c1ccccc1Sc2c(/C=N/O)c(nn2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G21	compound treatment	1.077	0.00999	0.13	1.351	0.0665	0.91	0.737	0.8033	1908145	Bionet1_000539	[O-][N+](=O)/C(=C/Nc1cccc(c1)C(F)(F)F)/C2OC(=O)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	G22	compound treatment	1.089	0.022	0.3	1.389	0.105	1.43	1.2178	0.8363	1703282	Bionet1_000540	Clc1ccc(cc1)C(=O)NCC(=O)N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H03	compound treatment	1.057	-0.01	-0.14	1.293	0.00855	0.12	-0.0131	-0.0734	1908146	Bionet1_000541	C/C(=C/C(=O)c1c(C)nn(c1O)c2nc(cs2)c3ccc(C)cc3)/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H04	compound treatment	1.015	-0.052	-0.7	1.236	-0.0485	-0.66	-0.9634	-0.9995	1908147	Bionet1_000542	Cc1ccc(CN2C(=O)/C(=N\OC(=O)C(C)(C)CCl)/c3ccccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H05	compound treatment	1.072	0.00499	0.07	1.32	0.0355	0.48	0.3904	0.7977	1908148	Bionet1_000543	Cc1cc(c2c(C)nn(c2O)c3ccccc3)n(n1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H06	compound treatment	1.019	-0.048	-0.65	1.264	-0.0205	-0.28	-0.6552	-0.9291	1908149	Bionet1_000544	ClCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H07	compound treatment	1.082	0.015	0.2	1.268	-0.0165	-0.22	-0.0157	-0.0518	1908150	Bionet1_000545	Cc1cc(c2c(C)nn(c2O)c3ccc(Cl)cc3)n(n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H08	compound treatment	1.049	-0.018	-0.24	1.286	0.00155	0.02	-0.1569	-0.6434	1908151	Bionet1_000546	ClCCCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H09	compound treatment	1.093	0.026	0.35	1.312	0.0275	0.38	0.5135	0.9994	1908152	Bionet1_000547	COc1ccc(cc1)c2csc(n2)n3nc(C)c(C(=O)/C=C(/C)\O)c3O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H10	compound treatment	1.077	0.00999	0.13	1.276	-0.00845	-0.12	0.0138	0.0777	1908153	Bionet1_000548	CC(C)CC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H11	compound treatment	1.043	-0.024	-0.32	1.321	0.0365	0.5	0.1234	0.2075	1908154	Bionet1_000549	Cc1cc(c2c(C)nn(c2O)c3ccc(Cl)cc3)n(n1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H12	compound treatment	1.076	0.00899	0.12	1.331	0.0465	0.63	0.5346	0.8273	1908155	Bionet1_000550	[O-][N+](=O)c1ccc2N(Cc3ccc(Cl)cc3Cl)C(=O)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H13	compound treatment	1.058	-0.00901	-0.12	1.302	0.0175	0.24	0.0832	0.3102	1908156	Bionet1_000551	Cc1cc(c2c(C)nn(c2O)c3nc(cs3)c4ccccc4)n(n1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H14	compound treatment	1.062	-0.00501	-0.07	1.338	0.0535	0.73	0.4685	0.6389	1908157	Bionet1_000552	CCCCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H15	compound treatment	1.092	0.025	0.34	1.326	0.0415	0.57	0.639	0.9693	1908158	Bionet1_000553	C/C(=C/C(=O)c1c(C)nn(c1O)c2nc(cs2)c3ccc(Cl)cc3)/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H16	compound treatment	1.039	-0.028	-0.38	1.297	0.0125	0.17	-0.1462	-0.3525	1908159	Bionet1_000554	FC(F)(F)c1cnc(N2CCN(CC2)c3ccc(Cl)nn3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H17	compound treatment	1.065	-0.00201	-0.03	1.325	0.0405	0.55	0.3718	0.6716	1908160	Bionet1_000555	COc1ccc(cc1)c2nc3ccccc3n2OCc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H18	compound treatment	1.058	-0.00901	-0.12	1.295	0.0105	0.14	0.0157	0.0836	1908161	Bionet1_000556	O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2Cl)c3ccc(cc13)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H19	compound treatment	1.078	0.011	0.15	1.276	-0.00845	-0.12	0.0233	0.1242	1908162	Bionet1_000557	COc1ccc(cc1)c2nc3ccccc3n2OCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H20	compound treatment	1.053	-0.014	-0.19	1.267	-0.0175	-0.24	-0.3019	-0.9935	1908163	Bionet1_000558	CCCCC(=O)O/N=C/1\C(=O)N(Cc2cccc(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H21	compound treatment	1.097	0.03	0.4	1.334	0.0495	0.68	0.7638	0.9699	1908164	Bionet1_000559	COc1ccc(cc1)c2nc3ccccc3n2OCc4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	H22	compound treatment	1.032	-0.035	-0.47	1.295	0.0105	0.14	-0.2323	-0.4705	1908165	Bionet1_000560	ClCCC(=O)O/N=C/1\C(=O)N(Cc2cccc(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I03	compound treatment	1.057	-0.01	-0.14	1.317	0.0325	0.44	0.2183	0.4707	1908166	Bionet1_000561	[O-][N+](=O)/C(=C/Nc1ccc(Oc2ccccc2)cc1)/C3OC(=O)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I04	compound treatment	1.04	-0.027	-0.36	1.276	-0.00845	-0.12	-0.3392	-0.8875	1908167	Bionet1_000562	COc1ccc(cc1)C(=O)NCC(=O)NCCOC(=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I05	compound treatment	1.016	-0.051	-0.69	1.3	0.0155	0.21	-0.3367	-0.4676	1908168	Bionet1_000563	Clc1ccc(CO/N=C/NC(=O)C2CCN(CC2)c3ncccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I06	compound treatment	1.077	0.00999	0.13	1.288	0.00355	0.05	0.1295	0.9043	1908169	Bionet1_000564	CC/1=NN(C(=O)\C1=N/Nc2cccc(c2)C(F)(F)F)C3=NCCS3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I07	compound treatment	1.06	-0.00701	-0.09	1.254	-0.0305	-0.42	-0.3605	-0.8464	1908170	Bionet1_000565	CC(C)(C)c1ccc(N/C=C(\C2OC(=O)c3ccccc23)/[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I08	compound treatment	1.107	0.04	0.54	1.348	0.0635	0.87	0.9942	0.974	1908171	Bionet1_000566	Clc1ccc(cc1Cl)N2C(=O)CSC23C(=O)Nc4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I09	compound treatment	1.056	-0.011	-0.15	1.276	-0.00845	-0.12	-0.1865	-0.9922	1908172	Bionet1_000567	Clc1cccc(Cn2cc(Cl)cc(C(=O)Nc3ccccc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I10	compound treatment	1.054	-0.013	-0.18	1.312	0.0275	0.38	0.1415	0.3413	1908173	Bionet1_000568	FC(F)(F)c1cccc(c1)N2C(=O)CSC23C(=O)Nc4ccccc43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I11	compound treatment	1.105	0.038	0.51	1.287	0.00255	0.03	0.3869	0.7533	1908174	Bionet1_000569	Clc1ccc(cc1)C(=O)C[n+]2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I12	compound treatment	1.026	-0.041	-0.55	1.307	0.0225	0.31	-0.1738	-0.2746	1333462	Bionet1_000570	O=C1CSC2(N1c3ccccc3)C(=O)N(Cc4ccccc4)c5ccccc52
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I13	compound treatment	1.089	0.022	0.3	1.271	-0.0135	-0.18	0.08	0.2295	1908175	Bionet1_000571	Clc1ccc(C(=O)C[n+]2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I14	compound treatment	1.072	0.00499	0.07	1.288	0.00355	0.05	0.0818	0.9868	1908176	Bionet1_000572	Clc1ccc(cc1)n2cc(COC(=O)Nc3cccc(Cl)c3)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I15	compound treatment	1.061	-0.00601	-0.08	1.337	0.0525	0.72	0.4493	0.6231	1003505	Bionet1_000573	[O-][N+](=O)c1ccc(cc1)C(=O)C[n+]2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I16	compound treatment	1.081	0.014	0.19	1.312	0.0275	0.38	0.3991	0.9493	1908177	Bionet1_000574	FC(F)(F)c1cccc(NC(=O)OCc2cn(nn2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I17	compound treatment	1.053	-0.014	-0.19	1.293	0.00855	0.12	-0.0512	-0.2308	1908178	Bionet1_000575	CNC(=S)NNC(=O)c1ccc(=O)n(Cc2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I18	compound treatment	1.104	0.037	0.5	1.211	-0.0735	-1.0	-0.3554	-0.3176	1908179	Bionet1_000576	Clc1ccc(NC(=O)OCc2cn(nn2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I19	compound treatment	1.047	-0.02	-0.27	1.353	0.0685	0.93	0.4701	0.4832	1908180	Bionet1_000577	FC(F)(F)c1cccc(Cn2cc(ccc2=O)c3nnc(S)n3CC=C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I20	compound treatment	1.103	0.036	0.49	1.359	0.0745	1.02	1.0621	0.9428	1908181	Bionet1_000578	Clc1ccc(cc1)n2cc(COC(=O)C(Cl)(Cl)Cl)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I21	compound treatment	1.087	0.02	0.27	1.404	0.12	1.63	1.3434	0.813	1908182	Bionet1_000579	FC(F)(F)c1cccc(Cn2cc(ccc2=O)c3nnc(S)o3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	I22	compound treatment	1.099	0.032	0.43	1.326	0.0415	0.57	0.7058	0.991	1908183	Bionet1_000580	Clc1ccc(cc1)n2cc(COC(=O)c3ccc(Cl)cc3Cl)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J03	compound treatment	1.07	0.00299	0.04	1.295	0.0105	0.14	0.1302	0.8718	1908184	Bionet1_000581	COc1ccc(cc1)c2nc3ccccc3n2OCc4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J04	compound treatment	1.059	-0.00801	-0.11	1.261	-0.0235	-0.32	-0.3026	-0.8962	1908185	Bionet1_000582	Cc1ccc(cc1)S(=O)(=O)Nc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J05	compound treatment	1.06	-0.00701	-0.09	1.309	0.0245	0.33	0.1698	0.4882	1908186	Bionet1_000583	Clc1ccc(cc1)c2nc3ncccc3n2OCc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J06	compound treatment	1.032	-0.035	-0.47	1.231	-0.0535	-0.73	-0.8494	-0.9779	1908187	Bionet1_000584	CC(=O)N(OCc1ccc(Cl)cc1)/C=C\2/N=C(OC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J07	compound treatment	1.074	0.00699	0.09	1.273	-0.0115	-0.16	-0.0438	-0.2399	1726544	Bionet1_000585	Clc1ccc(COn2c(nc3ncccc23)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J08	compound treatment	1.042	-0.025	-0.34	1.284	-4.55E-4	-0.01	-0.243	-0.72	1908188	Bionet1_000586	FC(F)(F)c1cnc(OCCNC(=O)Cc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J09	compound treatment	1.084	0.017	0.23	1.235	-0.0495	-0.67	-0.3148	-0.4419	1908189	Bionet1_000587	FC(F)(F)c1cccc(COn2c(nc3ncccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J10	compound treatment	1.054	-0.013	-0.18	1.226	-0.0585	-0.8	-0.6877	-0.8426	1908190	Bionet1_000588	FC(F)(F)c1cnc(N2CCN(CC2)c3ccc(C#N)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J11	compound treatment	1.074	0.00699	0.09	1.257	-0.0275	-0.37	-0.198	-0.513	1908191	Bionet1_000589	Clc1ccc(cc1)c2nc3ncccc3n2OCc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J12	compound treatment	1.059	-0.00801	-0.11	1.2	-0.0845	-1.15	-0.8907	-0.7701	1908192	Bionet1_000590	[O-][N+](=O)c1cccnc1N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J13	compound treatment	1.101	0.034	0.46	1.309	0.0245	0.33	0.5609	0.988	1908193	Bionet1_000591	Cc1ccc(cc1)c2nc3ncccc3n2OCc4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J14	compound treatment	1.089	0.022	0.3	1.243	-0.0415	-0.57	-0.1899	-0.2975	1908194	Bionet1_000592	FC(F)(F)c1cnc(N2CCN(CC2)c3cccc(Cl)n3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J15	compound treatment	1.081	0.014	0.19	1.282	-0.00245	-0.03	0.1098	0.5728	1908195	Bionet1_000593	Cc1ccc(cc1)c2nc3ncccc3n2OCc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J16	compound treatment	1.044	-0.023	-0.31	1.22	-0.0645	-0.88	-0.841	-0.9022	1908196	Bionet1_000594	NC(=O)c1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J17	compound treatment	1.113	0.046	0.62	1.295	0.0105	0.14	0.5404	0.8485	1908197	Bionet1_000595	Cc1ccc(cc1)c2nc3ncccc3n2OCc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J18	compound treatment	1.01	-0.057	-0.77	1.27	-0.0145	-0.2	-0.6832	-0.8605	1908198	Bionet1_000596	CN(C)/C=N/NC(=O)CN1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J19	compound treatment	1.12	0.053	0.71	1.292	0.00755	0.1	0.5783	0.8006	1687610	Bionet1_000597	COc1ccc(cc1)c2nc3ncccc3n2OCc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J20	compound treatment	1.057	-0.01	-0.14	1.259	-0.0255	-0.35	-0.3409	-0.9154	1908199	Bionet1_000598	O/N=C/1\C(=O)N(Cc2ccc(Cl)c(Cl)c2)c3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J21	compound treatment	1.081	0.014	0.19	1.339	0.0545	0.74	0.6594	0.8593	1557171	Bionet1_000599	COc1ccc(cc1)c2nc3ncccc3n2OCc4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	J22	compound treatment	1.037	-0.03	-0.4	1.242	-0.0425	-0.58	-0.6956	-0.9847	1908200	Bionet1_000600	Cc1onc(c1C(=O)NC(=S)NC(=O)N)c2c(F)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K03	compound treatment	1.072	0.00499	0.07	1.26	-0.0245	-0.33	-0.1882	-0.5532	1908201	Bionet1_000601	CCNC(=S)NNC(=O)c1ccc(=O)n(Cc2cccc(c2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K04	compound treatment	1.073	0.00599	0.08	1.298	0.0135	0.18	0.1878	0.9313	1908202	Bionet1_000602	FC(F)(F)c1cccc(c1)C(=O)OCc2cn(nn2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K05	compound treatment	1.092	0.025	0.34	1.331	0.0465	0.63	0.6872	0.9562	1908203	Bionet1_000603	CCn1c(S)nnc1c2ccc(=O)n(Cc3cccc(c3)C(F)(F)F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K06	compound treatment	1.079	0.012	0.16	1.283	-0.00145	-0.02	0.1004	0.6158	1908204	Bionet1_000604	Clc1ccc(cc1Cl)n2cc(COC(=O)Nc3ccccc3)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K07	compound treatment	1.076	0.00899	0.12	1.315	0.0305	0.42	0.3803	0.8766	1908205	Bionet1_000605	CNC(=S)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K08	compound treatment	1.11	0.043	0.58	1.275	-0.00945	-0.13	0.3189	0.5368	1908206	Bionet1_000606	Cc1ccc(NC(=O)OCc2cn(nn2)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K09	compound treatment	1.105	0.038	0.51	1.248	-0.0365	-0.5	0.0109	0.0153	1255396	Bionet1_000607	Cn1c(S)nnc1c2ccc(=O)n(Cc3ccc(Cl)cc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K10	compound treatment	1.108	0.041	0.55	1.317	0.0325	0.44	0.7048	0.9941	1908207	Bionet1_000608	Clc1cccc(NC(=O)OCc2cn(nn2)c3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K11	compound treatment	1.086	0.019	0.26	1.313	0.0285	0.39	0.4564	0.9794	1672425	Bionet1_000609	Sc1nnc(c2ccc(=O)n(Cc3ccc(Cl)cc3Cl)c2)n1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K12	compound treatment	1.083	0.016	0.22	1.331	0.0465	0.63	0.6013	0.897	1234090	Bionet1_000610	COc1ccc(cc1)C(=O)OCc2cn(nn2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K13	compound treatment	1.065	-0.00201	-0.03	1.321	0.0365	0.5	0.3332	0.6677	1908208	Bionet1_000611	CSc1nnc(c2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K14	compound treatment	1.112	0.045	0.61	1.31	0.0255	0.35	0.6755	0.9653	1908209	Bionet1_000612	Clc1ccc(cc1Cl)n2cc(COC(=O)C(Cl)(Cl)Cl)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K15	compound treatment	1.061	-0.00601	-0.08	1.274	-0.0105	-0.14	-0.1581	-0.9642	1024527	Bionet1_000613	COc1ccc(cc1)C(=O)C[n+]2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K16	compound treatment	1.074	0.00699	0.09	1.271	-0.0135	-0.18	-0.063	-0.3056	1742367	Bionet1_000614	Cc1cccc(c1)C(=O)NCC(=O)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K17	compound treatment	1.084	0.017	0.23	1.322	0.0375	0.51	0.5241	0.9343	1908210	Bionet1_000615	[O-][N+](=O)c1cccc(c1)C(=O)C[n+]2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K18	compound treatment	1.081	0.014	0.19	1.31	0.0255	0.35	0.3798	0.9586	1422775	Bionet1_000616	COc1ccc(cc1)C(=O)NCC(=O)N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K19	compound treatment	1.05	-0.017	-0.23	1.307	0.0225	0.31	0.0551	0.1437	1908211	Bionet1_000617	CCOC(=O)/C(=C\C(=C(\N)/N1CCN(CC1)c2ccc(OC)cc2)\C#N)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K20	compound treatment	1.087	0.02	0.27	1.356	0.0715	0.98	0.8806	0.8699	1908212	Bionet1_000618	COC(=O)C(NC(=O)c1ccccc1)/C=N/OCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K21	compound treatment	1.094	0.027	0.36	1.312	0.0275	0.38	0.5231	0.9999	1708814	Bionet1_000619	CCOC(=O)c1cc(C#N)c([nH]c1=O)N2CCN(CC2)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	K22	compound treatment	1.098	0.031	0.42	1.336	0.0515	0.7	0.7927	0.9692	1908213	Bionet1_000620	COC(=O)c1sc2ncccc2c1OCc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L03	compound treatment	1.1	0.033	0.45	1.244	-0.0405	-0.55	-0.0754	-0.1063	1908214	Bionet1_000621	Cc1ccc(COn2c(nc3ncccc23)c4ccc(Cl)cc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L04	compound treatment	1.042	-0.025	-0.34	1.291	0.00655	0.09	-0.1755	-0.5027	1908215	Bionet1_000622	Cc1onc(c1C(=O)Nc2nc(=O)[nH]s2)c3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L05	compound treatment	1.08	0.013	0.18	1.223	-0.0615	-0.84	-0.4686	-0.5474	1908216	Bionet1_000623	COc1ccc(N/C(=N\C=[N+](C)C)/SC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L06	compound treatment	1.088	0.021	0.28	1.256	-0.0285	-0.39	-0.0741	-0.1543	1908217	Bionet1_000624	Cc1ccc2N(Cc3ccc(Cl)cc3)C(=O)/C(=N\OC(=O)CCCl)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L07	compound treatment	1.078	0.011	0.15	1.225	-0.0595	-0.81	-0.4684	-0.5684	1908218	Bionet1_000625	CS/C(=N/C=[N+](C)C)/Nc1c(C)cccc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L08	compound treatment	1.024	-0.043	-0.58	1.244	-0.0405	-0.55	-0.8004	-0.9997	1908219	Bionet1_000626	CCCCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccc(C)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L09	compound treatment	1.095	0.028	0.38	1.255	-0.0295	-0.4	-0.017	-0.0308	1908220	Bionet1_000627	CN(C)/C=N/C(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L10	compound treatment	1.087	0.02	0.27	1.242	-0.0425	-0.58	-0.2187	-0.3424	1908221	Bionet1_000628	CC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L11	compound treatment	1.073	0.00599	0.08	1.305	0.0205	0.28	0.2553	0.8754	1908222	Bionet1_000629	Cc1ccc(NC(=O)c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L12	compound treatment	1.036	-0.031	-0.42	1.277	-0.00745	-0.1	-0.3677	-0.8541	1908223	Bionet1_000630	ClCC(=O)O/N=C/1\C(=O)N(Cc2ccc(Cl)cc2)c3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L13	compound treatment	1.049	-0.018	-0.24	1.322	0.0375	0.51	0.1902	0.3357	1908224	Bionet1_000631	Cc1ccccc1NC(=O)c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L14	compound treatment	1.067	-9.4E-6	0.0	1.245	-0.0395	-0.54	-0.3805	-0.7073	1908225	Bionet1_000632	CC(=O)O/N=C/1\C(=O)N(Cc2cccc(c2)C(F)(F)F)c3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L15	compound treatment	1.033	-0.034	-0.46	1.256	-0.0285	-0.39	-0.5988	-0.9965	1908226	Bionet1_000633	Cc1ccc(NC(=O)c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L16	compound treatment	1.041	-0.026	-0.35	1.245	-0.0395	-0.54	-0.6285	-0.9786	1908227	Bionet1_000634	CN(C)/C=C(\C#N)/c1nn2c(cc(nc2c1C#N)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L17	compound treatment	1.082	0.015	0.2	1.244	-0.0405	-0.55	-0.2471	-0.4205	1908228	Bionet1_000635	Cc1cccc(NC(=O)c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L18	compound treatment	1.001	-0.066	-0.89	1.283	-0.00145	-0.02	-0.6437	-0.7227	1908229	Bionet1_000636	Cc1cc(C)n2nc(/C(=C/c3ccc(Cl)cc3Cl)/C#N)c(C#N)c2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L19	compound treatment	1.094	0.027	0.36	1.277	-0.00745	-0.1	0.1856	0.4909	1908230	Bionet1_000637	Cc1ccc(NC(=O)c2cccn(Cc3cccc(c3)C(F)(F)F)c2=O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L20	compound treatment	1.052	-0.015	-0.2	1.228	-0.0565	-0.77	-0.6875	-0.8637	1908231	Bionet1_000638	FC(F)(F)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L21	compound treatment	1.084	0.017	0.23	1.263	-0.0215	-0.29	-0.0448	-0.1205	1908232	Bionet1_000639	Clc1ccc2nc(c3ccccc3)n(OCc4ccccc4Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	L22	compound treatment	1.043	-0.024	-0.32	1.258	-0.0265	-0.36	-0.4841	-0.9986	1908233	Bionet1_000640	FC(F)(F)c1ccccc1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M03	compound treatment	1.084	0.017	0.23	1.32	0.0355	0.48	0.5048	0.9415	1908234	Bionet1_000641	ClCCCC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M04	compound treatment	1.065	-0.00201	-0.03	1.316	0.0315	0.43	0.285	0.6612	1908235	Bionet1_000642	COC(=O)c1sc2ncccc2c1OCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M05	compound treatment	1.081	0.014	0.19	1.313	0.0285	0.39	0.4087	0.9448	1908236	Bionet1_000643	FC(F)(F)c1ccc(=O)n(Cc2ccc(cc2)C(=O)Nc3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M06	compound treatment	1.148	0.081	1.09	1.315	0.0305	0.42	1.0671	0.9126	1908237	Bionet1_000644	COC(=O)c1sc2ncccc2c1OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M07	compound treatment	1.064	-0.00301	-0.04	1.258	-0.0265	-0.36	-0.2838	-0.7818	1908238	Bionet1_000645	FC(F)(F)c1ccc(=O)n(Cc2ccc(NC(=O)N3CCOCC3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M08	compound treatment	1.112	0.045	0.61	1.304	0.0195	0.27	0.6176	0.9317	1908239	Bionet1_000646	COC(=O)c1sc2ncccc2c1OCc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M09	compound treatment	1.081	0.014	0.19	1.272	-0.0125	-0.17	0.0134	0.0527	1908240	Bionet1_000647	CC(C)(C)NC(=O)Nc1ccc(Cn2cc(ccc2=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M10	compound treatment	1.071	0.00399	0.05	1.355	0.0705	0.96	0.7183	0.7455	1908241	Bionet1_000648	Cn1nc(c(C#N)c1S(=O)(=O)c2ccc(Cl)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M11	compound treatment	1.089	0.022	0.3	1.286	0.00155	0.02	0.2247	0.7554	1908242	Bionet1_000649	FC(F)(F)c1ccc(=O)n(Cc2ccc(NC(=O)Nc3ccccc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M12	compound treatment	1.064	-0.00301	-0.04	1.36	0.0755	1.03	0.6997	0.6787	1908243	Bionet1_000650	CO/N=C/C1C(=O)N(OCc2ccc(Cl)cc2Cl)C(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M13	compound treatment	1.104	0.037	0.5	1.326	0.0415	0.57	0.7535	0.998	1908244	Bionet1_000651	COC(=O)CSC(=O)Nc1ccc(Cn2cc(ccc2=O)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M14	compound treatment	1.101	0.034	0.46	1.288	0.00355	0.05	0.3584	0.7774	1908245	Bionet1_000652	COC(=O)C(NC(=O)c1ccccc1)/C=N/OCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M15	compound treatment	1.131	0.064	0.86	1.248	-0.0365	-0.5	0.2589	0.2599	1908246	Bionet1_000653	Clc1ccc(Sc2ccc(Cc3ccc(Cl)cc3Cl)nn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M16	compound treatment	1.02	-0.047	-0.63	1.275	-0.00945	-0.13	-0.5396	-0.8338	1908247	Bionet1_000654	COC(=O)C(NC(=O)c1ccccc1)/C=N/OCc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M17	compound treatment	1.061	-0.00601	-0.08	1.288	0.00355	0.05	-0.0231	-0.2451	1908248	Bionet1_000655	Clc1cccc(Sc2ccc(Cc3ccc(Cl)cc3Cl)nn2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M18	compound treatment	1.112	0.045	0.61	1.336	0.0515	0.7	0.9262	0.9973	1908249	Bionet1_000656	COC(=O)C(NC(=O)c1ccccc1)/C=N/OCc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M19	compound treatment	1.067	-9.4E-6	0.0	1.264	-0.0205	-0.28	-0.1973	-0.7074	1908250	Bionet1_000657	Clc1ccc(Cc2ccc(SCc3ccccc3)nn2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M20	compound treatment	1.072	0.00499	0.07	1.382	0.0975	1.33	0.9882	0.7419	1908251	Bionet1_000658	COC(=O)C(NC(=O)c1ccccc1)/C=N/OCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M21	compound treatment	1.085	0.018	0.24	1.338	0.0535	0.73	0.6879	0.894	1908252	Bionet1_000659	Fc1ccc(NC(=S)N/C=N\OCc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	M22	compound treatment	1.097	0.03	0.4	1.341	0.0565	0.77	0.8313	0.9547	1908253	Bionet1_000660	COC(=O)c1ccccc1S(=O)(=O)c2c(C#N)c(nn2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N03	compound treatment	1.052	-0.015	-0.2	1.237	-0.0475	-0.65	-0.6008	-0.886	1908254	Bionet1_000661	Clc1cccc(COn2c(nc3ccc(Cl)cc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N04	compound treatment	1.03	-0.037	-0.5	1.228	-0.0565	-0.77	-0.8974	-0.978	1908255	Bionet1_000662	ClC(Cl)(Cl)C(=O)c1cc(c[nH]1)C(=O)c2ccccc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N05	compound treatment	1.09	0.023	0.31	1.228	-0.0565	-0.77	-0.325	-0.3916	1908256	Bionet1_000663	Clc1ccc(COn2c(nc3ccc(Cl)cc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N06	compound treatment	1.03	-0.037	-0.5	1.266	-0.0185	-0.25	-0.531	-0.9497	1908257	Bionet1_000664	Fc1ccc(C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N07	compound treatment	1.08	0.013	0.18	1.246	-0.0385	-0.52	-0.2469	-0.4465	1908258	Bionet1_000665	CCOC(=O)COn1c(nc2ccc(Cl)cc12)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N08	compound treatment	1.036	-0.031	-0.42	1.265	-0.0195	-0.27	-0.4834	-0.9758	1908259	Bionet1_000666	Clc1ccsc1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N09	compound treatment	1.103	0.036	0.49	1.326	0.0415	0.57	0.7439	0.997	1908260	Bionet1_000667	CCOC(=O)C(C)On1c(nc2ccc(Cl)cc12)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N10	compound treatment	1.036	-0.031	-0.42	1.297	0.0125	0.17	-0.1748	-0.3868	1426038	Bionet1_000668	Clc1ccc(C(=O)c2c[nH]c(NC(=O)Nc3ccccc3)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N11	compound treatment	1.044	-0.023	-0.31	1.315	0.0305	0.42	0.075	0.1444	1908261	Bionet1_000669	COc1ccc(COn2c(nc3ccc(Cl)cc23)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N12	compound treatment	1.067	-9.4E-6	0.0	1.207	-0.0775	-1.06	-0.7469	-0.7072	1908262	Bionet1_000670	Clc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N13	compound treatment	1.044	-0.023	-0.31	1.193	-0.0915	-1.25	-1.1013	-0.857	1908263	Bionet1_000671	Cc1ccc(COn2c(nc3ccc(Cl)cc23)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N14	compound treatment	1.068	9.91E-4	0.01	1.259	-0.0255	-0.35	-0.236	-0.6794	1908264	Bionet1_000672	Clc1ccc(C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N15	compound treatment	1.094	0.027	0.36	1.284	-4.55E-4	-0.01	0.2531	0.695	1566066	Bionet1_000673	CCOC(=O)COn1c(nc2ccc(Cl)cc12)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N16	compound treatment	1.013	-0.054	-0.73	1.238	-0.0465	-0.63	-0.9631	-0.9976	1908265	Bionet1_000674	Cc1onc(c1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N17	compound treatment	1.11	0.043	0.58	1.279	-0.00545	-0.07	0.3575	0.6114	1706192	Bionet1_000675	COc1ccc(Nc2nc3ccccc3c4nnc(c5ccccc5F)n24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N18	compound treatment	1.064	-0.00301	-0.04	1.24	-0.0445	-0.61	-0.4574	-0.7528	1908266	Bionet1_000676	Cn1cc(cc1C(=O)C(Cl)(Cl)Cl)C(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N19	compound treatment	1.044	-0.023	-0.31	1.262	-0.0225	-0.31	-0.436	-1.0	1908267	Bionet1_000677	[O-][N+](=O)c1ccc2nc(c3ccc(Cl)cc3)n(OCc4ccccc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N20	compound treatment	1.028	-0.039	-0.53	1.275	-0.00945	-0.13	-0.4633	-0.8551	1908268	Bionet1_000678	Clc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NNc3cccc(Cl)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N21	compound treatment	1.106	0.039	0.53	1.255	-0.0295	-0.4	0.0879	0.1329	1908269	Bionet1_000679	COc1ccc(cc1)c2nc3ccc(Cl)cc3n2OCc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	N22	compound treatment	0.999	-0.068	-0.92	1.231	-0.0535	-0.73	-1.1642	-0.9935	1908270	Bionet1_000680	Clc1ccccc1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O03	compound treatment	1.072	0.00499	0.07	1.272	-0.0125	-0.17	-0.0725	-0.3968	1908271	Bionet1_000681	Cc1nn(c(N)c1c2cccc(c2)C(F)(F)F)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O04	compound treatment	1.062	-0.00501	-0.07	1.302	0.0175	0.24	0.1214	0.4883	1908272	Bionet1_000682	Cn1nc(c(C#N)c1S(=O)(=O)Cc2cccc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O05	compound treatment	1.114	0.047	0.63	1.248	-0.0365	-0.5	0.0967	0.1201	1908273	Bionet1_000683	FC(F)(F)c1cccc(N/C=C\2/C=NN(C2=O)c3cccc(Cl)n3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O06	compound treatment	1.057	-0.01	-0.14	1.321	0.0365	0.5	0.2569	0.4976	1908274	Bionet1_000684	Cn1nc(c(C#N)c1S(=O)(=O)Cc2ccc(cc2)C(C)(C)C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O07	compound treatment	1.054	-0.013	-0.18	1.242	-0.0425	-0.58	-0.5335	-0.8818	1908275	Bionet1_000685	Clc1ccc(CON/C=C\2/C=NN(C2=O)c3cccc(Cl)n3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O08	compound treatment	1.067	-9.4E-6	0.0	1.265	-0.0195	-0.27	-0.1877	-0.7074	1908276	Bionet1_000686	Cn1nc(c(C#N)c1S(=O)(=O)c2cccc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O09	compound treatment	1.188	0.121	1.63	1.339	0.0545	0.74	1.6801	0.9367	1168349	Bionet1_000687	Clc1cccc(Cl)c1Cn2n(c3ccccc3)c4ncccc4c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O10	compound treatment	1.044	-0.023	-0.31	1.315	0.0305	0.42	0.075	0.1444	1493607	Bionet1_000688	Clc1ccc(cc1)N2CCN(CC2)c3ncnc4c5ccccc5[nH]c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O11	compound treatment	1.075	0.00799	0.11	1.26	-0.0245	-0.33	-0.1596	-0.4553	1908277	Bionet1_000689	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O12	compound treatment	1.106	0.039	0.53	1.295	0.0105	0.14	0.4736	0.8685	1677052	Bionet1_000690	COc1ccc(cc1)N2CCN(CC2)c3ncnc4c5ccccc5[nH]c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O13	compound treatment	1.099	0.032	0.43	1.243	-0.0415	-0.57	-0.0946	-0.1329	1908278	Bionet1_000691	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O14	compound treatment	1.07	0.00299	0.04	1.313	0.0285	0.39	0.3038	0.7762	1908279	Bionet1_000692	Cc1ccc(cc1)S(=O)(=O)NC(=O)OCc2cn(nn2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O15	compound treatment	1.082	0.015	0.2	1.257	-0.0275	-0.37	-0.1217	-0.2861	1908280	Bionet1_000693	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O16	compound treatment	1.072	0.00499	0.07	1.279	-0.00545	-0.07	-0.005	-0.0497	1323356	Bionet1_000694	Nc1nn(cc1c2ccc(Cl)cc2)c3ncnc4c5ccccc5[nH]c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O17	compound treatment	1.109	0.042	0.57	1.276	-0.00845	-0.12	0.319	0.5519	1908281	Bionet1_000695	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O18	compound treatment	1.071	0.00399	0.05	1.334	0.0495	0.68	0.5158	0.761	1908282	Bionet1_000696	Clc1ccc(/C=N/Nc2ncnc3c4ccccc4[nH]c23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O19	compound treatment	1.085	0.018	0.24	1.263	-0.0215	-0.29	-0.0353	-0.0927	1908283	Bionet1_000697	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O20	compound treatment	1.105	0.038	0.51	1.352	0.0675	0.92	1.0137	0.9617	1908284	Bionet1_000698	Clc1cccc(Cl)c1COn2c(nc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O21	compound treatment	1.085	0.018	0.24	1.321	0.0365	0.5	0.524	0.9453	1908285	Bionet1_000699	CN(C)S(=O)(=O)Oc1ccc(cc1)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	O22	compound treatment	1.113	0.046	0.62	1.326	0.0415	0.57	0.8393	0.999	1908286	Bionet1_000700	Clc1ccc(COn2c(nc3ccccc23)c4ccccc4)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P03	compound treatment	1.054	-0.013	-0.18	1.276	-0.00845	-0.12	-0.2056	-0.9792	1908287	Bionet1_000701	COc1ccc(cc1)c2nc3ccc(Cl)cc3n2OCc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P04	compound treatment	1.086	0.019	0.26	1.22	-0.0645	-0.88	-0.4403	-0.481	1908288	Bionet1_000702	Fc1ccc(C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P05	compound treatment	1.065	-0.00201	-0.03	1.259	-0.0255	-0.35	-0.2646	-0.76	1908289	Bionet1_000703	COc1ccc(cc1)c2nc3ccc(Cl)cc3n2OCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P06	compound treatment	1.018	-0.049	-0.66	1.243	-0.0415	-0.57	-0.8672	-0.997	1908290	Bionet1_000704	Fc1cccc(F)c1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P07	compound treatment	1.097	0.03	0.4	1.269	-0.0155	-0.21	0.1371	0.3005	1908291	Bionet1_000705	COc1ccc(cc1)c2nc3ccc(Cl)cc3n2OCc4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P08	compound treatment	1.061	-0.00601	-0.08	1.219	-0.0655	-0.89	-0.6885	-0.7682	1908292	Bionet1_000706	Clc1cccc(Cl)c1C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P09	compound treatment	0.957	-0.11	-1.48	1.143	-0.141	-1.93	-2.4134	-0.9916	1908293	Bionet1_000707	COc1ccc(cc1)c2nc3ccc(Cl)cc3n2OCc4cc(C)cc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P10	compound treatment	0.282	-0.785	-10.59	0.438	-0.846	-11.54	-15.6503	-0.9991	1908294	Bionet1_000708	Cn1cc(cc1C(=O)C(Cl)(Cl)Cl)C(=O)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P11	compound treatment	1.046	-0.021	-0.28	1.232	-0.0525	-0.72	-0.7062	-0.9179	1908295	Bionet1_000709	CCOC(=O)COn1c(nc2ccc(cc12)[N+](=O)[O-])c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P12	compound treatment	1.049	-0.018	-0.24	1.198	-0.0865	-1.18	-1.0054	-0.8353	1908296	Bionet1_000710	Clc1cccc(C(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P13	compound treatment	1.057	-0.01	-0.14	1.269	-0.0155	-0.21	-0.2445	-0.9769	1908297	Bionet1_000711	Cc1ccc(COn2c(nc3ccc(cc23)[N+](=O)[O-])c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P14	compound treatment	1.03	-0.037	-0.5	1.231	-0.0535	-0.73	-0.8685	-0.983	1908298	Bionet1_000712	CN(C)CCCNC(=O)c1cc(c[nH]1)C(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P15	compound treatment	1.092	0.025	0.34	1.265	-0.0195	-0.27	0.0508	0.1184	1908299	Bionet1_000713	COc1ccc(COn2c(nc3ccc(Cl)cc23)c4ccc(OC)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P16	compound treatment	1.021	-0.046	-0.62	1.234	-0.0505	-0.69	-0.9254	-0.9987	1375498	Bionet1_000714	CCOC(=O)c1ccccc1c2csc(Nc3ccc(Cl)c(Cl)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P17	compound treatment	1.051	-0.016	-0.22	1.24	-0.0445	-0.61	-0.5814	-0.9034	1908300	Bionet1_000715	CCOC(=O)C(C)On1c(nc2ccc(cc12)[N+](=O)[O-])c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P18	compound treatment	1.024	-0.043	-0.58	1.301	0.0165	0.23	-0.2507	-0.4028	1908301	Bionet1_000716	CCOC(=O)c1ccccc1c2csc(NC(=O)c3ccc(F)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P19	compound treatment	1.113	0.046	0.62	1.278	-0.00645	-0.09	0.3765	0.6008	1908302	Bionet1_000717	[O-][N+](=O)c1ccc2nc(c3ccccc3)n(OCc4ccc(Cl)cc4)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P20	compound treatment	1.009	-0.058	-0.78	1.293	0.00855	0.12	-0.471	-0.5953	1908303	Bionet1_000718	FC(F)(F)Oc1ccc(NC(=O)c2csc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P21	compound treatment	1.057	-0.01	-0.14	1.347	0.0625	0.85	0.5076	0.5878	1599721	Bionet1_000719	COc1ccc(Oc2nc3ccccc3c4nnc(c5ccccc5F)n24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.569	P22	compound treatment	1.102	0.035	0.47	1.233	-0.0515	-0.7	-0.1624	-0.192	1908304	Bionet1_000720	Cc1nc(sc1C(=O)Nc2cccc(c2)C(F)(F)F)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A03	compound treatment	1.051	-0.0333	-0.45	1.183	-0.097	-1.32	-1.2535	-0.897	1442469	Bionet1_000721	Cc1nc(sc1C(=O)Nc2ccc(Cl)c(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A04	compound treatment	1.107	0.0227	0.31	1.263	-0.017	-0.23	0.0521	0.1358	1675922	Bionet1_000722	Cc1ccc(cc1)S(=O)(=O)CCCS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A05	compound treatment	1.051	-0.0333	-0.45	1.295	0.015	0.2	-0.1735	-0.3514	1908305	Bionet1_000723	Cc1nc(sc1C(=O)Nc2ccc(OC(F)(F)F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A06	compound treatment	1.074	-0.0103	-0.14	1.284	0.00397	0.05	-0.0602	-0.4026	1908306	Bionet1_000724	CCNc1nc(Oc2c(Cl)cccc2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A07	compound treatment	1.065	-0.0193	-0.26	1.255	-0.025	-0.34	-0.4257	-0.9912	1908307	Bionet1_000725	FC(F)(F)c1cnc(NC(=S)NC(=O)c2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A08	compound treatment	1.103	0.0187	0.25	1.337	0.057	0.78	0.7275	0.8907	1908308	Bionet1_000726	CCNc1nc(Sc2ccc(Cl)cc2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A09	compound treatment	1.064	-0.0203	-0.27	1.254	-0.026	-0.35	-0.4448	-0.9919	1908309	Bionet1_000727	[O-][N+](=O)c1cc(ccc1n2cncn2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A10	compound treatment	1.121	0.0367	0.49	1.27	-0.01	-0.14	0.2532	0.4932	1908310	Bionet1_000728	CCNc1nc(SCc2ccc(Cl)c(Cl)c2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A11	compound treatment	1.101	0.0167	0.22	1.244	-0.036	-0.49	-0.1883	-0.3485	1908311	Bionet1_000729	COc1ccc(NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cncn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A12	compound treatment	1.115	0.0307	0.41	1.291	0.011	0.15	0.3984	0.9054	1908312	Bionet1_000730	CCNc1nc(Sc2ccc(Cl)c(Cl)c2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A13	compound treatment	1.044	-0.0403	-0.54	1.291	0.011	0.15	-0.2789	-0.4942	1908313	Bionet1_000731	Cc1c(Cl)cccc1NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A14	compound treatment	1.092	0.00767	0.1	1.304	0.024	0.33	0.3044	0.8876	1908314	Bionet1_000732	CCNc1nc(Oc2cc(Cl)cc(Cl)c2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A15	compound treatment	1.062	-0.0223	-0.3	1.321	0.041	0.56	0.1821	0.2869	1908315	Bionet1_000733	FC(F)(F)c1cnc(Nc2nc(cs2)c3ccc(Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A16	compound treatment	1.069	-0.0153	-0.21	1.357	0.077	1.05	0.596	0.5571	1908316	Bionet1_000734	CCNc1nc(Oc2ccc(Cl)cc2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A17	compound treatment	1.102	0.0177	0.24	1.344	0.064	0.87	0.7855	0.8685	1600344	Bionet1_000735	CCOC(=O)c1ccccc1c2csc(NC(=O)c3ccc(OC)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A18	compound treatment	1.129	0.0447	0.6	1.318	0.038	0.52	0.7923	0.9971	1129864	Bionet1_000736	CC(C)(C)c1ccc(CS(=O)(=O)CCCS(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A19	compound treatment	1.067	-0.0173	-0.23	1.244	-0.036	-0.49	-0.5126	-0.9423	1908317	Bionet1_000737	CN(C)/C=N/C(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A20	compound treatment	1.1	0.0157	0.21	1.296	0.016	0.22	0.3036	0.9999	1908318	Bionet1_000738	CCNc1nc(SCc2ccc(cc2)C(C)(C)C)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A21	compound treatment	1.092	0.00767	0.1	1.252	-0.028	-0.38	-0.197	-0.4976	1548652	Bionet1_000739	Fc1ccc(NC(=O)c2csc(n2)c3ccc(Cl)cc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	A22	compound treatment	1.093	0.00867	0.12	1.289	0.00897	0.12	0.1693	0.9997	1908319	Bionet1_000740	FC(F)(F)c1cnc(N2CCN(CC2)C(=O)CN3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B03	compound treatment	1.099	0.0147	0.2	1.283	0.00297	0.04	0.1687	0.8347	1908320	Bionet1_000741	O=C(CCSSCCC(=O)Nc1ccccc1)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B04	compound treatment	1.039	-0.0453	-0.61	1.301	0.021	0.29	-0.2301	-0.3409	1908321	Bionet1_000742	Cc1cc(C)n(n1)c2nnc(nn2)N3CCN(CC3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B05	compound treatment	1.115	0.0307	0.41	1.252	-0.028	-0.38	0.0224	0.0397	1908322	Bionet1_000743	Cc1cc(C)cc(OC(F)(F)C(=O)Nc2cc(Cl)cc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B06	compound treatment	1.081	-0.00333	-0.04	1.282	0.00197	0.03	-0.0127	-0.2424	1603190	Bionet1_000744	O=S(=O)(C1CON(Cc2ccccc2)C1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B07	compound treatment	1.108	0.0237	0.32	1.285	0.00497	0.07	0.2738	0.8386	1908323	Bionet1_000745	Cc1cc(C)cc(OC(F)(F)C(=O)Nc2ccc(OC(F)(F)F)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B08	compound treatment	1.08	-0.00433	-0.06	1.305	0.025	0.34	0.1996	0.5775	1330374	Bionet1_000746	O=C(CON1C(=O)c2ccccc2C1=O)N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B09	compound treatment	1.069	-0.0153	-0.21	1.335	0.055	0.75	0.3839	0.4937	1908324	Bionet1_000747	COc1ccc(OC(F)(F)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B10	compound treatment	1.066	-0.0183	-0.25	1.258	-0.022	-0.3	-0.3872	-0.9953	1908325	Bionet1_000748	CC(=O)c1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B11	compound treatment	1.077	-0.00733	-0.1	1.326	0.046	0.63	0.3734	0.5884	1908326	Bionet1_000749	COC(=O)c1ccccc1NC(=O)C(F)(F)Oc2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B12	compound treatment	1.045	-0.0393	-0.53	1.286	0.00597	0.08	-0.3175	-0.5916	1908327	Bionet1_000750	C/C(=N\O)/c1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B13	compound treatment	1.104	0.0197	0.27	1.34	0.06	0.82	0.766	0.8908	1908328	Bionet1_000751	COc1ccc(OC(F)(F)C(=O)Nc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B14	compound treatment	1.081	-0.00333	-0.04	1.298	0.018	0.25	0.1416	0.5682	1908329	Bionet1_000752	Cn1cc(cc1/C=C(\C#N)/c2ccccn2)C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B15	compound treatment	1.112	0.0277	0.37	1.251	-0.029	-0.4	-0.0159	-0.0292	1908330	Bionet1_000753	COC(=O)c1ccccc1NC(=O)C(F)(F)Oc2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B16	compound treatment	1.073	-0.0113	-0.15	1.334	0.054	0.74	0.4124	0.5486	1908331	Bionet1_000754	FC(F)(F)c1cc(c2ccc(Sc3nc[nH]n3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B17	compound treatment	1.078	-0.00633	-0.09	1.282	0.00197	0.03	-0.0413	-0.4615	1908332	Bionet1_000755	CC(C)(C)c1ccc(OC(F)(F)C(=O)Nc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B18	compound treatment	1.082	-0.00233	-0.03	1.24	-0.04	-0.55	-0.4081	-0.7465	1702138	Bionet1_000756	COc1ccc(cc1OC)c2cn(nc2C)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B19	compound treatment	1.083	-0.00133	-0.02	1.336	0.056	0.76	0.5271	0.6903	1908333	Bionet1_000757	CON/C=N/C(=O)C1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B20	compound treatment	1.072	-0.0123	-0.17	1.316	0.036	0.49	0.2293	0.4427	1908334	Bionet1_000758	CO/N=C/C(C)C(=O)c1ccc2c(Br)c(OC)ccc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B21	compound treatment	1.061	-0.0233	-0.31	1.328	0.048	0.65	0.2401	0.3307	1908335	Bionet1_000759	CC(C)(C)c1ccc(OC(F)(F)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	B22	compound treatment	1.065	-0.0193	-0.26	1.271	-0.00903	-0.12	-0.2714	-0.9413	1908336	Bionet1_000760	COc1ccc(cc1OC)c2nnn3c2nc(N)c4ncc(cc43)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C03	compound treatment	1.082	-0.00233	-0.03	1.266	-0.014	-0.19	-0.1574	-0.8123	1908337	Bionet1_000761	FC(F)(F)Oc1ccc(NC(=O)c2csc(n2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C04	compound treatment	1.099	0.0147	0.2	1.303	0.023	0.31	0.3615	0.9755	1908338	Bionet1_000762	FC(F)(F)c1cnc(N2CCN(CC2)c3nc(CCl)cs3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C05	compound treatment	1.101	0.0167	0.22	1.254	-0.026	-0.35	-0.0919	-0.2187	1908339	Bionet1_000763	Fc1ccc(NC(=O)c2csc(n2)c3cccc(c3)C(F)(F)F)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C06	compound treatment	1.087	0.00267	0.04	1.287	0.00697	0.1	0.0928	0.9119	1440891	Bionet1_000764	Nc1c(C#N)c(COc2ccc(Cl)cc2Cl)nc(=O)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C07	compound treatment	1.104	0.0197	0.27	1.295	0.015	0.2	0.3321	0.9916	1908340	Bionet1_000765	FC(F)(F)c1cccc(c1)c2nc(cs2)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C08	compound treatment	1.097	0.0127	0.17	1.347	0.067	0.91	0.7667	0.8251	1908341	Bionet1_000766	Clc1ccc(Nc2nc(Cn3cncn3)nn2c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C09	compound treatment	1.1	0.0157	0.21	1.341	0.061	0.83	0.7375	0.8596	1908342	Bionet1_000767	COC(=O)c1ccc(cc1)c2nc(cs2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C10	compound treatment	1.073	-0.0113	-0.15	1.304	0.024	0.33	0.1231	0.3412	1908343	Bionet1_000768	Fc1ccc(Sc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C11	compound treatment	1.082	-0.00233	-0.03	1.313	0.033	0.45	0.2958	0.6562	1908344	Bionet1_000769	Cc1nc(sc1C(=O)Nc2ccc(F)cc2F)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C12	compound treatment	1.128	0.0437	0.59	1.355	0.075	1.02	1.1396	0.9657	1908345	Bionet1_000770	CCOC(=O)CSc1ccc(cn1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C13	compound treatment	1.061	-0.0233	-0.31	1.304	0.024	0.33	0.0087	0.0191	1538007	Bionet1_000771	O=C(Nc1ccccc1)c2ccc(cc2)c3nc(cs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C14	compound treatment	1.115	0.0307	0.41	1.338	0.058	0.79	0.8516	0.9544	1908346	Bionet1_000772	CCOC(=O)CSc1ccc(cn1)C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C15	compound treatment	1.079	-0.00533	-0.07	1.272	-0.00803	-0.11	-0.1282	-0.9792	1190182	Bionet1_000773	Fc1ccc(NC(=O)c2ccc(cc2)c3nc(cs3)c4ccccc4)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C16	compound treatment	1.104	0.0197	0.27	1.354	0.074	1.01	0.901	0.8638	1132001	Bionet1_000774	CCC(C)S(=O)(=O)c1ccc(cn1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C17	compound treatment	1.072	-0.0123	-0.17	1.37	0.09	1.23	0.75	0.6057	1908347	Bionet1_000775	CN(C)C(=O)c1ccc(cc1)c2nc(cs2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C18	compound treatment	1.078	-0.00633	-0.09	1.362	0.082	1.12	0.7301	0.6512	1134836	Bionet1_000776	Cc1ccc(Sc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C19	compound treatment	1.049	-0.0353	-0.48	1.286	0.00597	0.08	-0.2794	-0.5778	1367743	Bionet1_000777	Clc1ccc(c2csc(n2)c3ccc(cc3)C(=O)NCC=C)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C20	compound treatment	1.092	0.00767	0.1	1.267	-0.013	-0.18	-0.0524	-0.2548	1439191	Bionet1_000778	CCCCS(=O)(=O)c1ccc(cn1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C21	compound treatment	1.126	0.0417	0.56	1.299	0.019	0.26	0.5805	0.938	1599031	Bionet1_000779	Fc1ccc(NC(=O)c2ccc(cc2)c3nc(cs3)c4ccc(F)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	C22	compound treatment	1.131	0.0467	0.63	1.319	0.039	0.53	0.8211	0.9964	1908348	Bionet1_000780	Cc1ccc(Sc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D03	compound treatment	1.074	-0.0103	-0.14	1.295	0.015	0.2	0.0459	0.1856	1908349	Bionet1_000781	FC(F)(F)c1cnc(N2CCN(CC2)c3c[nH]c(=O)[nH]c3=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D04	compound treatment	1.079	-0.00533	-0.07	1.328	0.048	0.65	0.4118	0.6257	1908350	Bionet1_000782	Nc1nc2c(nnn2c3cc(cnc13)C(F)(F)F)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D05	compound treatment	1.082	-0.00233	-0.03	1.34	0.06	0.82	0.5561	0.6795	1908351	Bionet1_000783	CSc1sn(C(=O)NS(=O)(=O)c2ccc(C)cc2)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D06	compound treatment	1.033	-0.0513	-0.69	1.25	-0.03	-0.41	-0.7791	-0.9686	1908352	Bionet1_000784	Nc1nc2c(nnn2c3cc(cnc13)C(F)(F)F)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D07	compound treatment	1.102	0.0177	0.24	1.288	0.00797	0.11	0.2455	0.9368	1908353	Bionet1_000785	Cc1onc(c1C(=O)NOCCOc2ccccc2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D08	compound treatment	1.038	-0.0463	-0.62	1.259	-0.021	-0.29	-0.6447	-0.9375	1908354	Bionet1_000786	Nc1nc2c(nnn2c3cc(cnc13)C(F)(F)F)c4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D09	compound treatment	1.071	-0.0133	-0.18	1.35	0.07	0.95	0.5476	0.564	1908355	Bionet1_000787	FC(F)(F)c1cccc(OCCON2C(=O)c3ccccc3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D10	compound treatment	1.071	-0.0133	-0.18	1.246	-0.034	-0.46	-0.4552	-0.9148	1908356	Bionet1_000788	CCOC(=O)c1sc(=S)sc1SCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D11	compound treatment	1.077	-0.00733	-0.1	1.254	-0.026	-0.35	-0.3208	-0.8709	1214859	Bionet1_000789	Cc1ccc(NC(=O)N2CCOC32CCN(CC3)c4ncccn4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D12	compound treatment	1.073	-0.0113	-0.15	1.222	-0.058	-0.79	-0.6675	-0.8283	1908357	Bionet1_000790	CCOC(=O)c1sc(=S)sc1SCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D13	compound treatment	1.133	0.0487	0.66	1.264	-0.016	-0.22	0.3098	0.4477	1908358	Bionet1_000791	COc1ccc(cc1)C(=O)N2CCOC32CCN(CC3)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D14	compound treatment	1.099	0.0147	0.2	1.224	-0.056	-0.76	-0.4002	-0.5071	1130635	Bionet1_000792	CCOC(=O)c1sc(=S)sc1SCc2cccc(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D15	compound treatment	1.033	-0.0513	-0.69	1.274	-0.00603	-0.08	-0.5477	-0.7855	1723867	Bionet1_000793	Clc1ccc(C(=O)N2CCOC32CCN(CC3)c4ncccn4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D16	compound treatment	1.076	-0.00833	-0.11	1.317	0.037	0.5	0.2771	0.5364	1355653	Bionet1_000794	Clc1ccc(COc2ccsc2NC(=O)Nc3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D17	compound treatment	1.111	0.0267	0.36	1.244	-0.036	-0.49	-0.0929	-0.1526	1253955	Bionet1_000795	COc1ccc(cc1)C(=O)N2CCOC32CCN(CC3)c4ncccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D18	compound treatment	1.104	0.0197	0.27	1.286	0.00597	0.08	0.2453	0.8835	1908359	Bionet1_000796	CN(C)c1nnc(o1)/C(=C/c2cc(cn2C)C(=O)c3cccc(Cl)c3)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D19	compound treatment	1.087	0.00267	0.04	1.319	0.039	0.53	0.4013	0.7534	1908360	Bionet1_000797	COc1ccc(N/C=C(\C#N)/C(=O)N/C=N/OCc2ccc(cc2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D20	compound treatment	1.096	0.0117	0.16	1.31	0.03	0.41	0.4004	0.9141	1908361	Bionet1_000798	Cn1cc(cc1/C=C(\C#N)/C(=O)c2ccccc2)C(=O)c3c(F)cccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D21	compound treatment	1.077	-0.00733	-0.1	1.239	-0.041	-0.56	-0.4655	-0.8193	1908362	Bionet1_000799	FC(F)(F)c1cccc(c1)N2CCN(CC2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	D22	compound treatment	1.035	-0.0493	-0.67	1.295	0.015	0.2	-0.3261	-0.4686	1908363	Bionet1_000800	COC(=O)c1c(N)sc2CN(CCc12)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E03	compound treatment	1.064	-0.0203	-0.27	1.304	0.024	0.33	0.0373	0.0874	1908364	Bionet1_000801	N/C(=N\NC(=O)c1ccc(Cl)cc1)/CSc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E04	compound treatment	1.065	-0.0193	-0.26	1.323	0.043	0.59	0.23	0.3586	1669123	Bionet1_000802	Cc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E05	compound treatment	1.069	-0.0153	-0.21	1.272	-0.00803	-0.11	-0.2236	-0.9557	1908365	Bionet1_000803	N/C(=N\NC(=O)c1ccc(Cl)cc1)/COc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E06	compound treatment	1.085	6.74E-4	0.01	1.298	0.018	0.25	0.1798	0.7328	1146305	Bionet1_000804	Cc1ccc(Sc2ccc(NC(=O)c3c(F)cccc3F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E07	compound treatment	1.102	0.0177	0.24	1.31	0.03	0.41	0.4576	0.9671	1908366	Bionet1_000805	Cc1c(Cl)cccc1NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E08	compound treatment	1.117	0.0327	0.44	1.321	0.041	0.56	0.7068	0.9931	1528774	Bionet1_000806	Fc1ccc(Sc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E09	compound treatment	1.121	0.0367	0.49	1.281	9.75E-4	0.01	0.3592	0.7258	1908367	Bionet1_000807	COc1ccc(NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cncn3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E10	compound treatment	1.112	0.0277	0.37	1.339	0.059	0.8	0.8327	0.9391	1482424	Bionet1_000808	Clc1ccc(cc1Cl)c2ccnc3nc(nn23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E11	compound treatment	1.092	0.00767	0.1	1.26	-0.02	-0.27	-0.1199	-0.4105	1908368	Bionet1_000809	COc1ccc(NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cccn3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E12	compound treatment	1.07	-0.0143	-0.19	1.336	0.056	0.76	0.4031	0.5119	1433181	Bionet1_000810	CC(Oc1ccc(Cl)cc1Cl)c2ccnc3nc(nn23)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E13	compound treatment	1.066	-0.0183	-0.25	1.302	0.022	0.3	0.0371	0.0954	1908369	Bionet1_000811	COc1ccc(NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3cccn3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E14	compound treatment	1.068	-0.0163	-0.22	1.29	0.00997	0.14	-0.0596	-0.2301	1681221	Bionet1_000812	C1CN(CCN1c2nc3nccc(c4ccccc4)n3n2)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E15	compound treatment	1.076	-0.00833	-0.11	1.309	0.029	0.4	0.2	0.4868	1908370	Bionet1_000813	CCOC(=O)c1c(NC(=O)Nc2ccc(Cl)cc2)[nH]cc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E16	compound treatment	1.088	0.00367	0.05	1.257	-0.023	-0.31	-0.187	-0.5882	1733643	Bionet1_000814	COc1ccc(cc1)c2ccnc3nc(nn23)N4CCN(CC4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E17	compound treatment	1.104	0.0197	0.27	1.315	0.035	0.48	0.5249	0.9617	1369019	Bionet1_000815	Brc1ccc(NC(=O)c2csc(n2)c3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E18	compound treatment	1.077	-0.00733	-0.1	1.333	0.053	0.72	0.4409	0.6047	1681135	Bionet1_000816	Fc1ccc(cc1)c2ccnc3nc(nn23)N4CCN(CC4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E19	compound treatment	1.11	0.0257	0.35	1.283	0.00297	0.04	0.2736	0.7846	1908371	Bionet1_000817	Cc1nc(sc1C(=O)Nc2cccc(c2)C(F)(F)F)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E20	compound treatment	1.131	0.0467	0.63	1.329	0.049	0.67	0.9175	0.9996	1908372	Bionet1_000818	Fc1ccc(cc1)c2ccnc3nc(SCc4c(F)cccc4Cl)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E21	compound treatment	1.125	0.0407	0.55	1.332	0.052	0.71	0.8892	0.992	1908373	Bionet1_000819	Cc1nc(sc1C(=O)Nc2ccc(cc2)C(F)(F)F)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	E22	compound treatment	1.122	0.0377	0.51	1.279	-0.00103	-0.01	0.3495	0.6874	1908374	Bionet1_000820	Fc1cccc(Cl)c1CSc2nc3nccc(/C=C\c4ccccc4)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F03	compound treatment	1.079	-0.00533	-0.07	1.278	-0.00203	-0.03	-0.0703	-0.9137	1908375	Bionet1_000821	CN(C)c1nc(cc(n1)C(F)(F)F)N2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F04	compound treatment	1.06	-0.0243	-0.33	1.228	-0.052	-0.71	-0.7337	-0.9386	1908376	Bionet1_000822	Nc1sc2CN(CCc2c1C#N)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F05	compound treatment	1.093	0.00867	0.12	1.313	0.033	0.45	0.4007	0.8624	1908377	Bionet1_000823	CN(C)c1nc(cc(n1)C(F)(F)F)N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F06	compound treatment	1.077	-0.00733	-0.1	1.221	-0.059	-0.8	-0.639	-0.788	1908378	Bionet1_000824	Cn1c(CNS(=O)(=O)c2ccc(Cl)cc2)nnc1SCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F07	compound treatment	1.083	-0.00133	-0.02	1.221	-0.059	-0.8	-0.5818	-0.7226	1908379	Bionet1_000825	CN(C)c1nc(cc(n1)C(F)(F)F)N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F08	compound treatment	1.083	-0.00133	-0.02	1.315	0.035	0.48	0.3246	0.6801	1168738	Bionet1_000826	COC(=O)CSc1nnc(CNS(=O)(=O)c2ccc(Cl)cc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F09	compound treatment	1.064	-0.0203	-0.27	1.269	-0.011	-0.15	-0.3002	-0.96	1297873	Bionet1_000827	Clc1ccc(cc1Cl)N2CCN(CC2)c3nnnn3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F10	compound treatment	1.052	-0.0323	-0.44	1.251	-0.029	-0.4	-0.5882	-0.9988	1908380	Bionet1_000828	CSc1nnc(CNS(=O)(=O)c2ccc(Br)cc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F11	compound treatment	1.099	0.0147	0.2	1.271	-0.00903	-0.12	0.053	0.2272	1229343	Bionet1_000829	Clc1ccc(cc1Cl)N2CCN(CC2)c3cnc4ccccc4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F12	compound treatment	1.048	-0.0363	-0.49	1.205	-0.075	-1.02	-1.0699	-0.9432	1666889	Bionet1_000830	CCC(C)Sc1nnc(CNS(=O)(=O)c2ccc(F)cc2)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F13	compound treatment	1.102	0.0177	0.24	1.265	-0.015	-0.2	0.0237	0.0755	1908381	Bionet1_000831	Cn1nc(c(C#N)c1N2CCN(CC2)c3ccc(F)cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F14	compound treatment	1.085	6.74E-4	0.01	1.246	-0.034	-0.46	-0.3217	-0.6931	1908382	Bionet1_000832	[O-][N+](=O)c1ccc(cc1)N2CCc3nn(cc3C2)c4cccc(Cl)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F15	compound treatment	1.096	0.0117	0.16	1.29	0.00997	0.14	0.2075	0.9973	1908383	Bionet1_000833	Cn1nc(c(C#N)c1N2CCN(CC2)c3ccccc3F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F16	compound treatment	1.075	-0.00933	-0.13	1.269	-0.011	-0.15	-0.1953	-0.9961	1908384	Bionet1_000834	COc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F17	compound treatment	1.09	0.00567	0.08	1.288	0.00797	0.11	0.131	0.9852	1908385	Bionet1_000835	COc1cccc(c1)N2CCN(CC2)c3c(C#N)c(nn3C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F18	compound treatment	1.073	-0.0113	-0.15	1.204	-0.076	-1.04	-0.8411	-0.8027	1908386	Bionet1_000836	COc1ccc(NC(=O)CS(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F19	compound treatment	1.067	-0.0173	-0.23	1.271	-0.00903	-0.12	-0.2523	-0.9551	1908387	Bionet1_000837	CCOC(=O)NC(=O)c1cn(OCc2ccc(Cl)cc2)c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F20	compound treatment	1.089	0.00467	0.06	1.267	-0.013	-0.18	-0.081	-0.4298	1908388	Bionet1_000838	COc1ccc(NC(=O)CS(=O)c2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F21	compound treatment	1.076	-0.00833	-0.11	1.289	0.00897	0.12	0.0071	0.0428	1908389	Bionet1_000839	FC(F)(F)c1cccc(c1)C(=O)OCCn2cc(C#N)c(=O)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	F22	compound treatment	1.024	-0.0603	-0.81	1.232	-0.048	-0.65	-1.0385	-0.9942	1908390	Bionet1_000840	COc1ccc(NC(=O)CS(=O)(=O)c2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G03	compound treatment	1.079	-0.00533	-0.07	1.249	-0.031	-0.42	-0.35	-0.8155	1908391	Bionet1_000841	COC(=O)c1ccc(cc1)c2nc(cs2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G04	compound treatment	1.105	0.0207	0.28	1.311	0.031	0.42	0.4959	0.9797	1908392	Bionet1_000842	Fc1cccc(Cl)c1CSc2nc3nccc(c4ccccn4)n3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G05	compound treatment	1.082	-0.00233	-0.03	1.248	-0.032	-0.44	-0.331	-0.756	1908393	Bionet1_000843	Cc1nc(sc1C(=O)Nc2ccc(Br)cc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G06	compound treatment	1.114	0.0297	0.4	1.302	0.022	0.3	0.495	0.9898	1908394	Bionet1_000844	C(Sc1nc2nccc(/C=C\c3ccccc3)n2n1)/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G07	compound treatment	1.062	-0.0223	-0.3	1.266	-0.014	-0.19	-0.3482	-0.976	1353051	Bionet1_000845	CCOC(=O)c1cc([nH]c1N2CCN(CC2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G08	compound treatment	1.077	-0.00733	-0.1	1.276	-0.00403	-0.05	-0.1087	-0.9615	1908395	Bionet1_000846	Fc1ccc(cc1)c2ccnc3nc(SC/C=C/c4ccccc4)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G09	compound treatment	1.083	-0.00133	-0.02	1.322	0.042	0.57	0.3921	0.6847	1599578	Bionet1_000847	COc1ccc(cc1)N2CCN(CC2)c3[nH]c(cc3C#N)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G10	compound treatment	1.094	0.00967	0.13	1.268	-0.012	-0.16	-0.0237	-0.1129	1908396	Bionet1_000848	COc1ccc(cc1)c2cnc3nc(SC/C=C/c4ccccc4)nn3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G11	compound treatment	1.086	0.00167	0.02	1.259	-0.021	-0.29	-0.1868	-0.6494	1908397	Bionet1_000849	Cc1nc(sc1C(=O)Nc2ccc(OC(F)(F)F)cc2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G12	compound treatment	1.132	0.0477	0.64	1.316	0.036	0.49	0.8017	0.9911	1908398	Bionet1_000850	Nc1c(cnc2nc(SC/C=C/c3ccccc3)nn12)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G13	compound treatment	1.106	0.0217	0.29	1.275	-0.00503	-0.07	0.1583	0.5271	1908399	Bionet1_000851	CNC(=O)c1ccc(cc1)c2nc(cs2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G14	compound treatment	1.097	0.0127	0.17	1.306	0.026	0.35	0.3714	0.9442	1908400	Bionet1_000852	COc1ccc(cc1)c2ccnc3nc(SC/C=C/c4ccccc4)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G15	compound treatment	1.135	0.0507	0.68	1.261	-0.019	-0.26	0.2999	0.4102	1908401	Bionet1_000853	FC(F)(F)c1cccc(c1)c2csc(n2)c3ccc(cc3)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G16	compound treatment	1.104	0.0197	0.27	1.302	0.022	0.3	0.3996	0.9982	1908402	Bionet1_000854	CN(C)/C=C/C(=O)c1cccc(Oc2ncc(cc2Cl)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G17	compound treatment	1.14	0.0557	0.75	1.272	-0.00803	-0.11	0.4537	0.5978	1179349	Bionet1_000855	CCOC(=O)c1cc([nH]c1N2CCOCC2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G18	compound treatment	1.101	0.0167	0.22	1.291	0.011	0.15	0.2649	0.9804	1908403	Bionet1_000856	CO/N=C/C(=C\Nc1ccc(Cl)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G19	compound treatment	1.072	-0.0123	-0.17	1.234	-0.046	-0.63	-0.5614	-0.8646	1152475	Bionet1_000857	Clc1ccc(cc1)c2csc(n2)c3ccc(cc3)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G20	compound treatment	1.05	-0.0343	-0.46	1.286	0.00597	0.08	-0.2698	-0.5739	1908404	Bionet1_000858	FC(F)(F)c1cccc(N/C=C/c2ncc(cc2Cl)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G21	compound treatment	1.11	0.0257	0.35	1.344	0.064	0.87	0.8618	0.9181	1908405	Bionet1_000859	CN(C)CCCNC(=O)c1ccc(cc1)c2nc(cs2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	G22	compound treatment	1.109	0.0247	0.33	1.361	0.081	1.1	1.0162	0.8811	1908406	Bionet1_000860	FC(F)(F)c1cnc(C/C=N\OCc2c(Cl)cccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H03	compound treatment	1.069	-0.0153	-0.21	1.28	-2.51E-5	0.0	-0.1464	-0.7083	1908407	Bionet1_000861	C/C(=N\Nc1ncc(cc1Cl)C(F)(F)F)/c2cn(C)c(=O)n(C)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H04	compound treatment	1.028	-0.0563	-0.76	1.232	-0.048	-0.65	-1.0004	-0.9973	1908408	Bionet1_000862	COc1ccc(NC(=O)CSc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H05	compound treatment	1.102	0.0177	0.24	1.319	0.039	0.53	0.5444	0.9346	1197912	Bionet1_000863	COc1ccc(cc1)n2cc(C#N)c(=O)n(Cc3ccc(F)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H06	compound treatment	1.043	-0.0413	-0.56	1.243	-0.037	-0.5	-0.7512	-0.9988	1908409	Bionet1_000864	COc1ccc(NC(=O)CS(=O)(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H07	compound treatment	1.11	0.0257	0.35	1.253	-0.027	-0.37	-0.0157	-0.031	1908410	Bionet1_000865	CN(c1ncc(cc1Cl)C(F)(F)F)n2cc(C(=O)C)c(=O)[nH]c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H08	compound treatment	1.072	-0.0123	-0.17	1.246	-0.034	-0.46	-0.4457	-0.9042	1908411	Bionet1_000866	Clc1ccc(NC(=O)C/C=N\OCc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H09	compound treatment	1.104	0.0197	0.27	1.303	0.023	0.31	0.4092	0.9966	1908412	Bionet1_000867	CC(=O)c1cn(CCNc2ncc(cc2Cl)C(F)(F)F)c(=O)[nH]c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H10	compound treatment	1.103	0.0187	0.25	1.265	-0.015	-0.2	0.0333	0.1024	1908413	Bionet1_000868	Clc1ccc(NC(=O)C/C=N\OCc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H11	compound treatment	1.058	-0.0263	-0.36	1.313	0.033	0.45	0.0668	0.1166	1908414	Bionet1_000869	CN1CCN(CC1)n2cc(C(=O)C)c(=O)n(Cc3ccc(F)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H12	compound treatment	1.091	0.00667	0.09	1.292	0.012	0.16	0.1791	0.9606	1908415	Bionet1_000870	[O-][N+](=O)c1ccc(CO/N=C\CC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H13	compound treatment	1.052	-0.0323	-0.44	1.289	0.00897	0.12	-0.2218	-0.4897	1908416	Bionet1_000871	CC(=O)c1cn(Cc2ccccc2)c(=O)n(Cc3ccc(F)cc3)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H14	compound treatment	1.069	-0.0153	-0.21	1.404	0.124	1.69	1.0492	0.616	1908417	Bionet1_000872	Clc1ccc(NC(=O)C/C=N\OC(=O)Nc2ccccc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H15	compound treatment	1.086	0.00167	0.02	1.293	0.013	0.18	0.1411	0.7909	1908418	Bionet1_000873	CC(=O)c1cn(c2ccc(Cl)cc2)c(=O)n(Cc3ccc(F)cc3)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H16	compound treatment	1.051	-0.0333	-0.45	1.275	-0.00503	-0.07	-0.3664	-0.8056	1908419	Bionet1_000874	Clc1ccc(NC(=O)C/C=N\OCc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H17	compound treatment	1.052	-0.0323	-0.44	1.292	0.012	0.16	-0.1929	-0.4142	1908420	Bionet1_000875	Cn1c(=O)c(C#N)cn(CCNc2ncc(cc2Cl)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H18	compound treatment	1.078	-0.00633	-0.09	1.278	-0.00203	-0.03	-0.0799	-0.8905	1908421	Bionet1_000876	[O-][N+](=O)c1ccc(CO/N=C\CC(=O)Nc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H19	compound treatment	1.096	0.0117	0.16	1.255	-0.025	-0.34	-0.1299	-0.3457	1908422	Bionet1_000877	FC(F)(F)c1cnc(NCCn2cc(C#N)c(=O)[nH]c2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H20	compound treatment	1.066	-0.0183	-0.25	1.221	-0.059	-0.8	-0.744	-0.8836	1908423	Bionet1_000878	Fc1ccc(NC(=O)C/C=N\OCc2ccc(Cl)cc2Cl)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H21	compound treatment	1.107	0.0227	0.31	1.281	9.75E-4	0.01	0.2257	0.7371	1908424	Bionet1_000879	CCOC(=O)NC(=O)/C(=C\NNc1ncc(cc1Cl)C(F)(F)F)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	H22	compound treatment	1.051	-0.0333	-0.45	1.286	0.00597	0.08	-0.2603	-0.5697	1908425	Bionet1_000880	Fc1ccc(NC(=O)C/C=N\OCc2ccc(Cl)c(Cl)c2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I03	compound treatment	1.082	-0.00233	-0.03	1.325	0.045	0.61	0.4115	0.6701	1153565	Bionet1_000881	CNC(=O)c1ccc(cc1)c2nc(cs2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I04	compound treatment	1.078	-0.00633	-0.09	1.288	0.00797	0.11	0.0166	0.1197	1908426	Bionet1_000882	FC(F)(F)c1cnc(/C=C/Nc2ccccc2Oc3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I05	compound treatment	1.063	-0.0213	-0.29	1.261	-0.019	-0.26	-0.3869	-0.9987	1317106	Bionet1_000883	Clc1ccc(cc1Cl)c2csc(n2)c3ccc(cc3)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I06	compound treatment	1.079	-0.00533	-0.07	1.283	0.00297	0.04	-0.0221	-0.2681	1908427	Bionet1_000884	CO/N=C/C(=C\Nc1ccccc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I07	compound treatment	1.066	-0.0183	-0.25	1.206	-0.074	-1.01	-0.8886	-0.855	1908428	Bionet1_000885	CCOC(=O)c1cc([nH]c1NNC(=O)c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I08	compound treatment	1.132	0.0477	0.64	1.3	0.02	0.27	0.6474	0.9269	1908429	Bionet1_000886	CO/N=C/C(=C\Nc1ccc(F)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I09	compound treatment	1.042	-0.0423	-0.57	1.276	-0.00403	-0.05	-0.4426	-0.7715	1601031	Bionet1_000887	CCOC(=O)c1cc([nH]c1Nc2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I10	compound treatment	1.086	0.00167	0.02	1.313	0.033	0.45	0.3339	0.7417	1908430	Bionet1_000888	CO/N=C/C(=C\Nc1ccc(OC)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I11	compound treatment	1.119	0.0347	0.47	1.271	-0.00903	-0.12	0.2437	0.5039	1908431	Bionet1_000889	CCOC(=O)c1cc([nH]c1Nc2ccc(C)cc2)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I12	compound treatment	1.052	-0.0323	-0.44	1.303	0.023	0.31	-0.0868	-0.1617	1908432	Bionet1_000890	FC(F)(F)c1cnc(C(C#N)c2c(Cl)cccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I13	compound treatment	1.103	0.0187	0.25	1.32	0.04	0.55	0.5636	0.9385	1266304	Bionet1_000891	O=C(c1cc(C#N)c([nH]1)N2CCN(CC2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I14	compound treatment	1.104	0.0197	0.27	1.277	-0.00303	-0.04	0.1585	0.5901	1908433	Bionet1_000892	COc1ccc(cc1OC)C(C#N)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I15	compound treatment	1.061	-0.0233	-0.31	1.325	0.045	0.61	0.2112	0.3063	1908434	Bionet1_000893	CCOC(=O)C(=CNc1c[nH]c(C)c1C(=O)c2ccccc2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I16	compound treatment	1.13	0.0457	0.62	1.306	0.026	0.35	0.6862	0.9654	1908435	Bionet1_000894	NC(=O)C(c1cccc(c1)C(F)(F)F)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I17	compound treatment	1.087	0.00267	0.04	1.308	0.028	0.38	0.2953	0.7705	1908436	Bionet1_000895	CCOC(=O)C(=CNc1cn(C)c(C)c1C(=O)c2ccccc2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I18	compound treatment	1.112	0.0277	0.37	1.194	-0.086	-1.17	-0.5655	-0.4594	1908437	Bionet1_000896	COc1ccc(cc1OC)C(C(=O)N)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I19	compound treatment	1.06	-0.0243	-0.33	1.315	0.035	0.48	0.1052	0.1817	1430706	Bionet1_000897	O=C(c1cc(C#N)c([nH]1)N2CCN(CC2)c3ccccn3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I20	compound treatment	1.124	0.0397	0.54	1.336	0.056	0.76	0.9182	0.9849	1908438	Bionet1_000898	FC(F)(F)c1cnc(C(C#N)c2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I21	compound treatment	1.077	-0.00733	-0.1	1.369	0.089	1.21	0.788	0.6474	1710693	Bionet1_000899	CCOC(=O)c1cc([nH]c1Nc2ccc(Cl)cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	I22	compound treatment	1.098	0.0137	0.18	1.321	0.041	0.56	0.5255	0.8931	1908439	Bionet1_000900	NC(=O)C(c1ncc(cc1Cl)C(F)(F)F)c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J03	compound treatment	1.099	0.0147	0.2	1.33	0.05	0.68	0.6219	0.8763	1908440	Bionet1_000901	Cn1c(ccc1/C(=C/c2ccc(Cl)cc2)/C#N)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J04	compound treatment	1.095	0.0107	0.14	1.271	-0.00903	-0.12	0.0148	0.0781	1908441	Bionet1_000902	Fc1ccc(NC(=O)C/C=N\OCc2c(Cl)cccc2Cl)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J05	compound treatment	1.086	0.00167	0.02	1.307	0.027	0.37	0.2761	0.7491	1908442	Bionet1_000903	COC(=O)C(NS(=O)(=O)c1cccc(c1)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J06	compound treatment	1.057	-0.0273	-0.37	1.191	-0.089	-1.21	-1.1191	-0.8821	1908443	Bionet1_000904	CSc1nc(NC(=O)C/C=N\OCc2ccc(cc2)[N+](=O)[O-])nn1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J07	compound treatment	1.094	0.00967	0.13	1.25	-0.03	-0.41	-0.1972	-0.459	1514688	Bionet1_000905	CS(=O)(=O)c1ccc(C(=O)Nc2ccc(cc2)N3CCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J08	compound treatment	1.07	-0.0143	-0.19	1.278	-0.00203	-0.03	-0.1562	-0.8	1908444	Bionet1_000906	Clc1ccc(cc1)S(=O)(=O)C/C=N/OCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J09	compound treatment	1.075	-0.00933	-0.13	1.256	-0.024	-0.33	-0.3206	-0.9136	1151626	Bionet1_000907	CCCCC(=O)Nc1ccc(cc1)N2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J10	compound treatment	1.067	-0.0173	-0.23	1.208	-0.072	-0.98	-0.8598	-0.8516	1908445	Bionet1_000908	Clc1ccc(OC(=O)C/C=N\OCc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J11	compound treatment	1.101	0.0167	0.22	1.262	-0.018	-0.25	-0.0147	-0.0443	1908446	Bionet1_000909	FC(F)(F)c1cccc(c1)C(=O)Nc2ccccc2N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J12	compound treatment	1.086	0.00167	0.02	1.179	-0.101	-1.38	-0.9582	-0.6954	1908447	Bionet1_000910	COc1ccc(OC(=O)C/C=N\OCc2c(Cl)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J13	compound treatment	1.106	0.0217	0.29	1.271	-0.00903	-0.12	0.1197	0.3774	1418952	Bionet1_000911	CS(=O)(=O)c1ccc(C(=O)Nc2ccccc2N3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J14	compound treatment	1.101	0.0167	0.22	1.187	-0.093	-1.27	-0.7379	-0.5728	1908448	Bionet1_000912	Clc1ccc(cc1)c2nnc(COc3ccc(Cl)cc3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J15	compound treatment	1.079	-0.00533	-0.07	1.248	-0.032	-0.44	-0.3596	-0.8125	1908449	Bionet1_000913	Cc1nc(nn1c2ccc(cc2)[N+](=O)[O-])C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J16	compound treatment	1.085	6.74E-4	0.01	1.201	-0.079	-1.08	-0.7556	-0.7011	1908450	Bionet1_000914	CC(C)(N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F)C(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J17	compound treatment	1.1	0.0157	0.21	1.295	0.015	0.2	0.2939	0.9998	1349482	Bionet1_000915	Cc1nc(nn1c2ccc(Cl)cc2)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J18	compound treatment	1.043	-0.0413	-0.56	1.259	-0.021	-0.29	-0.597	-0.9522	1908451	Bionet1_000916	COc1cccc2C=C(COc12)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J19	compound treatment	1.124	0.0397	0.54	1.292	0.012	0.16	0.4939	0.8827	1908452	Bionet1_000917	Cc1nc(nn1c2ccc(cc2)[N+](=O)[O-])C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J20	compound treatment	1.065	-0.0193	-0.26	1.234	-0.046	-0.63	-0.6281	-0.9243	1908453	Bionet1_000918	COc1cccc2C=C(COc12)C(=O)Nc3ccc(OC(F)(F)F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J21	compound treatment	1.102	0.0177	0.24	1.348	0.068	0.93	0.824	0.861	1908454	Bionet1_000919	Cc1nc(nn1c2ccc(cc2)[N+](=O)[O-])C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	J22	compound treatment	1.081	-0.00333	-0.04	1.241	-0.039	-0.53	-0.408	-0.764	1908455	Bionet1_000920	COc1cccc2C=C(COc12)C(=O)NCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K03	compound treatment	1.073	-0.0113	-0.15	1.281	9.75E-4	0.01	-0.0986	-0.6432	1908456	Bionet1_000921	Cn1nc(c(CO)c1Sc2ccc(Br)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K04	compound treatment	1.108	0.0237	0.32	1.279	-0.00103	-0.01	0.2159	0.6755	1908457	Bionet1_000922	NC(=O)C(c1ccc(Cl)cc1Cl)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K05	compound treatment	1.055	-0.0293	-0.4	1.27	-0.01	-0.14	-0.3764	-0.8993	1908458	Bionet1_000923	CC(=O)OCc1c(nn(C)c1S(=O)(=O)c2ccc(Cl)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K06	compound treatment	1.081	-0.00333	-0.04	1.328	0.048	0.65	0.4309	0.6571	1908459	Bionet1_000924	FC(F)(F)c1cnc(N2CCC(CC2)C(=O)N3CCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K07	compound treatment	1.059	-0.0253	-0.34	1.238	-0.042	-0.57	-0.6468	-0.9695	1908460	Bionet1_000925	Cn1nc(c(CO)c1S(=O)(=O)c2ccc(Cl)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K08	compound treatment	1.121	0.0367	0.49	1.286	0.00597	0.08	0.4075	0.8126	1908461	Bionet1_000926	FC(F)(F)c1cnc(N2CCC(CC2)C(=O)N3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K09	compound treatment	1.041	-0.0433	-0.58	1.256	-0.024	-0.33	-0.645	-0.9626	1908462	Bionet1_000927	Cn1nc(c(CO)c1S(=O)(=O)c2ccc(Br)cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K10	compound treatment	1.114	0.0297	0.4	1.312	0.032	0.44	0.5914	0.9991	1908463	Bionet1_000928	FC(F)(F)c1cnc(N2CCC(CC2)C(=O)N3CCCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K11	compound treatment	1.095	0.0107	0.14	1.278	-0.00203	-0.03	0.0823	0.5613	1908464	Bionet1_000929	Cc1ccnc(N/C=C(/NC(=O)c2ccccc2)\C(=O)N/N=C\c3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K12	compound treatment	1.087	0.00267	0.04	1.26	-0.02	-0.27	-0.1676	-0.6084	1908465	Bionet1_000930	CN(CCO)C(=O)C1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K13	compound treatment	1.075	-0.00933	-0.13	1.27	-0.01	-0.14	-0.1856	-0.9991	1908466	Bionet1_000931	FC(F)(F)c1cnc(CON2C(=O)c3ccccc3C2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K14	compound treatment	1.121	0.0367	0.49	1.333	0.053	0.72	0.8607	0.983	1908467	Bionet1_000932	CN1CCN(CC1)C(=O)C2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K15	compound treatment	1.092	0.00767	0.1	1.321	0.041	0.56	0.4683	0.8241	1908468	Bionet1_000933	Cn1c(SCc2ccccc2)nnc1c3csc(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K16	compound treatment	1.137	0.0527	0.71	1.341	0.061	0.83	1.0904	0.9969	1378992	Bionet1_000934	Cc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)c3c(F)cccc3F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K17	compound treatment	1.109	0.0247	0.33	1.277	-0.00303	-0.04	0.2062	0.6148	1908469	Bionet1_000935	Clc1ccc(CSc2nnc(o2)c3csc(n3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K18	compound treatment	1.099	0.0147	0.2	1.309	0.029	0.4	0.4194	0.9489	1908470	Bionet1_000936	Fc1ccc(cc1)C(=O)Nc2ccc(Sc3cccc(c3)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K19	compound treatment	1.083	-0.00133	-0.02	1.219	-0.061	-0.83	-0.6011	-0.7221	1908471	Bionet1_000937	CN(C)c1nc(Sc2ccc(Cl)c(Cl)c2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K20	compound treatment	1.117	0.0327	0.44	1.39	0.11	1.5	1.3721	0.8778	1908472	Bionet1_000938	COC(=O)/C(=C\Nc1ccc(Cl)cc1Cl)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K21	compound treatment	1.11	0.0257	0.35	1.314	0.034	0.46	0.5725	0.9897	1908473	Bionet1_000939	CN(C)c1nc(Sc2ccc(Br)cc2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	K22	compound treatment	1.137	0.0527	0.71	1.33	0.05	0.68	0.9844	0.9998	1908474	Bionet1_000940	COC(=O)/C(=C\Nc1ccc(OC)cc1)/NC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L03	compound treatment	1.098	0.0137	0.18	1.238	-0.042	-0.57	-0.2748	-0.4564	1908475	Bionet1_000941	COc1ccc(NC(=O)c2nc(C)n(n2)c3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L04	compound treatment	1.076	-0.00833	-0.11	1.269	-0.011	-0.15	-0.1857	-0.9897	1908476	Bionet1_000942	COc1ccc2OCC(=Cc2c1)C(=O)NCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L05	compound treatment	1.097	0.0127	0.17	1.242	-0.038	-0.52	-0.2458	-0.4501	1908477	Bionet1_000943	Clc1ccc(CC(=O)c2c[nH]c(c2)C(=O)C(Cl)(Cl)Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L06	compound treatment	1.081	-0.00333	-0.04	1.237	-0.043	-0.59	-0.4466	-0.759	1908478	Bionet1_000944	Cc1ccc(cc1)n2cc3CN(CCc3n2)c4ncc(cc4Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L07	compound treatment	1.082	-0.00233	-0.03	1.23	-0.05	-0.68	-0.5046	-0.7389	1908479	Bionet1_000945	CCOC(=O)c1c(N)onc1OCCOC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L08	compound treatment	1.032	-0.0523	-0.71	1.229	-0.051	-0.7	-0.9912	-1.0	1908480	Bionet1_000946	CSc1nnc(CNS(=O)(=O)c2ccc(Cl)cc2)n1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L09	compound treatment	1.098	0.0137	0.18	1.286	0.00597	0.08	0.1881	0.9325	1908481	Bionet1_000947	CCOC(=O)c1c(N)onc1OCCOC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L10	compound treatment	1.101	0.0167	0.22	1.251	-0.029	-0.4	-0.1208	-0.2654	1908482	Bionet1_000948	Clc1ccc(cc1)S(=O)(=O)NCc2nnc(SCC=C)n2CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L11	compound treatment	1.08	-0.00433	-0.06	1.281	9.75E-4	0.01	-0.0319	-0.5324	1908483	Bionet1_000949	FC(F)(F)c1cnc(NCCNC2=CC(=O)c3ccccc3C2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L12	compound treatment	1.044	-0.0403	-0.54	1.284	0.00397	0.05	-0.3464	-0.6335	1908484	Bionet1_000950	CCn1c(SCC=C)nnc1C(C)NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L13	compound treatment	1.053	-0.0313	-0.42	1.318	0.038	0.52	0.0673	0.1007	1908485	Bionet1_000951	CCOC(=O)c1c(N)onc1OCCOC(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L14	compound treatment	1.096	0.0117	0.16	1.198	-0.082	-1.12	-0.6796	-0.6016	1908486	Bionet1_000952	CCn1c(SC)nnc1C(C)NS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L15	compound treatment	1.028	-0.0563	-0.76	1.256	-0.024	-0.33	-0.769	-0.9293	1631585	Bionet1_000953	CC(C)CC(NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc2ccc(C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L16	compound treatment	1.074	-0.0103	-0.14	1.256	-0.024	-0.33	-0.3302	-0.9274	1908487	Bionet1_000954	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L17	compound treatment	1.087	0.00267	0.04	1.284	0.00397	0.05	0.0638	0.9804	1479836	Bionet1_000955	CC(NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc2ccc(C)c(C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L18	compound treatment	1.026	-0.0583	-0.79	1.223	-0.057	-0.78	-1.1063	-1.0	1908488	Bionet1_000956	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L19	compound treatment	1.104	0.0197	0.27	1.284	0.00397	0.05	0.226	0.8343	1177965	Bionet1_000957	CC(NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L20	compound treatment	1.077	-0.00733	-0.1	1.223	-0.057	-0.78	-0.6197	-0.7906	1908489	Bionet1_000958	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L21	compound treatment	1.075	-0.00933	-0.13	1.247	-0.033	-0.45	-0.4074	-0.8713	1383336	Bionet1_000959	CC(C)C(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	L22	compound treatment	1.072	-0.0123	-0.17	1.236	-0.044	-0.6	-0.5421	-0.8702	1908490	Bionet1_000960	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M03	compound treatment	1.098	0.0137	0.18	1.297	0.017	0.23	0.2941	0.9937	1908491	Bionet1_000961	CN(C)c1nc(Oc2cccc(Cl)c2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M04	compound treatment	1.08	-0.00433	-0.06	1.306	0.026	0.35	0.2092	0.5827	1908492	Bionet1_000962	COC(=O)/C(=C\Nc1ccccc1)/NC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M05	compound treatment	1.083	-0.00133	-0.02	1.285	0.00497	0.07	0.0353	0.5034	1908493	Bionet1_000963	CN(C)c1nc(Oc2c(Cl)cccc2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M06	compound treatment	1.146	0.0617	0.83	1.277	-0.00303	-0.04	0.5592	0.6712	1908494	Bionet1_000964	COC(=O)/C(=C\Nc1ccc(OC)cc1)/NC(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M07	compound treatment	1.081	-0.00333	-0.04	1.249	-0.031	-0.42	-0.3309	-0.7777	1908495	Bionet1_000965	CN(C)/C=N\NC(=O)/C(=C\Nc1nccc(C)n1)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M08	compound treatment	1.16	0.0757	1.02	1.296	0.016	0.22	0.8759	0.8391	1397124	Bionet1_000966	Cc1cccc(c1)C(=O)Nc2ccc(Sc3ccccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M09	compound treatment	1.087	0.00267	0.04	1.269	-0.011	-0.15	-0.0808	-0.5226	1908496	Bionet1_000967	FC(F)(F)Oc1ccc(NC(=O)c2nc(Cn3cncn3)n[nH]2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M10	compound treatment	1.09	0.00567	0.08	1.284	0.00397	0.05	0.0925	0.9857	1908497	Bionet1_000968	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M11	compound treatment	1.019	-0.0653	-0.88	1.264	-0.016	-0.22	-0.7777	-0.8565	1908498	Bionet1_000969	CCc1cccc(CC)c1NC(=O)C(F)(F)Oc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M12	compound treatment	1.081	-0.00333	-0.04	1.287	0.00697	0.1	0.0355	0.3378	1465528	Bionet1_000970	Clc1ccc(C(=O)Nc2ccc(cc2)N3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M13	compound treatment	1.123	0.0387	0.52	1.295	0.015	0.2	0.5133	0.9162	1908499	Bionet1_000971	FC(F)(F)c1cccc(OC(F)(F)C(=O)Nc2c(Cl)cccc2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M14	compound treatment	1.103	0.0187	0.25	1.309	0.029	0.4	0.4575	0.9764	1345249	Bionet1_000972	CS(=O)(=O)c1ccc(C(=O)Nc2ccc(cc2)N3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M15	compound treatment	1.133	0.0487	0.66	1.273	-0.00703	-0.1	0.3966	0.5976	1908500	Bionet1_000973	Cc1ccc(NC(=O)C(F)(F)Oc2cccc(c2)C(F)(F)F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M16	compound treatment	1.03	-0.0543	-0.73	1.262	-0.018	-0.25	-0.692	-0.8952	1908501	Bionet1_000974	CN1CCN(CC1)c2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M17	compound treatment	1.062	-0.0223	-0.3	1.268	-0.012	-0.16	-0.3289	-0.9591	1908502	Bionet1_000975	FC(F)(F)c1ccc(NC(=O)C(F)(F)Oc2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M18	compound treatment	1.123	0.0387	0.52	1.293	0.013	0.18	0.494	0.8967	1423200	Bionet1_000976	Fc1ccc(cc1)C(=O)Nc2ccc(cc2)N3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M19	compound treatment	1.116	0.0317	0.43	1.268	-0.012	-0.16	0.1862	0.4068	1908503	Bionet1_000977	Fc1ccc(OC(F)(F)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M20	compound treatment	1.095	0.0107	0.14	1.349	0.069	0.94	0.7669	0.806	1908504	Bionet1_000978	ClC(Cl)C(=O)Nc1ccc(cc1)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M21	compound treatment	1.108	0.0237	0.32	1.317	0.037	0.5	0.5824	0.9757	1908505	Bionet1_000979	Fc1ccc(OC(F)(F)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	M22	compound treatment	1.139	0.0547	0.74	1.312	0.032	0.44	0.8299	0.9685	1908506	Bionet1_000980	O/N=C(\Sc1ccc(Cl)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N03	compound treatment	1.054	-0.0303	-0.41	1.273	-0.00703	-0.1	-0.357	-0.8497	1908507	Bionet1_000981	Cc1nc(nn1c2ccc(Cl)cc2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N04	compound treatment	1.039	-0.0453	-0.61	1.191	-0.089	-1.21	-1.2908	-0.9496	1908508	Bionet1_000982	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2ccc(cc2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N05	compound treatment	1.089	0.00467	0.06	1.264	-0.016	-0.22	-0.1099	-0.4834	1119468	Bionet1_000983	Cc1nc(nn1c2ccc(Cl)cc2)C(=O)Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N06	compound treatment	1.065	-0.0193	-0.26	1.266	-0.014	-0.19	-0.3196	-0.9884	1908509	Bionet1_000984	CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N07	compound treatment	1.104	0.0197	0.27	1.232	-0.048	-0.65	-0.2754	-0.3897	1908510	Bionet1_000985	Cc1nc(nn1c2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N08	compound treatment	1.045	-0.0393	-0.53	1.213	-0.067	-0.91	-1.0214	-0.9665	1908511	Bionet1_000986	CN(C)/C=C(/C(=O)c1ccc(Cl)cc1)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N09	compound treatment	1.095	0.0107	0.14	1.278	-0.00203	-0.03	0.0823	0.5613	1908512	Bionet1_000987	Cc1nc(nn1c2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N10	compound treatment	1.053	-0.0313	-0.42	1.301	0.021	0.29	-0.0966	-0.1893	1456380	Bionet1_000988	Clc1ccc(cc1)c2c(cnn2c3ccccc3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N11	compound treatment	1.049	-0.0353	-0.48	1.277	-0.00303	-0.04	-0.3662	-0.7655	1908513	Bionet1_000989	Cc1nc(nn1c2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N12	compound treatment	1.073	-0.0113	-0.15	1.284	0.00397	0.05	-0.0697	-0.43	1908514	Bionet1_000990	CN(C)/C=C(/C(=O)c1ccc(F)cc1)\S(=O)(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N13	compound treatment	1.037	-0.0473	-0.64	1.222	-0.058	-0.79	-1.011	-0.9943	1908515	Bionet1_000991	Cc1nc(nn1c2cccc(c2)C(F)(F)F)C(=O)Nc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N14	compound treatment	1.078	-0.00633	-0.09	1.264	-0.016	-0.22	-0.2149	-0.9159	1638945	Bionet1_000992	COc1ccc(cc1)c2c(cnn2c3ccccc3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N15	compound treatment	1.101	0.0167	0.22	1.238	-0.042	-0.57	-0.2462	-0.3999	1206788	Bionet1_000993	Cc1nc(nn1c2ccc(F)cc2F)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N16	compound treatment	1.03	-0.0543	-0.73	1.258	-0.022	-0.3	-0.7306	-0.9224	1732410	Bionet1_000994	Fc1ccc(cc1)c2c(cnn2c3ccccc3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N17	compound treatment	1.13	0.0457	0.62	1.292	0.012	0.16	0.5512	0.8647	1908516	Bionet1_000995	Cc1nc(nn1c2ccc(F)cc2F)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N18	compound treatment	1.087	0.00267	0.04	1.264	-0.016	-0.22	-0.129	-0.5825	1908517	Bionet1_000996	CN(C)/C=C(/C(=O)c1ccc(Cl)c(Cl)c1)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N19	compound treatment	1.046	-0.0383	-0.52	1.262	-0.018	-0.25	-0.5394	-0.9422	1319951	Bionet1_000997	Cc1nc(nn1c2ccc(F)cc2F)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N20	compound treatment	1.051	-0.0333	-0.45	1.257	-0.023	-0.31	-0.5399	-0.9846	1908518	Bionet1_000998	CN(C)/C=C(/C(=O)c1ccccc1Cl)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N21	compound treatment	1.127	0.0427	0.58	1.3	0.02	0.27	0.5997	0.9416	1908519	Bionet1_000999	Cc1nc(nn1c2ccc(F)cc2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	N22	compound treatment	1.024	-0.0603	-0.81	1.233	-0.047	-0.64	-1.0289	-0.993	1908520	Bionet1_001000	OC1CON(C1)C(=O)CN2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O03	compound treatment	1.097	0.0127	0.17	1.26	-0.02	-0.27	-0.0722	-0.2241	1908521	Bionet1_001001	Cc1ccc(NC(=O)C(F)(F)Oc2ccc(Cl)cc2C)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O04	compound treatment	1.091	0.00667	0.09	1.329	0.049	0.67	0.5359	0.7952	1908522	Bionet1_001002	O/N=C(/Nc1ccc(Cl)cc1)\c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O05	compound treatment	1.133	0.0487	0.66	1.274	-0.00603	-0.08	0.4062	0.6138	1322362	Bionet1_001003	Clc1ccc(C(C#N)c2ccc(Sc3ccccc3)nn2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O06	compound treatment	1.064	-0.0203	-0.27	1.296	0.016	0.22	-0.0399	-0.1138	1908523	Bionet1_001004	FC(F)(F)c1cnc(C2=C(COC2=O)c3ccc(Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O07	compound treatment	1.069	-0.0153	-0.21	1.192	-0.088	-1.2	-0.995	-0.8169	1522054	Bionet1_001005	NC(=O)C(c1ccc(Sc2ccccc2)nn1)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O08	compound treatment	1.074	-0.0103	-0.14	1.265	-0.015	-0.2	-0.2434	-0.9823	1908524	Bionet1_001006	CC(=O)C(/C=N/OCc1ccc(cc1)[N+](=O)[O-])C(=O)Nc2nccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O09	compound treatment	1.189	0.105	1.41	1.351	0.071	0.97	1.6829	0.983	1157065	Bionet1_001007	Clc1ccc(C(C#N)c2ccc(Nc3ccccc3)nn2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O10	compound treatment	1.034	-0.0503	-0.68	1.257	-0.023	-0.31	-0.7021	-0.9386	1908525	Bionet1_001008	COC(=O)/C(=C\Nc1cccc(c1)C(F)(F)F)/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O11	compound treatment	1.09	0.00567	0.08	1.289	0.00897	0.12	0.1407	0.9745	1908526	Bionet1_001009	CCc1cccc(CC)c1NC(=O)C(F)(F)Oc2ccc(Cl)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O12	compound treatment	1.109	0.0247	0.33	1.322	0.042	0.57	0.6401	0.9667	1908527	Bionet1_001010	COC(=O)/C(=C\Nc1ccc(Oc2ccccc2)cc1)/NC(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O13	compound treatment	1.1	0.0157	0.21	1.253	-0.027	-0.37	-0.1111	-0.2614	1908528	Bionet1_001011	NOCC(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O14	compound treatment	1.099	0.0147	0.2	1.295	0.015	0.2	0.2844	0.9999	1609013	Bionet1_001012	Fc1cccc(F)c1C(=O)Nc2ccc(Sc3ccccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O15	compound treatment	1.107	0.0227	0.31	1.269	-0.011	-0.15	0.11	0.3227	1908529	Bionet1_001013	NC(=O)NOCC(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O16	compound treatment	1.088	0.00367	0.05	1.27	-0.01	-0.14	-0.0616	-0.4237	1384508	Bionet1_001014	Fc1ccc(cc1)C(=O)Nc2ccc(Sc3ccccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O17	compound treatment	1.131	0.0467	0.63	1.251	-0.029	-0.4	0.1654	0.2223	1288104	Bionet1_001015	CN(C)c1nc(N2CCN(CC2)c3c(C)cccc3C)c(C#N)c(=O)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O18	compound treatment	1.097	0.0127	0.17	1.384	0.104	1.42	1.1235	0.7867	1133579	Bionet1_001016	Fc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O19	compound treatment	1.11	0.0257	0.35	1.259	-0.021	-0.29	0.0422	0.0938	1908530	Bionet1_001017	Clc1ccc(cc1)S(=O)CCCCS(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O20	compound treatment	1.103	0.0187	0.25	1.335	0.055	0.75	0.7082	0.8955	1908531	Bionet1_001018	Clc1ccccc1Sc2ccc(NC(=O)C(Cl)(Cl)Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O21	compound treatment	1.107	0.0227	0.31	1.295	0.015	0.2	0.3607	0.9807	1908532	Bionet1_001019	CCNc1nc(Sc2ccc(Br)cc2)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	O22	compound treatment	1.142	0.0577	0.78	1.293	0.013	0.18	0.6753	0.8463	1908533	Bionet1_001020	O=C(CCSSCCC(=O)NCc1ccccc1)NCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P03	compound treatment	1.051	-0.0333	-0.45	1.283	0.00297	0.04	-0.2892	-0.6407	1551657	Bionet1_001021	Cc1nc(nn1c2ccc(F)cc2)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P04	compound treatment	1.092	0.00767	0.1	1.197	-0.083	-1.13	-0.7274	-0.6398	1466673	Bionet1_001022	CS(=O)(=O)c1cnn(c1c2ccc(Cl)c(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P05	compound treatment	1.066	-0.0183	-0.25	1.262	-0.018	-0.25	-0.3486	-1.0	1478102	Bionet1_001023	Cc1nc(nn1c2ccc(Cl)cc2Cl)C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P06	compound treatment	1.041	-0.0433	-0.58	1.232	-0.048	-0.65	-0.8764	-0.9984	1908534	Bionet1_001024	C/C(=N\Oc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P07	compound treatment	1.085	6.74E-4	0.01	1.252	-0.028	-0.38	-0.2638	-0.6901	1712053	Bionet1_001025	Cc1nc(nn1c2ccc(Cl)cc2Cl)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P08	compound treatment	1.082	-0.00233	-0.03	1.185	-0.095	-1.3	-0.9385	-0.724	1908535	Bionet1_001026	FC(F)(F)c1cnc(N2CCc3nc(ncc3C2)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P09	compound treatment	0.973	-0.111	-1.5	1.152	-0.128	-1.75	-2.2964	-0.9972	1300978	Bionet1_001027	Cc1nc(nn1c2ccc(Cl)cc2Cl)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P10	compound treatment	0.36	-0.724	-9.77	0.416	-0.864	-11.78	-15.2409	-0.9957	1908536	Bionet1_001028	Cc1nc(c(s1)C(=O)NC(=O)Nc2cccc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P11	compound treatment	1.051	-0.0333	-0.45	1.261	-0.019	-0.26	-0.5014	-0.9659	1143904	Bionet1_001029	Cc1nc(nn1c2cc(Cl)ccc2Cl)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P12	compound treatment	1.052	-0.0323	-0.44	1.168	-0.112	-1.53	-1.3886	-0.8741	1908537	Bionet1_001030	Cc1nc(c(s1)C(=O)NC(=O)Nc2ccc(Cl)cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P13	compound treatment	1.071	-0.0133	-0.18	1.27	-0.01	-0.14	-0.2238	-0.9909	1200195	Bionet1_001031	Cc1nc(nn1c2cc(Cl)ccc2Cl)C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P14	compound treatment	1.04	-0.0443	-0.6	1.219	-0.061	-0.83	-1.0113	-0.9869	1908538	Bionet1_001032	CN(NC(=O)Nc1ccc(Cl)cc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P15	compound treatment	1.095	0.0107	0.14	1.265	-0.015	-0.2	-0.0431	-0.1719	1908539	Bionet1_001033	FC(F)(F)c1cccc(c1)S(=O)(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P16	compound treatment	1.02	-0.0643	-0.87	1.252	-0.028	-0.38	-0.8839	-0.9321	1908540	Bionet1_001034	CN(C)/C=N/C(=O)C(c1ccccc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P17	compound treatment	1.073	-0.0113	-0.15	1.235	-0.045	-0.61	-0.5422	-0.8569	1908541	Bionet1_001035	Brc1ccc(cc1)S(=O)(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P18	compound treatment	1.043	-0.0413	-0.56	1.271	-0.00903	-0.12	-0.4812	-0.8429	1908542	Bionet1_001036	O/N=C/NC(=O)C(c1ccccc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P19	compound treatment	1.124	0.0397	0.54	1.273	-0.00703	-0.1	0.3107	0.5715	1908543	Bionet1_001037	Clc1ccc(cc1Cl)S(=O)(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P20	compound treatment	1.029	-0.0553	-0.75	1.261	-0.019	-0.26	-0.7112	-0.9001	1908544	Bionet1_001038	O/N=C/NC(=O)C(c1ccc(Cl)cc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P21	compound treatment	1.043	-0.0413	-0.56	1.305	0.025	0.34	-0.1534	-0.2348	1256303	Bionet1_001039	Cc1nc(nn1c2cc(Cl)ccc2Cl)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.570	P22	compound treatment	1.127	0.0427	0.58	1.272	-0.00803	-0.11	0.3297	0.5626	1908545	Bionet1_001040	Clc1cccc(NN/C(=N\C(=O)Nc2ccccc2)/Cn3cncn3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A03	compound treatment	1.082	-0.0185	-0.25	1.206	-0.0661	-0.9	-0.8142	-0.8701	1908546	Bionet1_001041	Clc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A04	compound treatment	1.129	0.0285	0.38	1.274	0.00187	0.03	0.2899	0.7523	1633996	Bionet1_001042	COc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A05	compound treatment	1.013	-0.0875	-1.18	1.228	-0.0441	-0.6	-1.2602	-0.9511	1146805	Bionet1_001043	Clc1cccc(Cl)c1Cn2c(ccc(C#N)c2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A06	compound treatment	1.089	-0.0115	-0.16	1.297	0.0249	0.34	0.1301	0.3488	1908547	Bionet1_001044	COc1ccc(cc1)c2ccc(C#N)c(OC(=O)c3c(Cl)cccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A07	compound treatment	1.092	-0.0085	-0.11	1.263	-0.00913	-0.12	-0.1692	-0.9992	1908548	Bionet1_001045	FC(F)(F)c1cccc(Cn2c(ccc(C#N)c2=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A08	compound treatment	1.123	0.0225	0.3	1.316	0.0439	0.6	0.6376	0.9505	1438828	Bionet1_001046	OC(CSc1ccc(F)cc1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A09	compound treatment	1.062	-0.0385	-0.52	1.23	-0.0421	-0.57	-0.7735	-0.9987	1324721	Bionet1_001047	Brc1ccc(cc1)N2C(=O)CS(=O)(=O)C(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A10	compound treatment	1.144	0.0435	0.59	1.281	0.00887	0.12	0.5005	0.8353	1908549	Bionet1_001048	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3c(Cl)cccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A11	compound treatment	1.153	0.0525	0.71	1.3	0.0279	0.38	0.7695	0.9574	1241380	Bionet1_001049	Clc1ccc(cc1)N2C(=O)CS(=O)(=O)C(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A12	compound treatment	1.133	0.0325	0.44	1.3	0.0279	0.38	0.5787	0.9975	1908550	Bionet1_001050	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A13	compound treatment	1.065	-0.0355	-0.48	1.173	-0.0991	-1.35	-1.2945	-0.9027	1210179	Bionet1_001051	Clc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A14	compound treatment	1.076	-0.0245	-0.33	1.324	0.0519	0.71	0.2664	0.3412	1908551	Bionet1_001052	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3cccc(c3)C(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A15	compound treatment	1.064	-0.0365	-0.49	1.287	0.0149	0.2	-0.2048	-0.3846	1908552	Bionet1_001053	FC(F)(F)c1ccc(Cn2c(ccc(C#N)c2=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A16	compound treatment	1.086	-0.0145	-0.2	1.32	0.0479	0.65	0.3232	0.4743	1908553	Bionet1_001054	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3ccc(F)cc3F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A17	compound treatment	1.103	0.0025	0.03	1.305	0.0329	0.45	0.3408	0.7581	1250294	Bionet1_001055	Clc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A18	compound treatment	1.159	0.0585	0.79	1.287	0.0149	0.2	0.7014	0.8608	1908554	Bionet1_001056	FC(F)(F)c1cccc(c1)c2ccc(C#N)c(Oc3cccc(Cl)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A19	compound treatment	1.113	0.0125	0.17	1.22	-0.0521	-0.71	-0.3834	-0.5248	1573085	Bionet1_001057	COc1ccc(Cn2c(ccc(C#N)c2=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A20	compound treatment	1.133	0.0325	0.44	1.244	-0.0281	-0.38	0.0388	0.0665	1455913	Bionet1_001058	Clc1ccc(NC(=O)C2CCCN2S(=O)(=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A21	compound treatment	1.1	-5.02E-4	-0.01	1.258	-0.0141	-0.19	-0.141	-0.7315	1333412	Bionet1_001059	Clc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	A22	compound treatment	1.13	0.0295	0.4	1.269	-0.00313	-0.04	0.2512	0.6276	1588053	Bionet1_001060	Clc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B03	compound treatment	1.11	0.0095	0.13	1.281	0.00887	0.12	0.1761	0.9996	1638075	Bionet1_001061	Fc1cc(F)c(NC(=O)c2cccn(Cc3ccccc3)c2=O)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B04	compound treatment	1.063	-0.0375	-0.51	1.303	0.0309	0.42	-0.0601	-0.0913	1908555	Bionet1_001062	Clc1cccc(n1)N2N=C/C(=C/Nc3ccc(Oc4ccccc4)cc3)/C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B05	compound treatment	1.132	0.0315	0.42	1.248	-0.0241	-0.33	0.0678	0.1261	1908556	Bionet1_001063	CCOC(=O)NC(=O)C(/C=N\OCCOc1cccc(c1)C(F)(F)F)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B06	compound treatment	1.086	-0.0145	-0.2	1.307	0.0349	0.48	0.1979	0.3849	1908557	Bionet1_001064	CO/N=C/NC(=O)C(c1ccccc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B07	compound treatment	1.04	-0.0605	-0.82	1.297	0.0249	0.34	-0.3374	-0.3817	1908558	Bionet1_001065	Nc1c(sc2ncc(C#N)cc12)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B08	compound treatment	1.104	0.0035	0.05	1.319	0.0469	0.64	0.4853	0.7573	1908559	Bionet1_001066	Clc1ccc(NC(=O)/N=C(/Cn2cncn2)\NNc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B09	compound treatment	1.086	-0.0145	-0.2	1.305	0.0329	0.45	0.1786	0.3652	1908560	Bionet1_001067	Clc1ccc(CSc2snnc2c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B10	compound treatment	1.055	-0.0455	-0.61	1.26	-0.0121	-0.17	-0.551	-0.8667	1908561	Bionet1_001068	Sc1nnc(CNS(=O)(=O)c2ccc(Br)cc2)n1CC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B11	compound treatment	1.075	-0.0255	-0.34	1.322	0.0499	0.68	0.2376	0.3117	1908562	Bionet1_001069	Clc1ccc(CS(=O)(=O)c2snnc2c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B12	compound treatment	1.056	-0.0445	-0.6	1.29	0.0179	0.24	-0.2522	-0.3893	1908563	Bionet1_001070	CCn1c(S)nnc1CNS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B13	compound treatment	1.126	0.0255	0.34	1.346	0.0739	1.01	0.9555	0.8977	1908564	Bionet1_001071	FC(F)(F)c1cccc(CS(=O)(=O)c2snnc2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B14	compound treatment	1.104	0.0035	0.05	1.271	-0.00113	-0.02	0.0225	0.4523	1908565	Bionet1_001072	CCn1c(CNS(=O)(=O)c2ccc(Br)cc2)nnc1SC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B15	compound treatment	1.128	0.0275	0.37	1.21	-0.0621	-0.85	-0.3368	-0.3641	1908566	Bionet1_001073	Clc1ccccc1CS(=O)(=O)c2snnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B16	compound treatment	1.092	-0.0085	-0.11	1.328	0.0559	0.76	0.4576	0.594	1908567	Bionet1_001074	FC(F)(F)c1nc(/C=C/Nc2cccc(c2)C(F)(F)F)sc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B17	compound treatment	1.114	0.0135	0.18	1.241	-0.0311	-0.42	-0.1714	-0.3711	1197982	Bionet1_001075	Cc1nc(nn1c2cc(Cl)ccc2Cl)C(=O)Nc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B18	compound treatment	1.082	-0.0185	-0.25	1.223	-0.0491	-0.67	-0.6502	-0.9095	1908568	Bionet1_001076	CN1C(=NS(=O)(=O)c2ccccc12)Nc3nc(C)cc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B19	compound treatment	1.086	-0.0145	-0.2	1.292	0.0199	0.27	0.0532	0.1593	1616006	Bionet1_001077	Cc1nc(nn1c2cc(Cl)ccc2Cl)C(=O)Nc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B20	compound treatment	1.092	-0.0085	-0.11	1.294	0.0219	0.3	0.1298	0.4061	1908569	Bionet1_001078	FC(F)(F)c1cnc2cc(sc2c1)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B21	compound treatment	1.091	-0.0095	-0.13	1.284	0.0119	0.16	0.0238	0.1153	1908570	Bionet1_001079	Fc1ccc(Sc2snnc2c3ccc(Cl)cc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	B22	compound treatment	1.08	-0.0205	-0.28	1.27	-0.00213	-0.03	-0.2161	-0.7771	1323845	Bionet1_001080	Cc1cc(C)c(C#N)c(OC(=O)c2c(Cl)cc(Cl)cc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C03	compound treatment	1.081	-0.0195	-0.26	1.235	-0.0371	-0.51	-0.5441	-0.9535	1723417	Bionet1_001081	Clc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C04	compound treatment	1.136	0.0355	0.48	1.332	0.0599	0.82	0.9159	0.9677	1223342	Bionet1_001082	Fc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)Nc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C05	compound treatment	1.048	-0.0525	-0.71	1.27	-0.00213	-0.03	-0.5214	-0.7355	1298207	Bionet1_001083	Clc1ccc(cc1)C2SCC(=O)N(C2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C06	compound treatment	1.106	0.0055	0.07	1.272	-1.32E-4	0.0	0.0512	0.6898	1658525	Bionet1_001084	Fc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C07	compound treatment	1.095	-0.0055	-0.07	1.316	0.0439	0.6	0.3705	0.6147	1908571	Bionet1_001085	Clc1ccc(cc1)c2nn(cc2n3cncn3)S(=O)(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C08	compound treatment	1.119	0.0185	0.25	1.326	0.0539	0.73	0.6959	0.897	1908572	Bionet1_001086	OCc1cnc(S)n1CCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C09	compound treatment	1.115	0.0145	0.2	1.313	0.0409	0.56	0.5324	0.9014	1908573	Bionet1_001087	CSc1cccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C10	compound treatment	1.097	-0.0035	-0.05	1.288	0.0159	0.22	0.1196	0.54	1132556	Bionet1_001088	Cn1c(CS(=O)(=O)c2ccccc2)cnc1SCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C11	compound treatment	1.086	-0.0145	-0.2	1.306	0.0339	0.46	0.1882	0.3753	1908574	Bionet1_001089	COc1ccccc1N/C=C/c2onc(c2C#N)c3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C12	compound treatment	1.145	0.0445	0.6	1.321	0.0489	0.67	0.8957	0.9986	1908575	Bionet1_001090	CNC(=S)NNC(=O)c1sccc1OCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C13	compound treatment	1.133	0.0325	0.44	1.212	-0.0601	-0.82	-0.2698	-0.2902	1908576	Bionet1_001091	Cc1snc(SCc2n[nH]c(COc3ccc(F)cc3)n2)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C14	compound treatment	1.137	0.0365	0.49	1.344	0.0719	0.98	1.0412	0.9493	1908577	Bionet1_001092	Cn1c(S)nnc1c2sccc2OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C15	compound treatment	1.036	-0.0645	-0.87	1.247	-0.0251	-0.34	-0.8576	-0.917	1908578	Bionet1_001093	Cc1noc(/C=C/c2ccc(o2)c3ccc(Cl)cc3Cl)c1[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C16	compound treatment	1.131	0.0305	0.41	1.357	0.0849	1.16	1.1093	0.9031	1908579	Bionet1_001094	CSc1nnc(c2sccc2OCc3ccc(Cl)cc3Cl)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C17	compound treatment	1.088	-0.0125	-0.17	1.341	0.0689	0.94	0.5448	0.571	1362191	Bionet1_001095	Clc1ccc(c2ccc(Cc3n[nH]c(=O)c4ccccc34)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C18	compound treatment	1.111	0.0105	0.14	1.373	0.101	1.38	1.0728	0.7758	1908580	Bionet1_001096	CNC(=S)NNC(=O)c1sccc1OCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C19	compound treatment	1.085	-0.0155	-0.21	1.311	0.0389	0.53	0.2269	0.3982	1908581	Bionet1_001097	CO/N=C\NC(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C20	compound treatment	1.116	0.0155	0.21	1.241	-0.0311	-0.42	-0.1523	-0.3219	1908582	Bionet1_001098	Cn1c(S)nnc1c2sccc2OCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C21	compound treatment	1.143	0.0425	0.57	1.255	-0.0171	-0.23	0.2402	0.388	1908583	Bionet1_001099	CCOC(=O)C(Cc1ccc(cc1)C(=O)OC)(NC(=O)C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	C22	compound treatment	1.13	0.0295	0.4	1.296	0.0239	0.33	0.5115	0.995	1908584	Bionet1_001100	CSc1nnc(c2sccc2OCc3cccc(c3)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D03	compound treatment	1.081	-0.0195	-0.26	1.292	0.0199	0.27	0.0055	0.0147	1908585	Bionet1_001101	Clc1ccc(c2nnsc2SCc3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D04	compound treatment	1.107	0.0065	0.09	1.293	0.0209	0.28	0.2632	0.884	1908586	Bionet1_001102	CN(C)/C=C(/c1ncc(cc1Cl)C(F)(F)F)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D05	compound treatment	1.102	0.0015	0.02	1.324	0.0519	0.71	0.5144	0.727	1908587	Bionet1_001103	Clc1ccc(cc1)c2nnsc2Sc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D06	compound treatment	1.057	-0.0435	-0.59	1.235	-0.0371	-0.51	-0.773	-0.9973	1908588	Bionet1_001104	CO/N=C/C(c1ncc(cc1Cl)C(F)(F)F)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D07	compound treatment	1.123	0.0225	0.3	1.273	8.68E-4	0.01	0.223	0.7341	1525588	Bionet1_001105	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D08	compound treatment	1.048	-0.0525	-0.71	1.231	-0.0411	-0.56	-0.8974	-0.9933	1347380	Bionet1_001106	COc1ccc(NC(=O)CS(=O)(=O)Cc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D09	compound treatment	1.086	-0.0145	-0.2	1.329	0.0569	0.78	0.41	0.5127	1381444	Bionet1_001107	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D10	compound treatment	1.08	-0.0205	-0.28	1.215	-0.0571	-0.78	-0.7465	-0.9029	1908589	Bionet1_001108	FC(F)(F)c1cccc(NC(=O)CS(=O)Cc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D11	compound treatment	1.075	-0.0255	-0.34	1.265	-0.00713	-0.1	-0.312	-0.8728	1908590	Bionet1_001109	Clc1ccc(c2nnsc2Sc3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D12	compound treatment	1.081	-0.0195	-0.26	1.237	-0.0351	-0.48	-0.5248	-0.9602	1908591	Bionet1_001110	FC(F)(F)c1cccc(NC(=O)CS(=O)c2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D13	compound treatment	1.112	0.0115	0.16	1.244	-0.0281	-0.38	-0.1616	-0.3905	1238011	Bionet1_001111	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D14	compound treatment	1.098	-0.0025	-0.03	1.242	-0.0301	-0.41	-0.3144	-0.7626	1908592	Bionet1_001112	FC(F)(F)c1cnc(/C=C(\C#N)/C(=O)Nc2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D15	compound treatment	1.037	-0.0635	-0.86	1.267	-0.00513	-0.07	-0.6552	-0.7623	1416561	Bionet1_001113	COc1ccc(NC(=O)c2nc(C)n(n2)c3cc(Cl)cc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D16	compound treatment	1.131	0.0305	0.41	1.317	0.0449	0.61	0.7236	0.9814	1908593	Bionet1_001114	FC(F)(F)c1cccc(c1)S(=O)CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D17	compound treatment	1.134	0.0335	0.45	1.19	-0.0821	-1.12	-0.4724	-0.3911	1702956	Bionet1_001115	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D18	compound treatment	1.115	0.0145	0.2	1.266	-0.00613	-0.08	0.0792	0.3722	1908594	Bionet1_001116	FC(F)(F)c1cccc(NC(=O)CS(=O)(=O)Cc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D19	compound treatment	1.112	0.0115	0.16	1.309	0.0369	0.5	0.4652	0.8842	1328682	Bionet1_001117	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D20	compound treatment	1.095	-0.0055	-0.07	1.304	0.0319	0.43	0.2548	0.578	1908595	Bionet1_001118	COc1ccc(cc1)S(=O)(=O)CC(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D21	compound treatment	1.077	-0.0235	-0.32	1.284	0.0119	0.16	-0.1097	-0.3083	1382939	Bionet1_001119	Cc1nc(nn1c2cc(Cl)cc(Cl)c2)C(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	D22	compound treatment	1.065	-0.0355	-0.48	1.273	8.68E-4	0.01	-0.3303	-0.6894	1908596	Bionet1_001120	FC(F)(F)c1cccc(NC(=O)CS(=O)(=O)c2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E03	compound treatment	1.065	-0.0355	-0.48	1.297	0.0249	0.34	-0.0989	-0.1685	1908597	Bionet1_001121	CCCNS(=O)(=O)c1cccn1c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E04	compound treatment	1.117	0.0165	0.22	1.309	0.0369	0.5	0.5129	0.9328	1908598	Bionet1_001122	Sc1nnc([nH]1)c2sccc2OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E05	compound treatment	1.063	-0.0375	-0.51	1.265	-0.00713	-0.1	-0.4265	-0.8279	1908599	Bionet1_001123	[O-][N+](=O)/C(=C\Nc1cccc(c1)C(F)(F)F)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E06	compound treatment	1.12	0.0195	0.26	1.289	0.0169	0.23	0.3487	0.9978	1908600	Bionet1_001124	CSc1nnc([nH]1)c2sccc2OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E07	compound treatment	1.098	-0.0025	-0.03	1.311	0.0389	0.53	0.3509	0.6607	1908601	Bionet1_001125	Cc1c(Cl)cccc1N/C=C(\[N+](=O)[O-])/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E08	compound treatment	1.133	0.0325	0.44	1.292	0.0199	0.27	0.5016	0.9732	1908602	Bionet1_001126	COC(=O)CC(=NNc1ncc(cc1Cl)C(F)(F)F)CC(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E09	compound treatment	1.092	-0.0085	-0.11	1.265	-0.00713	-0.1	-0.1499	-0.9966	1908603	Bionet1_001127	[O-][N+](=O)/C(=C\Nc1ccc(Br)cc1)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E10	compound treatment	1.145	0.0445	0.6	1.329	0.0569	0.78	0.9728	0.992	1908604	Bionet1_001128	CN(c1ncc(cc1Cl)C(F)(F)F)n2cc(C#N)c3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E11	compound treatment	1.086	-0.0145	-0.2	1.277	0.00487	0.07	-0.0914	-0.4424	1908605	Bionet1_001129	[O-][N+](=O)/C(=C\Nc1ccc(Oc2ccccc2)cc1)/S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E12	compound treatment	1.092	-0.0085	-0.11	1.322	0.0499	0.68	0.3998	0.5797	1366469	Bionet1_001130	OC(CS(=O)(=O)Cc1ccccc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E13	compound treatment	1.073	-0.0275	-0.37	1.273	8.68E-4	0.01	-0.254	-0.6842	1908606	Bionet1_001131	[O-][N+](=O)/C(=C\Nc1ccc(Cl)c(Cl)c1)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E14	compound treatment	1.08	-0.0205	-0.28	1.252	-0.0201	-0.27	-0.3897	-1.0	1367991	Bionet1_001132	OC(CSc1ccc(Cl)cc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E15	compound treatment	1.152	0.0515	0.69	1.325	0.0529	0.72	1.001	0.9998	1908607	Bionet1_001133	COC(=O)c1cccc(N/C=C(\[N+](=O)[O-])/S(=O)(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E16	compound treatment	1.122	0.0215	0.29	1.212	-0.0601	-0.82	-0.3747	-0.4308	1520724	Bionet1_001134	OC(CSCc1ccccc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E17	compound treatment	1.093	-0.0075	-0.1	1.298	0.0259	0.35	0.1779	0.4847	1908608	Bionet1_001135	[O-][N+](=O)/C(=C\Nc1ccc(cc1)C(F)(F)F)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E18	compound treatment	1.077	-0.0235	-0.32	1.312	0.0399	0.54	0.1602	0.2546	1636688	Bionet1_001136	OC(CSCc1ccc(Cl)cc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E19	compound treatment	1.119	0.0185	0.25	1.253	-0.0191	-0.26	-0.008	-0.0222	1908609	Bionet1_001137	CN(C)S(=O)(=O)c1cccn1c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E20	compound treatment	1.132	0.0315	0.42	1.305	0.0329	0.45	0.6174	0.9996	1179101	Bionet1_001138	Cc1cccc(SCC(O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E21	compound treatment	1.142	0.0415	0.56	1.319	0.0469	0.64	0.8478	0.9978	1908610	Bionet1_001139	CN(C)/C=N/S(=O)(=O)c1cccn1c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	E22	compound treatment	1.129	0.0285	0.38	1.246	-0.0261	-0.36	0.0199	0.0379	1148662	Bionet1_001140	OC(CS(=O)c1ccc(Cl)cc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F03	compound treatment	1.092	-0.0085	-0.11	1.265	-0.00713	-0.1	-0.1499	-0.9966	1908611	Bionet1_001141	Fc1ccc(cc1)c2nnsc2Sc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F04	compound treatment	1.069	-0.0315	-0.42	1.23	-0.0421	-0.57	-0.7068	-0.989	1908612	Bionet1_001142	Clc1ccc(cc1Cl)S(=O)(=O)CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F05	compound treatment	1.123	0.0225	0.3	1.287	0.0149	0.2	0.358	0.9808	1908613	Bionet1_001143	Clc1ccc(CSc2snnc2c3ccc(Cl)cc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F06	compound treatment	1.098	-0.0025	-0.03	1.213	-0.0591	-0.81	-0.594	-0.7361	1908614	Bionet1_001144	Clc1ccccc1CS(=O)(=O)CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F07	compound treatment	1.106	0.0055	0.07	1.256	-0.0161	-0.22	-0.1031	-0.4441	1908615	Bionet1_001145	[O-][N+](=O)c1ccc(NN2C3CCC2c4c(O3)ccc5ccccc45)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F08	compound treatment	1.092	-0.0085	-0.11	1.315	0.0429	0.58	0.3323	0.5577	1908616	Bionet1_001146	FC(F)(F)c1cccc(c1)S(=O)(=O)CC(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F09	compound treatment	1.048	-0.0525	-0.71	1.225	-0.0471	-0.64	-0.9553	-0.9988	1908617	Bionet1_001147	N/C(=N/OC(=O)Nc1ccccc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F10	compound treatment	1.083	-0.0175	-0.24	1.19	-0.0821	-1.12	-0.9589	-0.8378	1908618	Bionet1_001148	FC(F)(F)c1cccc(c1)c2nnnn2c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F11	compound treatment	1.103	0.0025	0.03	1.247	-0.0251	-0.34	-0.2185	-0.6345	1908619	Bionet1_001149	N/C(=N/OC(=O)Nc1ccc(Cl)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F12	compound treatment	1.101	4.98E-4	0.01	1.228	-0.0441	-0.6	-0.4208	-0.6992	1908620	Bionet1_001150	[O-][N+](=O)c1ccc(cc1)N2CCC(CC2)OC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F13	compound treatment	1.155	0.0545	0.74	1.285	0.0129	0.18	0.644	0.8519	1908621	Bionet1_001151	FC(F)(F)c1cnc(c(Cl)c1)n2ccc(=O)n(CCc3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F14	compound treatment	1.085	-0.0155	-0.21	1.214	-0.0581	-0.79	-0.7084	-0.8641	1908622	Bionet1_001152	COc1ccc(cc1)C(=O)OC2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F15	compound treatment	1.081	-0.0195	-0.26	1.256	-0.0161	-0.22	-0.3416	-0.996	1908623	Bionet1_001153	Cc1nc(ncc1C(=O)Nc2ncc(cc2Cl)C(F)(F)F)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F16	compound treatment	1.105	0.0045	0.06	1.278	0.00587	0.08	0.0995	0.9907	1908624	Bionet1_001154	Cc1ccc(cc1)C(=O)ON=C2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F17	compound treatment	1.133	0.0325	0.44	1.28	0.00787	0.11	0.3859	0.8549	1908625	Bionet1_001155	Cc1nn(cc1C(=O)Nc2ncc(cc2Cl)C(F)(F)F)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F18	compound treatment	1.107	0.0065	0.09	1.215	-0.0571	-0.78	-0.4889	-0.6236	1908626	Bionet1_001156	COc1ccc(cc1)C(=O)ON=C2CCN(CC2)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F19	compound treatment	1.084	-0.0165	-0.22	1.253	-0.0191	-0.26	-0.3419	-0.9969	1908627	Bionet1_001157	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc(CSc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F20	compound treatment	1.108	0.0075	0.1	1.238	-0.0341	-0.47	-0.2576	-0.5408	1266791	Bionet1_001158	CC(C)N(C(C)C)C(=O)CS(=O)(=O)c1ccc(Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F21	compound treatment	1.09	-0.0105	-0.14	1.3	0.0279	0.38	0.1685	0.4156	1908628	Bionet1_001159	Clc1ccc(cc1)C(=O)Nc2ccc(CSc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	F22	compound treatment	1.063	-0.0375	-0.51	1.275	0.00287	0.04	-0.3301	-0.6505	1583340	Bionet1_001160	Brc1ccc(cc1)N2C(=O)CSC(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G03	compound treatment	1.086	-0.0145	-0.2	1.23	-0.0421	-0.57	-0.5446	-0.8973	1908629	Bionet1_001161	FC(F)(F)c1cnc(c(Cl)c1)n2cccc2S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G04	compound treatment	1.121	0.0205	0.28	1.323	0.0509	0.69	0.686	0.9187	1908630	Bionet1_001162	CC(=O)c1ccccc1NS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G05	compound treatment	1.099	-0.0015	-0.02	1.219	-0.0531	-0.72	-0.5266	-0.7266	1908631	Bionet1_001163	FC(F)(F)c1cnc(Sc2ccccc2n3cccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G06	compound treatment	1.132	0.0315	0.42	1.303	0.0309	0.42	0.5981	1.0	1506840	Bionet1_001164	OC(CSc1ccc(Cl)c(Cl)c1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G07	compound treatment	1.085	-0.0155	-0.21	1.294	0.0219	0.3	0.063	0.1729	1908632	Bionet1_001165	CCC(=O)Nc1ccccc1Sc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G08	compound treatment	1.106	0.0055	0.07	1.271	-0.00113	-0.02	0.0415	0.5483	1249374	Bionet1_001166	OC(CS(=O)c1ccc(Cl)c(Cl)c1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G09	compound treatment	1.092	-0.0085	-0.11	1.302	0.0299	0.41	0.2069	0.489	1908633	Bionet1_001167	FC(F)(F)c1cnc(Sc2ccccc2NC(=O)CCl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G10	compound treatment	1.109	0.0085	0.11	1.241	-0.0311	-0.42	-0.2191	-0.4983	1908634	Bionet1_001168	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G11	compound treatment	1.095	-0.0055	-0.07	1.227	-0.0451	-0.62	-0.4877	-0.7867	1908635	Bionet1_001169	FC(F)(F)c1cnc(c2ncc3c(Cl)cc(cn23)C(F)(F)F)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G12	compound treatment	1.149	0.0485	0.65	1.286	0.0139	0.19	0.5964	0.8756	1908636	Bionet1_001170	CCC(C)(C)NC(=O)c1sccc1Oc2ccc(F)cc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G13	compound treatment	1.124	0.0235	0.32	1.268	-0.00413	-0.06	0.1843	0.5725	1908637	Bionet1_001171	OS(=O)(=O)c1ccc(Cc2ncc(cc2Cl)C(F)(F)F)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G14	compound treatment	1.128	0.0275	0.37	1.318	0.0459	0.63	0.7046	0.9689	1908638	Bionet1_001172	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)Nc3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G15	compound treatment	1.132	0.0315	0.42	1.241	-0.0311	-0.42	3.0E-4	5.0E-4	1908639	Bionet1_001173	NS(=O)(=O)c1ccc(Cc2ncc(cc2Cl)C(F)(F)F)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G16	compound treatment	1.128	0.0275	0.37	1.259	-0.0131	-0.18	0.1357	0.3294	1908640	Bionet1_001174	CC(C)(NC(=O)c1sccc1Oc2ccc([N+](=O)[O-])c(c2)C(F)(F)F)C#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G17	compound treatment	1.101	4.98E-4	0.01	1.307	0.0349	0.48	0.341	0.717	1376726	Bionet1_001175	OC(CS(=O)(=O)c1ccc(Cl)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G18	compound treatment	1.103	0.0025	0.03	1.235	-0.0371	-0.51	-0.3342	-0.6586	1682048	Bionet1_001176	OC(CNCc1cccc(Cl)c1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G19	compound treatment	1.098	-0.0025	-0.03	1.243	-0.0291	-0.4	-0.3048	-0.7644	1908641	Bionet1_001177	OC(CSc1ccc(Br)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G20	compound treatment	1.108	0.0075	0.1	1.272	-1.32E-4	0.0	0.0703	0.6944	1280596	Bionet1_001178	OC(CNCc1ccc(Cl)cc1Cl)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G21	compound treatment	1.1	-5.02E-4	-0.01	1.327	0.0549	0.75	0.5243	0.7007	1655282	Bionet1_001179	OC(CS(=O)c1ccc(Cl)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	G22	compound treatment	1.124	0.0235	0.32	1.36	0.0879	1.2	1.0714	0.8644	1349629	Bionet1_001180	COc1ccccc1CNCC(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H03	compound treatment	1.089	-0.0115	-0.16	1.27	-0.00213	-0.03	-0.1303	-0.8252	1908642	Bionet1_001181	Clc1cc(Cl)cc(c1)C(=O)Nc2ccc(CSc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H04	compound treatment	1.054	-0.0465	-0.63	1.224	-0.0481	-0.66	-0.9077	-0.9997	1908643	Bionet1_001182	CN(C)/C=C(/C(=O)c1ccc(Cl)cc1Cl)\S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H05	compound treatment	1.136	0.0355	0.48	1.263	-0.00913	-0.12	0.2506	0.5064	1908644	Bionet1_001183	Fc1ccc(C(=O)Nc2ccc(CSc3ccccc3)cc2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H06	compound treatment	1.063	-0.0375	-0.51	1.226	-0.0461	-0.63	-0.8026	-0.9942	1908645	Bionet1_001184	CN(C)c1ncc(c(n1)c2ccccc2Cl)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H07	compound treatment	1.098	-0.0025	-0.03	1.231	-0.0411	-0.56	-0.4205	-0.7483	1908646	Bionet1_001185	FC(F)(F)c1ccc(cc1)C(=O)Nc2ccc(CSc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H08	compound treatment	1.081	-0.0195	-0.26	1.241	-0.0311	-0.42	-0.4862	-0.9735	1908647	Bionet1_001186	Fc1ccc(cc1)S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H09	compound treatment	1.126	0.0255	0.34	1.27	-0.00213	-0.03	0.2227	0.6451	1908648	Bionet1_001187	Clc1ccc(SCc2ccc(NC(=O)c3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H10	compound treatment	1.087	-0.0135	-0.18	1.266	-0.00613	-0.08	-0.1879	-0.9376	1908649	Bionet1_001188	Clc1ccc(NC(=O)CS(=O)(=O)c2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H11	compound treatment	1.091	-0.0095	-0.13	1.311	0.0389	0.53	0.2841	0.5211	1908650	Bionet1_001189	Fc1cccc(F)c1C(=O)Nc2ccc(CSc3ccc(Cl)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H12	compound treatment	1.082	-0.0185	-0.25	1.246	-0.0261	-0.36	-0.4285	-0.9848	1908651	Bionet1_001190	Clc1cccc(c1)S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H13	compound treatment	1.062	-0.0385	-0.52	1.323	0.0509	0.69	0.1232	0.1422	1908652	Bionet1_001191	NS(=O)(=O)c1ccc(CCNc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H14	compound treatment	1.087	-0.0135	-0.18	1.314	0.0419	0.57	0.2749	0.4587	1908653	Bionet1_001192	Clc1ccc(NC(=O)CS(=O)c2ccccc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H15	compound treatment	1.108	0.0075	0.1	1.268	-0.00413	-0.06	0.0317	0.2737	1908654	Bionet1_001193	CC(=O)CC(=O)N1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H16	compound treatment	1.055	-0.0455	-0.61	1.239	-0.0331	-0.45	-0.7535	-0.9886	1908655	Bionet1_001194	Cc1ncc(c(n1)c2ccc(Cl)cc2Cl)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H17	compound treatment	1.086	-0.0145	-0.2	1.263	-0.00913	-0.12	-0.2264	-0.9762	1908656	Bionet1_001195	Fc1ccc(SCc2ccc(NC(=O)c3c(F)cccc3F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H18	compound treatment	1.084	-0.0165	-0.22	1.247	-0.0251	-0.34	-0.3997	-0.9782	1285561	Bionet1_001196	COc1ccc(cc1)S(=O)CC(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H19	compound treatment	1.119	0.0185	0.25	1.256	-0.0161	-0.22	0.0209	0.0629	1908657	Bionet1_001197	Fc1ccc(SCc2ccc(NC(=O)c3ccc(F)cc3F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H20	compound treatment	1.086	-0.0145	-0.2	1.225	-0.0471	-0.64	-0.5928	-0.8824	1908658	Bionet1_001198	FC(F)(F)c1cccc(c1)S(=O)CC(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H21	compound treatment	1.108	0.0075	0.1	1.262	-0.0101	-0.14	-0.0262	-0.1528	1908659	Bionet1_001199	Fc1ccc(SCc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	H22	compound treatment	1.069	-0.0315	-0.42	1.292	0.0199	0.27	-0.1089	-0.2161	1743168	Bionet1_001200	COc1ccc(cc1)S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I03	compound treatment	1.111	0.0105	0.14	1.311	0.0389	0.53	0.4749	0.8657	1273474	Bionet1_001201	OC(CS(=O)(=O)Cc1ccccc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I04	compound treatment	1.076	-0.0245	-0.33	1.27	-0.00213	-0.03	-0.2543	-0.7663	1742621	Bionet1_001202	COc1ccc(CNCC(O)(c2ccccc2)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I05	compound treatment	1.101	4.98E-4	0.01	1.274	0.00187	0.03	0.0228	0.8641	1394231	Bionet1_001203	Cc1cccc(c1)S(=O)(=O)CC(O)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I06	compound treatment	1.129	0.0285	0.38	1.261	-0.0111	-0.15	0.1645	0.398	1405447	Bionet1_001204	OC(CNCc1ccccc1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I07	compound treatment	1.1	-5.02E-4	-0.01	1.342	0.0699	0.95	0.6689	0.7021	1343725	Bionet1_001205	OC(CS(=O)(=O)c1cccc(Cl)c1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I08	compound treatment	1.102	0.0015	0.02	1.32	0.0479	0.65	0.4759	0.7287	1400968	Bionet1_001206	Cc1ccc(CNCC(O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I09	compound treatment	1.099	-0.0015	-0.02	1.297	0.0249	0.34	0.2255	0.6637	1290011	Bionet1_001207	OC(CSCc1ccc(Cl)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I10	compound treatment	1.084	-0.0165	-0.22	1.305	0.0329	0.45	0.1595	0.3187	1245817	Bionet1_001208	OC(CNCc1ccc(F)cc1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I11	compound treatment	1.123	0.0225	0.3	1.313	0.0409	0.56	0.6087	0.9592	1471810	Bionet1_001209	OC(CSc1c(Cl)cccc1Cl)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I12	compound treatment	1.088	-0.0125	-0.17	1.279	0.00687	0.09	-0.053	-0.2749	1480312	Bionet1_001210	OC(CNCc1ccccc1F)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I13	compound treatment	1.14	0.0395	0.53	1.281	0.00887	0.12	0.4623	0.8461	1245223	Bionet1_001211	OC(CS(=O)c1c(Cl)cccc1Cl)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I14	compound treatment	1.112	0.0115	0.16	1.261	-0.0111	-0.15	0.0024	0.0108	1281121	Bionet1_001212	OC(CN1CCOCC1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I15	compound treatment	1.101	4.98E-4	0.01	1.332	0.0599	0.82	0.582	0.7129	1535297	Bionet1_001213	OC(CS(=O)Cc1ccc(Cl)cc1)(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I16	compound treatment	1.097	-0.0035	-0.05	1.282	0.00987	0.13	0.0618	0.433	1908660	Bionet1_001214	CS(=O)(=O)c1ccccc1Oc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I17	compound treatment	1.094	-0.0065	-0.09	1.294	0.0219	0.3	0.1488	0.4788	1127818	Bionet1_001215	OC(CSCc1ccccc1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I18	compound treatment	1.129	0.0285	0.38	1.226	-0.0461	-0.63	-0.173	-0.2346	1908661	Bionet1_001216	CN(c1ncc(cc1Cl)C(F)(F)F)n2cc(C(=O)N)c3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I19	compound treatment	1.098	-0.0025	-0.03	1.305	0.0329	0.45	0.2931	0.652	1908662	Bionet1_001217	Brc1ccc(Sc2nc(ccc2C#N)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I20	compound treatment	1.124	0.0235	0.32	1.346	0.0739	1.01	0.9364	0.8868	1908663	Bionet1_001218	FC(F)(F)c1ccc(N/C=C/c2onc(c2C#N)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I21	compound treatment	1.122	0.0215	0.29	1.375	0.103	1.4	1.197	0.8356	1908664	Bionet1_001219	FC(F)(F)c1cccc(Sc2nc(ccc2C#N)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	I22	compound treatment	1.112	0.0115	0.16	1.29	0.0179	0.24	0.282	0.9762	1908665	Bionet1_001220	Clc1ccccc1N/C=C/c2onc(c2C#N)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J03	compound treatment	1.111	0.0105	0.14	1.322	0.0499	0.68	0.581	0.8364	1908666	Bionet1_001221	Cc1sc(nc1OC(=O)c2ccc(Cl)c(Cl)c2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J04	compound treatment	1.094	-0.0065	-0.09	1.244	-0.0281	-0.38	-0.3333	-0.8469	1908667	Bionet1_001222	O=S(=O)(c1ccccc1)c2cnc(nc2c3ccccc3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J05	compound treatment	1.085	-0.0155	-0.21	1.297	0.0249	0.34	0.0919	0.2307	1908668	Bionet1_001223	Cc1sc(nc1OC(=O)c2ccc(Cl)cc2Cl)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J06	compound treatment	1.059	-0.0415	-0.56	1.222	-0.0501	-0.68	-0.8793	-0.9951	1908669	Bionet1_001224	O=S(=O)(c1ccccc1)c2cnc(nc2c3ccccc3)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J07	compound treatment	1.117	0.0165	0.22	1.288	0.0159	0.22	0.3104	0.9999	1908670	Bionet1_001225	Cc1sc(nc1OC(=O)c2cc(Cl)cc(Cl)c2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J08	compound treatment	1.088	-0.0125	-0.17	1.285	0.0129	0.18	0.0048	0.0198	1908671	Bionet1_001226	CN(C)/C=C(/C(=O)c1ccccc1)\S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J09	compound treatment	1.113	0.0125	0.17	1.255	-0.0171	-0.23	-0.046	-0.1595	1908672	Bionet1_001227	Cc1sc(nc1OC(=O)c2ccc(cc2)C(F)(F)F)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J10	compound treatment	1.078	-0.0225	-0.3	1.221	-0.0511	-0.7	-0.7077	-0.9306	1908673	Bionet1_001228	Clc1ccc(cc1)S(=O)(=O)CC(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J11	compound treatment	1.118	0.0175	0.24	1.296	0.0239	0.33	0.3971	0.9876	1908674	Bionet1_001229	Cc1sc(nc1OC(=O)c2ccc(Cl)cc2Cl)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J12	compound treatment	1.098	-0.0025	-0.03	1.2	-0.0721	-0.98	-0.7194	-0.7309	1908675	Bionet1_001230	CN(C)c1ncc(c(n1)c2ccccc2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J13	compound treatment	1.105	0.0045	0.06	1.26	-0.0121	-0.17	-0.0741	-0.4203	1908676	Bionet1_001231	Cc1sc(nc1OC(=O)c2ccc(Cl)c(Cl)c2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J14	compound treatment	1.12	0.0195	0.26	1.208	-0.0641	-0.87	-0.4324	-0.4735	1532686	Bionet1_001232	Clc1ccc(CN2C(=O)CSC(C2=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J15	compound treatment	1.092	-0.0085	-0.11	1.239	-0.0331	-0.45	-0.4006	-0.8594	1908677	Bionet1_001233	Cc1sc(nc1OC(=O)c2cc(Cl)cc(Cl)c2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J16	compound treatment	1.089	-0.0115	-0.16	1.209	-0.0631	-0.86	-0.7185	-0.8213	1908678	Bionet1_001234	FC(F)(F)c1ccc(cc1)N2C(=O)CSC(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J17	compound treatment	1.136	0.0355	0.48	1.331	0.0589	0.8	0.9063	0.9695	1908679	Bionet1_001235	Cc1sc(nc1OC(=O)c2cccc(c2)C(F)(F)F)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J18	compound treatment	1.051	-0.0495	-0.67	1.251	-0.0211	-0.29	-0.676	-0.9294	1244794	Bionet1_001236	Brc1ccc(cc1)N2C(=O)CS(=O)C(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J19	compound treatment	1.161	0.0605	0.82	1.278	0.00587	0.08	0.6337	0.7727	1908680	Bionet1_001237	Cc1sc(nc1OC(=O)c2ccc(Cl)cc2Cl)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J20	compound treatment	1.091	-0.0095	-0.13	1.231	-0.0411	-0.56	-0.4872	-0.8469	1516221	Bionet1_001238	Clc1ccc(N2C(=O)CSC(C2=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J21	compound treatment	1.108	0.0075	0.1	1.321	0.0489	0.67	0.5427	0.8052	1908681	Bionet1_001239	Cc1sc(nc1OC(=O)c2cccc(c2)C(F)(F)F)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	J22	compound treatment	1.067	-0.0335	-0.45	1.243	-0.0291	-0.4	-0.6005	-0.9979	1908682	Bionet1_001240	FC(F)(F)c1cnc(NCC2CC(=NO2)C(=O)N3CCOCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K03	compound treatment	1.089	-0.0115	-0.16	1.278	0.00587	0.08	-0.0531	-0.3043	1254773	Bionet1_001241	Clc1ccc(CSc2nc(ccc2C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K04	compound treatment	1.095	-0.0055	-0.07	1.276	0.00387	0.05	-0.0152	-0.1667	1908683	Bionet1_001242	Cc1cc(O)ccc1N/C=C/c2onc(c2C#N)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K05	compound treatment	1.081	-0.0195	-0.26	1.258	-0.0141	-0.19	-0.3223	-0.9883	1908684	Bionet1_001243	FC(F)(F)c1cccc(Oc2nc(ccc2C#N)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K06	compound treatment	1.113	0.0125	0.17	1.314	0.0419	0.57	0.5229	0.8784	1908685	Bionet1_001244	CC(Oc1ccc(Cl)cc1)c2ccnn2S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K07	compound treatment	1.068	-0.0325	-0.44	1.244	-0.0281	-0.38	-0.5813	-0.9978	1451789	Bionet1_001245	Clc1ccc(Cn2c(ccc(C#N)c2=O)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K08	compound treatment	1.128	0.0275	0.37	1.288	0.0159	0.22	0.4153	0.9671	1908686	Bionet1_001246	Clc1cccc(Cl)c1CO/N=C\NC(=S)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K09	compound treatment	1.111	0.0105	0.14	1.269	-0.00313	-0.04	0.07	0.4729	1725966	Bionet1_001247	Clc1ccc(cc1Cl)c2ccc(C#N)c(=O)n2Cc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K10	compound treatment	1.104	0.0035	0.05	1.324	0.0519	0.71	0.5335	0.7526	1908687	Bionet1_001248	CC(=O)c1ccccc1NS(=O)(=O)c2cc(Cl)c(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K11	compound treatment	1.095	-0.0055	-0.07	1.303	0.0309	0.42	0.2452	0.5736	1908688	Bionet1_001249	[O-][N+](=O)c1ccc(Oc2ccsc2C(=O)Nc3ccccc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K12	compound treatment	1.132	0.0315	0.42	1.228	-0.0441	-0.6	-0.1251	-0.1698	1446155	Bionet1_001250	CC1CN(CC(O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3)CC(C)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K13	compound treatment	1.097	-0.0035	-0.05	1.275	0.00287	0.04	-0.0057	-0.0937	1908689	Bionet1_001251	[O-][N+](=O)c1ccc(Oc2ccsc2C(=O)Nc3ccc(F)cc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K14	compound treatment	1.155	0.0545	0.74	1.302	0.0299	0.41	0.8079	0.9612	1563283	Bionet1_001252	CN1CCN(CC(O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K15	compound treatment	1.121	0.0205	0.28	1.229	-0.0431	-0.59	-0.2204	-0.339	1908690	Bionet1_001253	CN(C(=O)c1sccc1Oc2ccc(cc2F)[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K16	compound treatment	1.132	0.0315	0.42	1.287	0.0149	0.2	0.4438	0.9427	1908691	Bionet1_001254	COc1cnc(nc1Sc2cccc(c2)C(F)(F)F)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K17	compound treatment	1.127	0.0265	0.36	1.284	0.0119	0.16	0.3672	0.9358	1908692	Bionet1_001255	[O-][N+](=O)c1ccc(Oc2ccsc2C(=O)Nc3ccccc3F)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K18	compound treatment	1.135	0.0345	0.47	1.308	0.0359	0.49	0.6749	0.9997	1908693	Bionet1_001256	Fc1ccc(NC(=O)c2cnc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K19	compound treatment	1.097	-0.0035	-0.05	1.306	0.0339	0.46	0.2932	0.6315	1908694	Bionet1_001257	CCOC(CNC(=O)c1sccc1Oc2ccc(cc2F)[N+](=O)[O-])OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K20	compound treatment	1.127	0.0265	0.36	1.316	0.0439	0.6	0.6758	0.9697	1908695	Bionet1_001258	Clc1ccc(NC(=O)c2cnc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K21	compound treatment	1.119	0.0185	0.25	1.329	0.0569	0.78	0.7248	0.8897	1908696	Bionet1_001259	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	K22	compound treatment	1.13	0.0295	0.4	1.338	0.0659	0.9	0.9165	0.9329	1908697	Bionet1_001260	O=C(Nc1ccccc1)c2cnc(nc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L03	compound treatment	1.107	0.0065	0.09	1.235	-0.0371	-0.51	-0.296	-0.5761	1908698	Bionet1_001261	Cc1sc(nc1OC(=O)c2ccc(Cl)c(Cl)c2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L04	compound treatment	1.085	-0.0155	-0.21	1.288	0.0159	0.22	0.0051	0.0171	1908699	Bionet1_001262	C/[N+](=C/c1c(OCc2ccc(Cl)cc2Cl)ccc3ccccc13)/[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L05	compound treatment	1.116	0.0155	0.21	1.254	-0.0181	-0.25	-0.027	-0.0833	1908700	Bionet1_001263	Cc1sc(nc1OC(=O)c2cccc(Cl)c2Cl)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L06	compound treatment	1.087	-0.0135	-0.18	1.226	-0.0461	-0.63	-0.5736	-0.8759	1908701	Bionet1_001264	CN(C)/C=N/C(=O)C1=NOC(CNc2ncc(cc2Cl)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L07	compound treatment	1.103	0.0025	0.03	1.224	-0.0481	-0.66	-0.4403	-0.6699	1908702	Bionet1_001265	FC(F)(F)c1cnc(NCCNC(=O)Nc2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L08	compound treatment	1.059	-0.0415	-0.56	1.213	-0.0591	-0.81	-0.9661	-0.9841	1908703	Bionet1_001266	FC(F)(F)c1cnc(NCC2CC(=NO2)C(=O)NC3CC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L09	compound treatment	1.124	0.0235	0.32	1.274	0.00187	0.03	0.2422	0.7615	1908704	Bionet1_001267	CN(C)c1ccc(/C=N\CCNc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L10	compound treatment	1.129	0.0285	0.38	1.255	-0.0171	-0.23	0.1067	0.2371	1908705	Bionet1_001268	FC(F)(F)c1cnc(NCC2CC(=NO2)C(=O)Nc3cccnc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L11	compound treatment	1.101	4.98E-4	0.01	1.263	-0.00913	-0.12	-0.0833	-0.668	1908706	Bionet1_001269	FC(F)(F)c1cnc(NCCNC(=O)c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L12	compound treatment	1.066	-0.0345	-0.47	1.26	-0.0121	-0.17	-0.4461	-0.9031	1908707	Bionet1_001270	ON/C=N/C(=O)C1=NOC(CNc2ncc(cc2Cl)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L13	compound treatment	1.079	-0.0215	-0.29	1.309	0.0369	0.5	0.1504	0.2591	1908708	Bionet1_001271	Cc1nc(ncc1C(=O)Nc2ncc(cc2Cl)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L14	compound treatment	1.117	0.0165	0.22	1.197	-0.0751	-1.02	-0.5671	-0.5409	1908709	Bionet1_001272	CON/C=N/C(=O)C1=NOC(CNc2ncc(cc2Cl)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L15	compound treatment	1.05	-0.0505	-0.68	1.252	-0.0201	-0.27	-0.6759	-0.9201	1908710	Bionet1_001273	Cc1sc(nc1OC(=O)c2cccc(Cl)c2Cl)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L16	compound treatment	1.078	-0.0225	-0.3	1.246	-0.0261	-0.36	-0.4666	-0.9968	1908711	Bionet1_001274	CN(C)/C=C/C(=O)C1=NOC(CNc2ncc(cc2Cl)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L17	compound treatment	1.133	0.0325	0.44	1.272	-1.32E-4	0.0	0.3087	0.7042	1908712	Bionet1_001275	Cc1sc(nc1OC(=O)c2cccc(c2)C(F)(F)F)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L18	compound treatment	1.058	-0.0425	-0.57	1.25	-0.0221	-0.3	-0.6188	-0.9551	1908713	Bionet1_001276	Nc1nccc(n1)C2=NOC(CNc3ncc(cc3Cl)C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L19	compound treatment	1.121	0.0205	0.28	1.263	-0.00913	-0.12	0.1075	0.3544	1908714	Bionet1_001277	Cc1sc(nc1OCc2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L20	compound treatment	1.08	-0.0205	-0.28	1.214	-0.0581	-0.79	-0.7561	-0.9006	1908715	Bionet1_001278	CCOC(=O)C1=NOC(CNc2ncc(cc2Cl)C(F)(F)F)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L21	compound treatment	1.1	-5.02E-4	-0.01	1.211	-0.0611	-0.83	-0.5942	-0.7128	1908716	Bionet1_001279	COC(=O)c1ccc(cc1)c2nc(OCc3ccc(Cl)cc3)c(C)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	L22	compound treatment	1.087	-0.0135	-0.18	1.241	-0.0311	-0.42	-0.429	-0.9286	1908717	Bionet1_001280	CS(=O)(=O)c1cnc(nc1c2ccc(Cl)c(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M03	compound treatment	1.123	0.0225	0.3	1.292	0.0199	0.27	0.4062	0.9984	1908718	Bionet1_001281	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)Nc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M04	compound treatment	1.104	0.0035	0.05	1.321	0.0489	0.67	0.5046	0.7553	1908719	Bionet1_001282	Fc1ccc(NC(=O)c2cnc(nc2c3ccccc3)c4ccccc4)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M05	compound treatment	1.119	0.0185	0.25	1.265	-0.00713	-0.1	0.1077	0.4021	1908720	Bionet1_001283	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M06	compound treatment	1.149	0.0485	0.65	1.268	-0.00413	-0.06	0.4228	0.6438	1587015	Bionet1_001284	Clc1ccc(CNC(=O)c2cnc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M07	compound treatment	1.099	-0.0015	-0.02	1.23	-0.0421	-0.57	-0.4206	-0.7316	1908721	Bionet1_001285	CN(C(=O)c1sccc1Oc2ccc(F)cc2[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M08	compound treatment	1.135	0.0345	0.47	1.283	0.0109	0.15	0.4339	0.8883	1908722	Bionet1_001286	CC(=O)c1cc(NC(=O)c2ccc(C)cc2)c(=O)n(Cc3ccccc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M09	compound treatment	1.104	0.0035	0.05	1.278	0.00587	0.08	0.09	0.9683	1908723	Bionet1_001287	[O-][N+](=O)c1cc(F)ccc1Oc2ccsc2C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M10	compound treatment	1.102	0.0015	0.02	1.238	-0.0341	-0.47	-0.3148	-0.6758	1908724	Bionet1_001288	CC(=O)c1cc(NC(=O)c2ccc(Cl)cc2)c(=O)n(Cc3ccco3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M11	compound treatment	1.062	-0.0385	-0.52	1.383	0.111	1.51	0.7018	0.439	1273341	Bionet1_001289	OC1=C(C2NCCc3ccccc23)C(=O)CC(C1)c4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M12	compound treatment	1.127	0.0265	0.36	1.306	0.0339	0.46	0.5793	0.992	1651792	Bionet1_001290	Clc1cccc(c1)C(=O)Nc2cc3C(=O)CCCc3n(Cc4ccco4)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M13	compound treatment	1.131	0.0305	0.41	1.294	0.0219	0.3	0.5018	0.9875	1298481	Bionet1_001291	O=C(CC1NCCc2ccccc12)Nc3ccc(Oc4ccccc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M14	compound treatment	1.128	0.0275	0.37	1.306	0.0339	0.46	0.5889	0.9941	1908725	Bionet1_001292	Cn1nc(c(C(=O)Nc2cccc(c2)C(F)(F)F)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M15	compound treatment	1.062	-0.0385	-0.52	1.279	0.00687	0.09	-0.3011	-0.5704	1187392	Bionet1_001293	Clc1ccccc1n2ncc3C(=O)N4CCc5ccccc5C4Cc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M16	compound treatment	1.045	-0.0555	-0.75	1.228	-0.0441	-0.6	-0.955	-0.9941	1908726	Bionet1_001294	Cn1nc(c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M17	compound treatment	1.123	0.0225	0.3	1.217	-0.0551	-0.75	-0.317	-0.391	1908727	Bionet1_001295	Fc1ccc(Sc2nc(ccc2C#N)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M18	compound treatment	1.144	0.0435	0.59	1.327	0.0549	0.75	0.944	0.9928	1908728	Bionet1_001296	COc1ccc(OC)c(NC(=O)c2c(Cl)n(C)nc2C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M19	compound treatment	1.128	0.0275	0.37	1.253	-0.0191	-0.26	0.0778	0.1716	1908729	Bionet1_001297	Clc1cccc(Sc2nc(ccc2C#N)c3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M20	compound treatment	1.14	0.0395	0.53	1.315	0.0429	0.58	0.7901	0.9989	1908730	Bionet1_001298	Cn1nc(c(C(=O)Nc2ccc(Cl)c(Cl)c2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M21	compound treatment	1.132	0.0315	0.42	1.342	0.0699	0.95	0.9742	0.9338	1294695	Bionet1_001299	Clc1ccc(cc1Cl)c2ccc(C#N)c(Oc3ccccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	M22	compound treatment	1.153	0.0525	0.71	1.322	0.0499	0.68	0.9817	0.9998	1908731	Bionet1_001300	Cn1nc(c(C(=O)NCc2ccc(Cl)cc2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N03	compound treatment	1.098	-0.0025	-0.03	1.244	-0.0281	-0.38	-0.2951	-0.7664	1908732	Bionet1_001301	CCOC(=O)NCCN1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N04	compound treatment	1.068	-0.0325	-0.44	1.192	-0.0801	-1.09	-1.0827	-0.9196	1908733	Bionet1_001302	Fc1ccc(cc1)c2ccc(C#N)c(OC(=O)c3c(Cl)cccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N05	compound treatment	1.12	0.0195	0.26	1.246	-0.0261	-0.36	-0.066	-0.1489	1908734	Bionet1_001303	NC(=O)NCCN1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N06	compound treatment	1.089	-0.0115	-0.16	1.279	0.00687	0.09	-0.0435	-0.24	1908735	Bionet1_001304	[O-][N+](=O)c1ccc(Oc2ccsc2C(=O)Nc3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N07	compound treatment	1.094	-0.0065	-0.09	1.227	-0.0451	-0.62	-0.4972	-0.7998	1908736	Bionet1_001305	FC(F)(F)c1cnc(c(Cl)c1)n2ccc(=O)n(Cc3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N08	compound treatment	1.055	-0.0455	-0.61	1.212	-0.0601	-0.82	-1.0139	-0.9898	1908737	Bionet1_001306	CC(=O)Nc1ccc(NC(=O)c2sccc2Oc3ccc(cc3)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N09	compound treatment	1.084	-0.0165	-0.22	1.263	-0.00913	-0.12	-0.2455	-0.9623	1908738	Bionet1_001307	CN(OC(=O)c1ccc(C)cc1)/C=C/C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N10	compound treatment	1.068	-0.0325	-0.44	1.291	0.0189	0.26	-0.1281	-0.252	1908739	Bionet1_001308	[O-][N+](=O)c1ccccc1Oc2ccsc2C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N11	compound treatment	1.048	-0.0525	-0.71	1.278	0.00587	0.08	-0.4442	-0.6233	1569330	Bionet1_001309	Fc1cccc(n1)N2CCC3(CC2)OCCN3C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N12	compound treatment	1.109	0.0085	0.11	1.223	-0.0491	-0.67	-0.3927	-0.5777	1908740	Bionet1_001310	COc1ccc(OC)c(NC(=O)c2sccc2Oc3ccccc3[N+](=O)[O-])c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N13	compound treatment	1.085	-0.0155	-0.21	1.241	-0.0311	-0.42	-0.4481	-0.9468	1610039	Bionet1_001311	O=S(=O)(C1CON(C1c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N14	compound treatment	1.096	-0.0045	-0.06	1.267	-0.00513	-0.07	-0.0924	-0.9975	1908741	Bionet1_001312	[O-][N+](=O)c1ccccc1Oc2ccsc2C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N15	compound treatment	1.111	0.0105	0.14	1.271	-0.00113	-0.02	0.0892	0.6264	1908742	Bionet1_001313	FC(F)(F)c1cccc(SCc2ccc(NC(=O)c3ccccc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N16	compound treatment	1.033	-0.0675	-0.91	1.262	-0.0101	-0.14	-0.7416	-0.8052	1908743	Bionet1_001314	Cc1c(Cl)cccc1NC(=O)c2sccc2Oc3ccccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N17	compound treatment	1.16	0.0595	0.8	1.289	0.0169	0.23	0.7302	0.8745	1908744	Bionet1_001315	FC(F)(F)c1cccc(SCc2ccc(NC(=O)c3cccs3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N18	compound treatment	1.109	0.0085	0.11	1.265	-0.00713	-0.1	0.0123	0.0818	1908745	Bionet1_001316	CN(C(=O)c1sccc1Oc2ccccc2[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N19	compound treatment	1.073	-0.0275	-0.37	1.269	-0.00313	-0.04	-0.2925	-0.7833	1908746	Bionet1_001317	Cc1ccc(SCc2ccc(NC(=O)c3c(F)cccc3F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N20	compound treatment	1.082	-0.0185	-0.25	1.256	-0.0161	-0.22	-0.332	-0.998	1229369	Bionet1_001318	Clc1ccc(cc1)C2SCC(=O)N(C2=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N21	compound treatment	1.138	0.0375	0.51	1.264	-0.00813	-0.11	0.2793	0.5393	1287997	Bionet1_001319	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	N22	compound treatment	1.048	-0.0525	-0.71	1.239	-0.0331	-0.45	-0.8203	-0.9764	1540177	Bionet1_001320	Clc1ccc(cc1)C2C(=O)N(C(=O)CS2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O03	compound treatment	1.073	-0.0275	-0.37	1.267	-0.00513	-0.07	-0.3118	-0.8259	1908747	Bionet1_001321	Fc1ccc(Oc2nc(ccc2C#N)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O04	compound treatment	1.13	0.0295	0.4	1.335	0.0629	0.86	0.8876	0.9391	1640810	Bionet1_001322	O=C(N1CCSCC1)c2cnc(nc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O05	compound treatment	1.138	0.0375	0.51	1.26	-0.0121	-0.17	0.2407	0.4523	1908748	Bionet1_001323	FC(F)(F)c1cccc(c1)c2ccc(C#N)c(=O)n2Cc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O06	compound treatment	1.099	-0.0015	-0.02	1.276	0.00387	0.05	0.023	0.4066	1908749	Bionet1_001324	[O-][N+](=O)c1ccc(cc1)N2CCC(=NNc3nc4ccccc4[nH]c3=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O07	compound treatment	1.096	-0.0045	-0.06	1.242	-0.0301	-0.41	-0.3335	-0.8029	1908750	Bionet1_001325	[O-][N+](=O)c1ccc(Cn2c(ccc(C#N)c2=O)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O08	compound treatment	1.125	0.0245	0.33	1.259	-0.0131	-0.18	0.1071	0.2849	1908751	Bionet1_001326	[O-][N+](=O)c1cccnc1N2CCC(=NNc3nc4ccccc4[nH]c3=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O09	compound treatment	1.192	0.0915	1.23	1.354	0.0819	1.12	1.6622	0.9987	1288621	Bionet1_001327	Fc1ccc(cc1)c2ccc(C#N)c(Oc3ccc(Cl)c(Cl)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O10	compound treatment	1.062	-0.0385	-0.52	1.252	-0.0201	-0.27	-0.5614	-0.9556	1908752	Bionet1_001328	Clc1ccc(CO/N=C/2\CCSC3=C2c4ccccc4C3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O11	compound treatment	1.127	0.0265	0.36	1.284	0.0119	0.16	0.3672	0.9358	1307904	Bionet1_001329	Fc1ccc(cc1)c2ccc(C#N)c(Oc3cccc(Cl)c3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O12	compound treatment	1.135	0.0345	0.47	1.312	0.0399	0.54	0.7135	0.997	1908753	Bionet1_001330	[O-][N+](=O)c1ccc(cc1)N2CCC(=NOCc3ccc(Cl)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O13	compound treatment	1.065	-0.0355	-0.48	1.252	-0.0201	-0.27	-0.5328	-0.9651	1908754	Bionet1_001331	Fc1ccc(Oc2nc(ccc2C#N)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O14	compound treatment	1.094	-0.0065	-0.09	1.264	-0.00813	-0.11	-0.1404	-0.9933	1908755	Bionet1_001332	CCOC(=O)c1cc(C(=O)OCC)c(NNC(=O)c2ccncc2)nc1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O15	compound treatment	1.125	0.0245	0.33	1.279	0.00687	0.09	0.2999	0.8731	1908756	Bionet1_001333	COc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O16	compound treatment	1.1	-5.02E-4	-0.01	1.262	-0.0101	-0.14	-0.1025	-0.7408	1908757	Bionet1_001334	CCOC(=O)c1cc(C(=O)OCC)c2nnc(c3ccncc3)n2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O17	compound treatment	1.134	0.0335	0.45	1.256	-0.0161	-0.22	0.164	0.3263	1276453	Bionet1_001335	COc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O18	compound treatment	1.118	0.0175	0.24	1.357	0.0849	1.16	0.9853	0.8342	1319091	Bionet1_001336	CCOC(=O)c1cc(C(=O)OCC)c2nnc(c3ccc(Cl)cc3)n2c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O19	compound treatment	1.126	0.0255	0.34	1.279	0.00687	0.09	0.3095	0.868	1908758	Bionet1_001337	COc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O20	compound treatment	1.11	0.0095	0.13	1.279	0.00687	0.09	0.1568	0.9881	1908759	Bionet1_001338	Cc1[nH]cc(Br)c(=O)c1Oc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O21	compound treatment	1.121	0.0205	0.28	1.303	0.0309	0.42	0.4932	0.9792	1908760	Bionet1_001339	Clc1ccc(c2ccc(/C=C/3\OC(=O)c4ccccc34)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	O22	compound treatment	1.171	0.0705	0.95	1.312	0.0399	0.54	1.0569	0.9648	1550875	Bionet1_001340	Cc1c(OCc2c(F)cccc2Cl)c(=O)ccn1Cc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P03	compound treatment	1.075	-0.0255	-0.34	1.249	-0.0231	-0.32	-0.4663	-0.9991	1520633	Bionet1_001341	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P04	compound treatment	1.115	0.0145	0.2	1.205	-0.0671	-0.92	-0.509	-0.5438	1908761	Bionet1_001342	Fc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P05	compound treatment	1.105	0.0045	0.06	1.249	-0.0231	-0.32	-0.1801	-0.5608	1590329	Bionet1_001343	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccc(NC(=O)C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P06	compound treatment	1.079	-0.0215	-0.29	1.239	-0.0331	-0.45	-0.5246	-0.9771	1469037	Bionet1_001344	Clc1ccc(cc1Cl)N2C(=O)CS(=O)C(C2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P07	compound treatment	1.083	-0.0175	-0.24	1.242	-0.0301	-0.41	-0.4575	-0.9654	1908762	Bionet1_001345	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P08	compound treatment	1.102	0.0015	0.02	1.201	-0.0711	-0.97	-0.6716	-0.6922	1342855	Bionet1_001346	Fc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P09	compound treatment	0.991	-0.11	-1.48	1.121	-0.151	-2.06	-2.5018	-0.9867	1497979	Bionet1_001347	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P10	compound treatment	0.243	-0.858	-11.57	0.388	-0.884	-12.06	-16.7051	-0.9998	1158365	Bionet1_001348	Fc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P11	compound treatment	1.059	-0.0415	-0.56	1.227	-0.0451	-0.62	-0.8311	-0.9989	1908763	Bionet1_001349	CCOC(=O)CC1N(CCNC1=O)C(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P12	compound treatment	1.064	-0.0365	-0.49	1.162	-0.11	-1.5	-1.4101	-0.8922	1339555	Bionet1_001350	Fc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P13	compound treatment	1.09	-0.0105	-0.14	1.266	-0.00613	-0.08	-0.1593	-0.9684	1395153	Bionet1_001351	CCOC(=O)CC1N(CCNC1=O)C(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P14	compound treatment	1.08	-0.0205	-0.28	1.207	-0.0651	-0.89	-0.8236	-0.8854	1908764	Bionet1_001352	Fc1ccc(cc1)c2ccc(C#N)c(=O)n2Cc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P15	compound treatment	1.104	0.0035	0.05	1.273	8.68E-4	0.01	0.0417	0.8579	1356900	Bionet1_001353	CCOC(=O)CC1N(CCNC1=O)C(=O)c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P16	compound treatment	1.066	-0.0345	-0.47	1.256	-0.0161	-0.22	-0.4847	-0.9414	1908765	Bionet1_001354	FC(F)(F)c1ccc(cc1)N2C(=O)CSC(C2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P17	compound treatment	1.094	-0.0065	-0.09	1.22	-0.0521	-0.71	-0.5647	-0.7884	1246095	Bionet1_001355	CCOC(=O)CC1N(CCNC1=O)C(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P18	compound treatment	1.027	-0.0735	-0.99	1.264	-0.00813	-0.11	-0.7796	-0.7813	1908766	Bionet1_001356	C/C(=C\C(=O)Nc1ccccc1Cl)/N2CCN(CC2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P19	compound treatment	1.13	0.0295	0.4	1.246	-0.0261	-0.36	0.0294	0.0551	1201963	Bionet1_001357	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P20	compound treatment	1.043	-0.0575	-0.78	1.266	-0.00613	-0.08	-0.6077	-0.7788	1196283	Bionet1_001358	CCOC(=O)c1cc(C(=O)OCC)c(=O)n(NC(=O)c2ccccc2)c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P21	compound treatment	1.082	-0.0185	-0.25	1.297	0.0249	0.34	0.0633	0.1503	1420464	Bionet1_001359	CCOC(=O)CC1N(CCNC1=O)S(=O)(=O)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.571	P22	compound treatment	1.141	0.0405	0.55	1.26	-0.0121	-0.17	0.2693	0.4718	1335658	Bionet1_001360	CCOC(=O)c1cc(C(=O)OCC)c(=O)n(NC(=O)c2cccnc2)c1N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A03	compound treatment	1.109	-0.00968	-0.13	1.276	-0.00486	-0.07	-0.1393	-0.9506	1277576	Bionet1_001361	Cc1ccc(Cn2ccc(=O)c(OCc3c(F)cccc3Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A04	compound treatment	1.158	0.0393	0.53	1.317	0.0361	0.49	0.7235	0.9993	1274478	Bionet1_001362	COC(=O)c1ccc(CN2C(=O)C(C)N(C(=O)C3CC3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A05	compound treatment	1.027	-0.0917	-1.24	1.305	0.0241	0.33	-0.6418	-0.5015	1645956	Bionet1_001363	Cc1c(OCc2c(F)cccc2Cl)c(=O)ccn1Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A06	compound treatment	1.128	0.00932	0.13	1.299	0.0181	0.25	0.2638	0.9507	1692094	Bionet1_001364	CC(C)n1cnc2c(NS(=O)(=O)c3ccc(C)cc3)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A07	compound treatment	1.111	-0.00768	-0.1	1.234	-0.0469	-0.64	-0.5252	-0.8112	1908767	Bionet1_001365	Clc1ccc(Cn2c(/C=C/c3ccccc3)nc4ccccc24)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A08	compound treatment	1.121	0.00232	0.03	1.348	0.0671	0.92	0.6695	0.7308	1698919	Bionet1_001366	CC(C)n1cnc2c(NS(=O)(=O)c3ccc(Cl)cc3)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A09	compound treatment	1.099	-0.0197	-0.27	1.223	-0.0579	-0.79	-0.7457	-0.8957	1908768	Bionet1_001367	Clc1cccc(Cl)c1Cn2c(/C=C/c3ccccc3)nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A10	compound treatment	1.177	0.0583	0.79	1.274	-0.00686	-0.09	0.4901	0.6186	1273999	Bionet1_001368	CC(C)n1cnc2c(NS(=O)(=O)c3ccc(F)cc3)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A11	compound treatment	1.128	0.00932	0.13	1.255	-0.0259	-0.35	-0.1605	-0.4287	1908769	Bionet1_001369	CC(C)(C)c1ccc(Cn2c(/C=C/c3ccccc3)nc4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A12	compound treatment	1.161	0.0423	0.57	1.297	0.0161	0.22	0.5593	0.9141	1245414	Bionet1_001370	CC(C)n1cnc2c(NS(=O)(=O)c3ccccc3Cl)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A13	compound treatment	1.05	-0.0687	-0.93	1.276	-0.00486	-0.07	-0.7021	-0.7558	1908770	Bionet1_001371	Cc1cc2nc(/C=C/c3ccccc3)n(Cc4cccc(F)c4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A14	compound treatment	1.111	-0.00768	-0.1	1.348	0.0671	0.92	0.5741	0.6231	1233334	Bionet1_001372	COc1ccc(Cn2cc(cc(C#N)c2=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A15	compound treatment	1.085	-0.0337	-0.45	1.308	0.0271	0.37	-0.0596	-0.1018	1908771	Bionet1_001373	Cc1cc2nc(/C=C/c3ccccc3)n(Cc4ccc(cc4)C(C)(C)C)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A16	compound treatment	1.124	0.00532	0.07	1.312	0.0311	0.42	0.351	0.815	1702974	Bionet1_001374	Clc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3ccc(Cl)cc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A17	compound treatment	1.132	0.0133	0.18	1.299	0.0181	0.25	0.3019	0.9877	1908772	Bionet1_001375	COc1cccc(Cn2c(/C=C/c3ccccc3)nc4cc(C)c(C)cc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A18	compound treatment	1.192	0.0733	0.99	1.29	0.00914	0.12	0.7875	0.7899	1908773	Bionet1_001376	Cc1cccc(Cn2cnc3c(NS(=O)(=O)C(F)(F)F)c(C)c(C)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A19	compound treatment	1.095	-0.0237	-0.32	1.198	-0.0829	-1.13	-1.0249	-0.8728	1908774	Bionet1_001377	Cc1cc2nc(/C=C/c3ccccc3)n(Cc4ccc(C#N)cc4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A20	compound treatment	1.145	0.0263	0.36	1.25	-0.0309	-0.42	-0.0465	-0.0845	1320477	Bionet1_001378	CCCn1cnc2c(NS(=O)(=O)c3ccc(OC)cc3)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A21	compound treatment	1.113	-0.00568	-0.08	1.201	-0.0799	-1.09	-0.8243	-0.755	1908775	Bionet1_001379	Cc1cc2nc(/C=C/c3ccccc3)n(Cc4ccc(Cl)cc4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	A22	compound treatment	1.136	0.0173	0.23	1.273	-0.00786	-0.11	0.0894	0.3477	1477659	Bionet1_001380	CCCn1cnc2c(NS(=O)(=O)c3ccc(F)cc3)c(C)c(C)cc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B03	compound treatment	1.125	0.00632	0.09	1.276	-0.00486	-0.07	0.0134	0.1239	1535596	Bionet1_001381	Cc1nn(C)c(Oc2ccc(Cl)cc2)c1C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B04	compound treatment	1.115	-0.00368	-0.05	1.26	-0.0209	-0.28	-0.2363	-0.8182	1908776	Bionet1_001382	[O-][N+](=O)c1ccc(CSc2ncc(cn2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B05	compound treatment	1.153	0.0343	0.46	1.241	-0.0399	-0.54	-0.057	-0.0798	1908777	Bionet1_001383	Cc1nn(C)c(Oc2cccc(c2)C(F)(F)F)c1C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B06	compound treatment	1.108	-0.0107	-0.14	1.282	0.00114	0.02	-0.0909	-0.6274	1908778	Bionet1_001384	Clc1ccc(cc1)c2cnc(SCc3ccc(Cl)cc3Cl)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B07	compound treatment	1.134	0.0153	0.21	1.302	0.0211	0.29	0.3499	0.9867	1908779	Bionet1_001385	Cc1nn(C)c(Sc2ccc(Cl)cc2)c1C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B08	compound treatment	1.128	0.00932	0.13	1.287	0.00614	0.08	0.1481	0.9805	1136799	Bionet1_001386	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B09	compound treatment	1.121	0.00232	0.03	1.258	-0.0229	-0.31	-0.1983	-0.633	1908780	Bionet1_001387	Cc1nn(C)c(Sc2ccc(Cl)cc2)c1C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B10	compound treatment	1.093	-0.0257	-0.35	1.29	0.00914	0.12	-0.1569	-0.4261	1572137	Bionet1_001388	CN(C)C(=S)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B11	compound treatment	1.118	-6.83E-4	-0.01	1.338	0.0571	0.78	0.5444	0.6987	1908781	Bionet1_001389	Cc1nn(C)c(Sc2cccc(Cl)c2)c1C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B12	compound treatment	1.093	-0.0257	-0.35	1.295	0.0141	0.19	-0.1087	-0.2741	1477329	Bionet1_001390	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B13	compound treatment	1.146	0.0273	0.37	1.311	0.0301	0.41	0.5512	0.9985	1908782	Bionet1_001391	Cc1nn(C)c(Sc2cccc(Cl)c2)c1C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B14	compound treatment	1.122	0.00332	0.04	1.23	-0.0509	-0.69	-0.4588	-0.6601	1305385	Bionet1_001392	CN(C)C(=S)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B15	compound treatment	1.134	0.0153	0.21	1.264	-0.0169	-0.23	-0.0165	-0.0533	1162146	Bionet1_001393	Clc1ccc(Sc2nnc(Cc3ccccc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B16	compound treatment	1.114	-0.00468	-0.06	1.307	0.0261	0.36	0.2074	0.5728	1506007	Bionet1_001394	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c2ccc(C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B17	compound treatment	1.138	0.0193	0.26	1.275	-0.00586	-0.08	0.1277	0.4686	1421362	Bionet1_001395	COc1ccc(CNc2nnc(Cc3ccccc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B18	compound treatment	1.097	-0.0217	-0.29	1.217	-0.0639	-0.87	-0.8226	-0.8955	1596612	Bionet1_001396	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B19	compound treatment	1.105	-0.0137	-0.18	1.284	0.00314	0.04	-0.1003	-0.5292	1369090	Bionet1_001397	CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B20	compound treatment	1.103	-0.0157	-0.21	1.267	-0.0139	-0.19	-0.2833	-0.9984	1332510	Bionet1_001398	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B21	compound treatment	1.11	-0.00868	-0.12	1.343	0.0621	0.85	0.5163	0.6036	1569787	Bionet1_001399	CC(O)(CSc1ccc(Cl)cc1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	B22	compound treatment	1.099	-0.0197	-0.27	1.274	-0.00686	-0.09	-0.2539	-0.9019	1654914	Bionet1_001400	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C03	compound treatment	1.144	0.0253	0.34	1.285	0.00414	0.06	0.2814	0.8129	1908783	Bionet1_001401	COC(=O)c1ccc(Cn2c(/C=C/c3ccccc3)nc4cc(C)c(C)cc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C04	compound treatment	1.162	0.0433	0.58	1.266	-0.0149	-0.2	0.2699	0.4364	1908784	Bionet1_001402	CC1=CSC2=[N+](CC(=O)c3ccc(Cl)cc3)CCN12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C05	compound treatment	1.115	-0.00368	-0.05	1.279	-0.00186	-0.03	-0.0531	-0.9514	1908785	Bionet1_001403	Clc1ccc(/C=C/c2nc3ccccc3n2Cc4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C06	compound treatment	1.136	0.0173	0.23	1.291	0.0101	0.14	0.2629	0.9687	1325136	Bionet1_001404	Clc1cccc(Cl)c1Cn2cc(cc(C#N)c2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C07	compound treatment	1.131	0.0123	0.17	1.315	0.0341	0.47	0.4467	0.9037	1908786	Bionet1_001405	Cc1ccc(Cn2c(/C=C/c3ccc(Cl)cc3Cl)nc4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C08	compound treatment	1.147	0.0283	0.38	1.332	0.0511	0.7	0.7632	0.9599	1908787	Bionet1_001406	FC(F)(F)c1cccc(Cn2cc(cc(C#N)c2=O)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C09	compound treatment	1.091	-0.0277	-0.37	1.263	-0.0179	-0.24	-0.4363	-0.9786	1908788	Bionet1_001407	COc1cnc(nc1Sc2ccc(Cl)cc2Cl)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C10	compound treatment	1.117	-0.00168	-0.02	1.292	0.0111	0.15	0.0913	0.5948	1718993	Bionet1_001408	Clc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3ccc(Cl)c(Cl)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C11	compound treatment	1.11	-0.00868	-0.12	1.305	0.0241	0.33	0.1499	0.4291	1908789	Bionet1_001409	CCOC(=O)Cn1c(/C=C/c2ccc(Cl)cc2Cl)nc3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C12	compound treatment	1.162	0.0433	0.58	1.337	0.0561	0.77	0.9545	0.9911	1730545	Bionet1_001410	Clc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3c(Cl)cccc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C13	compound treatment	1.129	0.0103	0.14	1.299	0.0181	0.25	0.2733	0.963	1908790	Bionet1_001411	COc1cccc(Cn2c(/C=C/c3ccccc3Cl)nc4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C14	compound treatment	1.155	0.0363	0.49	1.325	0.0441	0.6	0.772	0.9948	1908791	Bionet1_001412	FC(F)(F)c1cccc(Cn2cc(cc(C#N)c2=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C15	compound treatment	1.13	0.0113	0.15	1.336	0.0551	0.75	0.6396	0.8337	1908792	Bionet1_001413	Fc1cccc(Cl)c1Cn2c(/C=C/c3ccccc3Cl)nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C16	compound treatment	1.153	0.0343	0.46	1.314	0.0331	0.45	0.6469	0.9999	1150783	Bionet1_001414	Clc1cccc(Cn2cc(cc(C#N)c2=O)c3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C17	compound treatment	1.105	-0.0137	-0.18	1.244	-0.0369	-0.5	-0.486	-0.9075	1908793	Bionet1_001415	Clc1cccc(Cn2c(/C=C/c3ccccc3Cl)nc4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C18	compound treatment	1.156	0.0373	0.5	1.298	0.0171	0.23	0.5212	0.9391	1633434	Bionet1_001416	Clc1cccc(c1)c2cc(C#N)c(=O)n(Cc3ccc(Cl)cc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C19	compound treatment	1.12	0.00132	0.02	1.284	0.00314	0.04	0.0428	0.9242	1908794	Bionet1_001417	Fc1cccc(Cn2c(/C=C/c3ccccc3Cl)nc4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C20	compound treatment	1.142	0.0233	0.31	1.28	-8.62E-4	-0.01	0.2141	0.6802	1123613	Bionet1_001418	COc1ccc(Sc2ncc(cc2C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C21	compound treatment	1.155	0.0363	0.49	1.248	-0.0329	-0.45	0.0296	0.0445	1908795	Bionet1_001419	Clc1ccc(Cn2c(/C=C/c3ccccc3Cl)nc4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	C22	compound treatment	1.136	0.0173	0.23	1.3	0.0191	0.26	0.3497	0.9985	1326244	Bionet1_001420	Clc1ccc(cc1)c2cnc(Sc3ccccc3Cl)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D03	compound treatment	1.104	-0.0147	-0.2	1.287	0.00614	0.08	-0.0809	-0.3761	1908796	Bionet1_001421	CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D04	compound treatment	1.12	0.00132	0.02	1.31	0.0291	0.4	0.2935	0.738	1544202	Bionet1_001422	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D05	compound treatment	1.124	0.00532	0.07	1.338	0.0571	0.78	0.6017	0.7689	1908797	Bionet1_001423	CC(O)(CS(=O)(=O)C1CCCCC1)C(=O)Nc2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D06	compound treatment	1.06	-0.0587	-0.79	1.294	0.0131	0.18	-0.4331	-0.5336	1179427	Bionet1_001424	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)c2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D07	compound treatment	1.16	0.0413	0.56	1.263	-0.0179	-0.24	0.2219	0.3648	1908798	Bionet1_001425	COc1ccc(SCC(C)(O)C(=O)Nc2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D08	compound treatment	1.082	-0.0367	-0.49	1.261	-0.0199	-0.27	-0.5415	-0.9598	1908799	Bionet1_001426	COc1ccc(cc1OC)C(=O)NCCSc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D09	compound treatment	1.112	-0.00668	-0.09	1.336	0.0551	0.75	0.4679	0.6179	1224308	Bionet1_001427	COc1cccc(Cn2cnc3c(NS(=O)(=O)C)c(C)c(C)cc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D10	compound treatment	1.095	-0.0237	-0.32	1.271	-0.00986	-0.13	-0.321	-0.926	1908800	Bionet1_001428	COc1cc(cc(OC)c1OC)C(=O)NCCSc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D11	compound treatment	1.092	-0.0267	-0.36	1.277	-0.00386	-0.05	-0.2918	-0.802	1723827	Bionet1_001429	Cc1cccc(Cn2c(nc3cc(C)c(C)cc23)c4cccnc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D12	compound treatment	1.081	-0.0377	-0.51	1.273	-0.00786	-0.11	-0.4353	-0.8378	1908801	Bionet1_001430	Clc1ccc(Sc2ncccc2c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D13	compound treatment	1.147	0.0283	0.38	1.269	-0.0119	-0.16	0.1557	0.3754	1337830	Bionet1_001431	Cc1cc2nc(c3cccnc3Cl)n(Cc4ccccc4Cl)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D14	compound treatment	1.129	0.0103	0.14	1.237	-0.0439	-0.6	-0.3245	-0.5285	1908802	Bionet1_001432	FC(F)(F)c1cccc(Sc2ncccc2c3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D15	compound treatment	1.06	-0.0587	-0.79	1.292	0.0111	0.15	-0.4524	-0.5612	1622607	Bionet1_001433	Cc1cc2nc(c3cccnc3Cl)n(Cc4ccc(F)cc4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D16	compound treatment	1.134	0.0153	0.21	1.269	-0.0119	-0.16	0.0317	0.1209	1908803	Bionet1_001434	COc1ccc(Cn2c(nc3ccccc23)c4ccc(Cl)nc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D17	compound treatment	1.147	0.0283	0.38	1.254	-0.0269	-0.37	0.0111	0.021	1460082	Bionet1_001435	Cc1ccccc1Cn2c(nc3cc(C)c(C)cc23)c4cccnc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D18	compound treatment	1.119	3.17E-4	0.0	1.273	-0.00786	-0.11	-0.0728	-0.6784	1908804	Bionet1_001436	FC(F)(F)c1cccc(Cn2c(nc3ccccc23)c4ccc(Cl)nc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D19	compound treatment	1.129	0.0103	0.14	1.345	0.0641	0.87	0.7169	0.8094	1678707	Bionet1_001437	Cc1cc2nc(c3cccnc3Cl)n(Cc4ccccc4F)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D20	compound treatment	1.128	0.00932	0.13	1.275	-0.00586	-0.08	0.0323	0.2172	1611698	Bionet1_001438	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D21	compound treatment	1.1	-0.0187	-0.25	1.254	-0.0269	-0.37	-0.4372	-0.9834	1477920	Bionet1_001439	Clc1ccc(Oc2nnc(Cc3ccccc3)c4ccccc24)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	D22	compound treatment	1.072	-0.0467	-0.63	1.26	-0.0209	-0.28	-0.6465	-0.9355	1580425	Bionet1_001440	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E03	compound treatment	1.109	-0.00968	-0.13	1.265	-0.0159	-0.22	-0.2453	-0.9708	1908805	Bionet1_001441	Clc1ccccc1/C=C/c2nc3ccccc3n2Cc4cccc(C#N)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E04	compound treatment	1.136	0.0173	0.23	1.258	-0.0229	-0.31	-0.0553	-0.1418	1480589	Bionet1_001442	Clc1ccc(cc1)c2cnc(Sc3cccc(Cl)c3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E05	compound treatment	1.09	-0.0287	-0.39	1.262	-0.0189	-0.26	-0.4555	-0.9803	1908806	Bionet1_001443	FC(F)(F)c1cnc(C(c2nc[nH]n2)c3ccc(Cl)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E06	compound treatment	1.135	0.0163	0.22	1.26	-0.0209	-0.28	-0.0455	-0.1265	1274264	Bionet1_001444	Clc1ccc(Sc2ncc(cc2C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E07	compound treatment	1.099	-0.0197	-0.27	1.307	0.0261	0.36	0.0643	0.1446	1908807	Bionet1_001445	COc1cnc(nc1Oc2ccc(Cl)c3ccccc23)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E08	compound treatment	1.162	0.0433	0.58	1.283	0.00214	0.03	0.4338	0.7415	1447550	Bionet1_001446	Clc1ccc(cc1)c2cnc(Sc3c(Cl)cccc3Cl)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E09	compound treatment	1.115	-0.00368	-0.05	1.267	-0.0139	-0.19	-0.1688	-0.8636	1908808	Bionet1_001447	COc1cnc(SCc2ccc(Cl)cc2)nc1Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E10	compound treatment	1.164	0.0453	0.61	1.295	0.0141	0.19	0.5686	0.887	1908809	Bionet1_001448	FC(F)(F)c1cccc(Oc2ncc(cc2C#N)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E11	compound treatment	1.109	-0.00968	-0.13	1.298	0.0171	0.23	0.0729	0.2722	1908810	Bionet1_001449	COc1cnc(SCc2ccc(Cl)cc2)nc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E12	compound treatment	1.104	-0.0147	-0.2	1.305	0.0241	0.33	0.0927	0.2412	1282964	Bionet1_001450	Clc1cccc(c1)c2cc(C#N)c(=O)n(Cc3c(Cl)cccc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E13	compound treatment	1.094	-0.0247	-0.33	1.211	-0.0699	-0.95	-0.9091	-0.9008	1908811	Bionet1_001451	COc1cnc(SCc2ccc(Cl)cc2)nc1Oc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E14	compound treatment	1.089	-0.0297	-0.4	1.256	-0.0249	-0.34	-0.5229	-0.9966	1908812	Bionet1_001452	FC(F)(F)c1cccc(Oc2ncc(cc2C#N)c3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E15	compound treatment	1.155	0.0363	0.49	1.316	0.0351	0.48	0.6853	0.9999	1908813	Bionet1_001453	CCOC(=O)CSc1ncc(OC)c(Sc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E16	compound treatment	1.126	0.00732	0.1	1.265	-0.0159	-0.22	-0.0832	-0.3497	1139505	Bionet1_001454	Clc1ccc(NC(=O)N2OCC3COc4ccc5ccccc5c4C32)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E17	compound treatment	1.108	-0.0107	-0.14	1.323	0.0421	0.57	0.3044	0.5138	1908814	Bionet1_001455	CCOC(=O)CSc1ncc(OC)c(Sc2ccc(OC)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E18	compound treatment	1.124	0.00532	0.07	1.361	0.0801	1.09	0.8234	0.7519	1457321	Bionet1_001456	Clc1ccc(cc1)C(=O)N2OCC3COc4ccc5ccccc5c4C32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E19	compound treatment	1.148	0.0293	0.4	1.287	0.00614	0.08	0.3388	0.8382	1908815	Bionet1_001457	CCOC(=O)CSc1ncc(OC)c(Oc2ccc(Cl)c(Cl)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E20	compound treatment	1.172	0.0533	0.72	1.341	0.0601	0.82	1.0885	0.9979	1172613	Bionet1_001458	O=C(NC(=S)N1OC[C@@H]2COc3ccc4ccccc4c3[C@@H]21)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E21	compound treatment	1.151	0.0323	0.44	1.288	0.00714	0.1	0.3771	0.8442	1908816	Bionet1_001459	CCOC(=O)CSc1ncc(OC)c(Oc2cccc(c2)[N+](=O)[O-])n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	E22	compound treatment	1.138	0.0193	0.26	1.259	-0.0219	-0.3	-0.0265	-0.067	1908817	Bionet1_001460	CN1C(=O)N(C)C(=O)C(=Cc2c(OCC=C)ccc3ccccc23)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F03	compound treatment	1.124	0.00532	0.07	1.283	0.00214	0.03	0.0713	0.9213	1908818	Bionet1_001461	Cc1cc2nc(c3cccnc3Cl)n(Cc4cccc(Cl)c4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F04	compound treatment	1.081	-0.0377	-0.51	1.255	-0.0259	-0.35	-0.6088	-0.984	1464474	Bionet1_001462	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F05	compound treatment	1.144	0.0253	0.34	1.261	-0.0199	-0.27	0.05	0.1147	1595639	Bionet1_001463	Cc1cc2nc(c3cccnc3Cl)n(Cc4c(F)cccc4Cl)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F06	compound treatment	1.122	0.00332	0.04	1.253	-0.0279	-0.38	-0.237	-0.6196	1697406	Bionet1_001464	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F07	compound treatment	1.114	-0.00468	-0.06	1.264	-0.0169	-0.23	-0.2073	-0.8692	1497567	Bionet1_001465	COc1cccc(Cn2c(nc3cc(C)c(C)cc23)c4cccnc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F08	compound treatment	1.112	-0.00668	-0.09	1.308	0.0271	0.37	0.1979	0.5196	1456538	Bionet1_001466	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3ccc(cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F09	compound treatment	1.06	-0.0587	-0.79	1.283	0.00214	0.03	-0.5392	-0.6806	1299705	Bionet1_001467	COc1ccc(Sc2nnc(Cc3ccccc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F10	compound treatment	1.115	-0.00368	-0.05	1.208	-0.0729	-0.99	-0.7377	-0.7415	1410089	Bionet1_001468	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F11	compound treatment	1.132	0.0133	0.18	1.259	-0.0219	-0.3	-0.0838	-0.2407	1908819	Bionet1_001469	COc1ccc(Oc2cccc3C(/C(=C/N(C)C)/C(=O)c32)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F12	compound treatment	1.117	-0.00168	-0.02	1.224	-0.0569	-0.78	-0.5643	-0.7275	1288290	Bionet1_001470	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F13	compound treatment	1.164	0.0453	0.61	1.275	-0.00586	-0.08	0.3758	0.6095	1908820	Bionet1_001471	CN(C)c1ccc(/C=C/C=C\2/C(c3ccccc3C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F14	compound treatment	1.093	-0.0257	-0.35	1.248	-0.0329	-0.45	-0.5619	-0.9919	1908821	Bionet1_001472	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F15	compound treatment	1.123	0.00432	0.06	1.328	0.0471	0.64	0.4957	0.768	1908822	Bionet1_001473	COc1ccc(/C=C\2/C(c3ccccc3C2=O)c4ccccc4)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F16	compound treatment	1.119	3.17E-4	0.0	1.266	-0.0149	-0.2	-0.1403	-0.6921	1339872	Bionet1_001474	Clc1ccc(Sc2ccc(nn2)C(C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F17	compound treatment	1.138	0.0193	0.26	1.3	0.0191	0.26	0.3688	1.0	1908823	Bionet1_001475	OC1CC(c2cccc(Oc3cccc(c3)C(F)(F)F)c12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F18	compound treatment	1.107	-0.0117	-0.16	1.231	-0.0499	-0.68	-0.5922	-0.8485	1511401	Bionet1_001476	NC(=O)C(c1ccc(Cl)cc1)c2ccc(Sc3ccccc3)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F19	compound treatment	1.082	-0.0367	-0.49	1.266	-0.0149	-0.2	-0.4932	-0.9223	1908824	Bionet1_001477	Fc1cccc2C(/C(=C\Nc3ccc(Cl)cc3)/C(=O)c21)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F20	compound treatment	1.13	0.0113	0.15	1.285	0.00414	0.06	0.1479	0.9084	1330119	Bionet1_001478	NC(=O)C(c1ccc(Cl)cc1)c2ccc(Sc3ccc(Cl)cc3)nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F21	compound treatment	1.094	-0.0247	-0.33	1.299	0.0181	0.25	-0.0606	-0.146	1908825	Bionet1_001479	Fc1cccc2C(/C(=C\Nc3cccc(c3)C(F)(F)F)/C(=O)c21)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	F22	compound treatment	1.066	-0.0527	-0.71	1.282	0.00114	0.02	-0.4916	-0.6915	1908826	Bionet1_001480	C/C(=N\OCc1ccc(cc1)[N+](=O)[O-])/CCS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G03	compound treatment	1.06	-0.0587	-0.79	1.258	-0.0229	-0.31	-0.7802	-0.917	1908827	Bionet1_001481	CCOC(=O)CSc1ncc(OC)c(Oc2ccc(OC)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G04	compound treatment	1.167	0.0483	0.65	1.281	1.38E-4	0.0	0.4622	0.7091	1908828	Bionet1_001482	Cn1c2OC[C@H]3COc4ccc5ccccc5c4[C@H]3c2c(=O)n(C)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G05	compound treatment	1.132	0.0133	0.18	1.251	-0.0299	-0.41	-0.1609	-0.3615	1908829	Bionet1_001483	CCOC(=O)C(C)Sc1ncc(OC)c(Sc2ccc(Cl)cc2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G06	compound treatment	1.167	0.0483	0.65	1.293	0.0121	0.17	0.5779	0.8594	1256704	Bionet1_001484	Clc1ccc(cc1Cl)C(=O)N2OC[C@@H]3COc4ccc5ccccc5c4[C@@H]32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G07	compound treatment	1.07	-0.0487	-0.66	1.266	-0.0149	-0.2	-0.6077	-0.8842	1908830	Bionet1_001485	Clc1ccc(SCCNC(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G08	compound treatment	1.232	0.113	1.53	1.296	0.0151	0.21	1.2269	0.7954	1908831	Bionet1_001486	O=C(CN1CCOCC1)N2OC[C@@H]3COc4ccc5ccccc5c4[C@@H]32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G09	compound treatment	1.143	0.0243	0.33	1.307	0.0261	0.36	0.484	0.9991	1187364	Bionet1_001487	Cc1ccc(Cn2ccc(=O)c(OCc3c(Cl)cccc3Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G10	compound treatment	1.115	-0.00368	-0.05	1.309	0.0281	0.38	0.2362	0.6104	1908832	Bionet1_001488	OC[C@H]1COc2ccc3ccccc3c2[C@H]1NC(=O)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G11	compound treatment	1.092	-0.0267	-0.36	1.31	0.0291	0.4	0.0264	0.0493	1336601	Bionet1_001489	Cc1c(OCc2c(Cl)cccc2Cl)c(=O)ccn1Cc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G12	compound treatment	1.155	0.0363	0.49	1.304	0.0231	0.32	0.5695	0.9773	1576493	Bionet1_001490	Clc1ccc(cc1)C2N[C@H]3[C@@H](CO2)COc4ccc5ccccc5c34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G13	compound treatment	1.102	-0.0167	-0.23	1.275	-0.00586	-0.08	-0.2157	-0.903	1674938	Bionet1_001491	Cc1c(OCc2ccccc2)c(=O)ccn1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G14	compound treatment	1.15	0.0313	0.42	1.293	0.0121	0.17	0.4158	0.9163	1908833	Bionet1_001492	COc1cccc2[C@@H]([C@H](CO)COc12)N(C)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G15	compound treatment	1.113	-0.00568	-0.08	1.267	-0.0139	-0.19	-0.1879	-0.921	1406416	Bionet1_001493	Cc1c(OCc2ccccc2)c(=O)ccn1Cc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G16	compound treatment	1.158	0.0393	0.53	1.271	-0.00986	-0.13	0.28	0.5116	1556426	Bionet1_001494	COc1cccc(c1)C2OC[C@@H]3COc4ccc5ccccc5c4[C@@H]3N2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G17	compound treatment	1.129	0.0103	0.14	1.286	0.00514	0.07	0.148	0.9495	1661200	Bionet1_001495	Cc1c(OCc2ccc(F)cc2)c(=O)ccn1Cc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G18	compound treatment	1.114	-0.00468	-0.06	1.292	0.0111	0.15	0.0627	0.3813	1908834	Bionet1_001496	O=C(N1OCC2COc3ccc4ccccc4c3C21)C5(CC6CC7CC(C6)C5)C7
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G19	compound treatment	1.128	0.00932	0.13	1.28	-8.62E-4	-0.01	0.0806	0.6382	1908835	Bionet1_001497	FC(F)(F)c1cccc(c1)C(=O)Nc2ncc3CCc4ccccc4-c3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G20	compound treatment	1.132	0.0133	0.18	1.297	0.0161	0.22	0.2826	0.9949	1908836	Bionet1_001498	CCCCCCCCCCC(=O)c1c[nH]c(c1)C(=O)C(Cl)(Cl)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G21	compound treatment	1.138	0.0193	0.26	1.297	0.0161	0.22	0.3399	0.9965	1648314	Bionet1_001499	Clc1ccc(NC(=O)Nc2ncc3CCc4ccccc4-c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	G22	compound treatment	1.137	0.0183	0.25	1.35	0.0691	0.94	0.8414	0.8633	1908837	Bionet1_001500	FC(F)(F)c1cnc(SC2CC(=O)N(C2=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H03	compound treatment	1.106	-0.0127	-0.17	1.275	-0.00586	-0.08	-0.1775	-0.9399	1908838	Bionet1_001501	[O-][N+](=O)c1ccccc1N/C=C/2\C(c3cccc(F)c3C2=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H04	compound treatment	1.058	-0.0607	-0.82	1.231	-0.0499	-0.68	-1.0597	-0.9957	1908839	Bionet1_001502	FC(F)(F)c1cnc(SC(C#N)c2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H05	compound treatment	1.146	0.0273	0.37	1.324	0.0431	0.59	0.6765	0.9746	1908840	Bionet1_001503	Fc1cccc2C(/C(=C\Nc3cccc(C#N)c3)/C(=O)c21)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H06	compound treatment	1.095	-0.0237	-0.32	1.262	-0.0189	-0.26	-0.4078	-0.9942	1908841	Bionet1_001504	FC(F)(F)c1cnc(SC(C#N)c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H07	compound treatment	1.136	0.0173	0.23	1.285	0.00414	0.06	0.2051	0.8534	1691069	Bionet1_001505	O=C1CC(c2cccc(N3CCN(CC3)c4ccccc4)c12)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H08	compound treatment	1.116	-0.00268	-0.04	1.28	-8.62E-4	-0.01	-0.0339	-0.8909	1335558	Bionet1_001506	Clc1ccc(CNc2nnc(Cc3ccccc3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H09	compound treatment	1.149	0.0303	0.41	1.315	0.0341	0.47	0.6184	0.9979	1520476	Bionet1_001507	Fc1ccc(cc1)N2CCN(CC2)c3cccc4C(CC(=O)c43)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H10	compound treatment	1.124	0.00532	0.07	1.27	-0.0109	-0.15	-0.054	-0.3282	1908842	Bionet1_001508	FC(F)(F)c1cccc(c1)c2nc(no2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H11	compound treatment	1.101	-0.0177	-0.24	1.329	0.0481	0.66	0.2955	0.4231	1908843	Bionet1_001509	CN(C)/C=C\1/C(c2cccc(Oc3ccc(Cl)cc3)c2C1=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H12	compound treatment	1.086	-0.0327	-0.44	1.308	0.0271	0.37	-0.0501	-0.087	1908844	Bionet1_001510	FC(F)(F)c1cnc(c(Cl)c1)c2cnc(Oc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H13	compound treatment	1.102	-0.0167	-0.23	1.308	0.0271	0.37	0.1025	0.2367	1908845	Bionet1_001511	FC(F)(F)c1cccc(Oc2cccc3C(CC(=O)c32)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H14	compound treatment	1.088	-0.0307	-0.41	1.322	0.0411	0.56	0.104	0.1491	1908846	Bionet1_001512	Clc1cccc(c1)c2cnc(SCc3ccc(Cl)c(Cl)c3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H15	compound treatment	1.127	0.00832	0.11	1.351	0.0701	0.96	0.7556	0.7847	1908847	Bionet1_001513	CN(C)/C=C/1\CCc2c(cc(c3ccccc3)n2c4ccc(C)cc4)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H16	compound treatment	1.064	-0.0547	-0.74	1.309	0.0281	0.38	-0.2503	-0.301	1908848	Bionet1_001514	Cn1c(SCc2ccc(Cl)c(Cl)c2)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H17	compound treatment	1.104	-0.0147	-0.2	1.352	0.0711	0.97	0.5459	0.5513	1908849	Bionet1_001515	Clc1ccc(cc1)C(=O)c2oc3ccccc3c2CBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H18	compound treatment	1.092	-0.0267	-0.36	1.28	-8.62E-4	-0.01	-0.2629	-0.7298	1908850	Bionet1_001516	Cn1c(SCc2ccc(Cl)cc2Cl)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H19	compound treatment	1.134	0.0153	0.21	1.28	-8.62E-4	-0.01	0.1378	0.6658	1380683	Bionet1_001517	Clc1ccc(cc1)C(=O)c2oc3ccccc3c2CSc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H20	compound treatment	1.116	-0.00268	-0.04	1.211	-0.0699	-0.95	-0.6992	-0.7334	1908851	Bionet1_001518	Cn1c(SCc2c(Cl)cccc2Cl)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H21	compound treatment	1.137	0.0183	0.25	1.296	0.0151	0.21	0.3207	0.996	1736174	Bionet1_001519	Cc1ccc(cc1)S(=O)(=O)Cc2c(oc3ccccc23)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	H22	compound treatment	1.069	-0.0497	-0.67	1.285	0.00414	0.06	-0.434	-0.6453	1908852	Bionet1_001520	Cn1c(SCc2ccc(cc2)C(C)(C)C)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I03	compound treatment	1.109	-0.00968	-0.13	1.284	0.00314	0.04	-0.0621	-0.4519	1308297	Bionet1_001521	Clc1cccc(NC(=O)Nc2ncc3CCc4ccccc4-c3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I04	compound treatment	1.117	-0.00168	-0.02	1.269	-0.0119	-0.16	-0.1304	-0.7986	1908853	Bionet1_001522	COc1ccc(cc1)C(CCC#N)(C#N)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I05	compound treatment	1.107	-0.0117	-0.16	1.278	-0.00286	-0.04	-0.139	-0.8563	1295409	Bionet1_001523	CC1N(C(=O)c2ccccc2)c3ccccc3N(Cc4cccc(Cl)c4)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I06	compound treatment	1.136	0.0173	0.23	1.281	1.38E-4	0.0	0.1665	0.7128	1908854	Bionet1_001524	COc1ccc(cc1)C2(CCC(=O)NC2=O)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I07	compound treatment	1.086	-0.0327	-0.44	1.28	-8.62E-4	-0.01	-0.3201	-0.7257	1140364	Bionet1_001525	CC1N(C(=O)c2ccccc2)c3ccccc3N(Cc4cccc(F)c4)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I08	compound treatment	1.124	0.00532	0.07	1.337	0.0561	0.77	0.592	0.77	1592764	Bionet1_001526	CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I09	compound treatment	1.118	-6.83E-4	-0.01	1.297	0.0161	0.22	0.1491	0.6769	1579010	Bionet1_001527	COc1cccc(CN2C(=O)C(C)N(C(=O)c3ccccc3)c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I10	compound treatment	1.098	-0.0207	-0.28	1.292	0.0111	0.15	-0.0899	-0.283	1250843	Bionet1_001528	CC(O)(CS(=O)(=O)C1CCCCC1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I11	compound treatment	1.144	0.0253	0.34	1.294	0.0131	0.18	0.3682	0.9547	1354171	Bionet1_001529	CC1N(C(=O)c2ccccc2)c3ccccc3N(Cc4ccccc4Cl)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I12	compound treatment	1.104	-0.0147	-0.2	1.297	0.0161	0.22	0.0155	0.0525	1394922	Bionet1_001530	CC(O)(CS(=O)c1ccc(Cl)cc1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I13	compound treatment	1.112	-0.00668	-0.09	1.24	-0.0409	-0.56	-0.4578	-0.811	1391776	Bionet1_001531	CC1N(C(=O)c2ccccc2)c3ccccc3N(Cc4ccccc4)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I14	compound treatment	1.127	0.00832	0.11	1.283	0.00214	0.03	0.0999	0.8622	1420403	Bionet1_001532	CC(O)(CS(=O)(=O)c1cccc(Cl)c1)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I15	compound treatment	1.11	-0.00868	-0.12	1.332	0.0511	0.7	0.4103	0.5802	1908855	Bionet1_001533	COc1cnc(nc1Sc2c(Cl)cccc2Cl)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I16	compound treatment	1.103	-0.0157	-0.21	1.313	0.0321	0.44	0.1603	0.3294	1255363	Bionet1_001534	Cc1ccc(cc1)S(=O)(=O)CC(C)(O)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I17	compound treatment	1.133	0.0143	0.19	1.305	0.0241	0.33	0.3693	0.9677	1908856	Bionet1_001535	FC(F)(F)c1cccc(NC(=O)Nc2ncc3CCc4ccccc4-c3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I18	compound treatment	1.15	0.0313	0.42	1.198	-0.0829	-1.13	-0.5003	-0.4147	1687284	Bionet1_001536	COc1ccc(cc1)S(=O)(=O)CC(C)(O)C(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I19	compound treatment	1.094	-0.0247	-0.33	1.338	0.0571	0.78	0.3155	0.3723	1683343	Bionet1_001537	Cc1cc2n(C)cnc2c(NS(=O)(=O)c3ccc(Cl)cc3)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I20	compound treatment	1.151	0.0323	0.44	1.376	0.0951	1.3	1.2256	0.8955	1908857	Bionet1_001538	CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I21	compound treatment	1.148	0.0293	0.4	1.379	0.0981	1.34	1.2259	0.8785	1340803	Bionet1_001539	Cc1cc2n(C)cnc2c(NS(=O)(=O)c3cc(Cl)ccc3Cl)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	I22	compound treatment	1.143	0.0243	0.33	1.302	0.0211	0.29	0.4358	0.9979	1908858	Bionet1_001540	COc1cnc(SCc2ccc(Cl)c(Cl)c2)nc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J03	compound treatment	1.14	0.0213	0.29	1.321	0.0401	0.55	0.5904	0.9549	1539254	Bionet1_001541	Clc1ccccc1SCc2c(oc3ccccc23)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J04	compound treatment	1.106	-0.0127	-0.17	1.27	-0.0109	-0.15	-0.2257	-0.9974	1908859	Bionet1_001542	FC(F)(F)c1cccc(c1)c2cnc(SCc3ccc(Cl)cc3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J05	compound treatment	1.098	-0.0207	-0.28	1.294	0.0131	0.18	-0.0706	-0.213	1158460	Bionet1_001543	Clc1ccc(SCc2c(oc3ccccc23)C(=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J06	compound treatment	1.077	-0.0417	-0.56	1.253	-0.0279	-0.38	-0.6663	-0.9818	1908860	Bionet1_001544	COC(=O)c1ccc(CSc2nc(cc(=O)n2C)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J07	compound treatment	1.119	3.17E-4	0.0	1.259	-0.0219	-0.3	-0.2078	-0.6969	1570403	Bionet1_001545	COc1ccc(SCc2c(oc3ccccc23)C(=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J08	compound treatment	1.112	-0.00668	-0.09	1.253	-0.0279	-0.38	-0.3324	-0.8513	1908861	Bionet1_001546	Cn1c(SCc2cccc(c2)C(F)(F)F)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J09	compound treatment	1.124	0.00532	0.07	1.25	-0.0309	-0.42	-0.2469	-0.5783	1451234	Bionet1_001547	Cc1ccccc1SCc2c(oc3ccccc23)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J10	compound treatment	1.078	-0.0407	-0.55	1.243	-0.0379	-0.52	-0.7532	-0.9995	1908862	Bionet1_001548	Cn1c(SCc2c(F)cccc2Cl)nc(cc1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J11	compound treatment	1.137	0.0183	0.25	1.311	0.0301	0.41	0.4653	0.9704	1658679	Bionet1_001549	COc1ccc(cc1)S(=O)Cc2c(oc3ccccc23)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J12	compound treatment	1.104	-0.0147	-0.2	1.214	-0.0669	-0.91	-0.7848	-0.8411	1908863	Bionet1_001550	Cc1cccc(CSc2ncc(cn2)c3cccc(c3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J13	compound treatment	1.123	0.00432	0.06	1.315	0.0341	0.47	0.3703	0.7894	1908864	Bionet1_001551	Clc1cccc(c1)c2cnn(c2)c3ccc(Cl)c(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J14	compound treatment	1.157	0.0383	0.52	1.267	-0.0139	-0.19	0.2319	0.4212	1908865	Bionet1_001552	FC(F)(F)c1cccc(c1)c2cnc(SCc3ccccc3Cl)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J15	compound treatment	1.113	-0.00568	-0.08	1.265	-0.0159	-0.22	-0.2072	-0.9027	1908866	Bionet1_001553	Clc1snnc1CO/N=C\C2C(=O)CC(CC2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J16	compound treatment	1.087	-0.0317	-0.43	1.246	-0.0349	-0.48	-0.6384	-0.9986	1908867	Bionet1_001554	FC(F)(F)c1cccc(c1)c2cnc(SCc3cccc(Cl)c3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J17	compound treatment	1.156	0.0373	0.5	1.306	0.0251	0.34	0.5984	0.9825	1908868	Bionet1_001555	FC(F)(F)c1cccc(c1)c2cc(C#N)c(=O)n(Cc3ccc(Cl)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J18	compound treatment	1.082	-0.0367	-0.49	1.255	-0.0259	-0.35	-0.5993	-0.9862	1908869	Bionet1_001556	Fc1ccc(CSc2ncc(cn2)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J19	compound treatment	1.19	0.0713	0.96	1.283	0.00214	0.03	0.7009	0.7282	1908870	Bionet1_001557	COc1ccc(Cn2cc(cc(C#N)c2=O)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J20	compound treatment	1.115	-0.00368	-0.05	1.236	-0.0449	-0.61	-0.4677	-0.762	1189944	Bionet1_001558	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J21	compound treatment	1.129	0.0103	0.14	1.33	0.0491	0.67	0.5722	0.8361	1908871	Bionet1_001559	Cc1ccc(Cn2cc(cc(C#N)c2=O)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	J22	compound treatment	1.09	-0.0287	-0.39	1.238	-0.0429	-0.58	-0.6869	-0.9799	1735124	Bionet1_001560	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K03	compound treatment	1.102	-0.0167	-0.23	1.274	-0.00686	-0.09	-0.2253	-0.9244	1908872	Bionet1_001561	Cc1cc2n(C)cnc2c(NS(=O)(=O)c3cccc(c3)C(F)(F)F)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K04	compound treatment	1.113	-0.00568	-0.08	1.294	0.0131	0.18	0.0725	0.3719	1908873	Bionet1_001562	FC(F)(F)c1cnc(c(Cl)c1)C(C#N)(N2CCOCC2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K05	compound treatment	1.088	-0.0307	-0.41	1.276	-0.00486	-0.07	-0.3396	-0.81	1412047	Bionet1_001563	Cc1cc2n(C)cnc2c(NS(=O)(=O)c3ccc(cc3)C(C)(C)C)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K06	compound treatment	1.124	0.00532	0.07	1.24	-0.0409	-0.56	-0.3433	-0.611	1368529	Bionet1_001564	COc1ccc(Cn2cnc3c(NS(=O)(=O)C)c(C)c(C)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K07	compound treatment	1.057	-0.0617	-0.83	1.298	0.0171	0.23	-0.4232	-0.4896	1642363	Bionet1_001565	Cc1cc2n(C)cnc2c(NS(=O)(=O)c3ccccc3Cl)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K08	compound treatment	1.13	0.0113	0.15	1.306	0.0251	0.34	0.3503	0.9336	1908874	Bionet1_001566	FC(F)(F)c1cnc(c(Cl)c1)C(C#N)(N2CCOCC2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K09	compound treatment	1.113	-0.00568	-0.08	1.272	-0.00886	-0.12	-0.1397	-0.9759	1908875	Bionet1_001567	FC(F)(F)c1cccc(c1)c2nnnn2c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K10	compound treatment	1.124	0.00532	0.07	1.312	0.0311	0.42	0.351	0.815	1908876	Bionet1_001568	FC(F)(F)c1cnc(c(Cl)c1)C(C#N)(N2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K11	compound treatment	1.143	0.0243	0.33	1.332	0.0511	0.7	0.7251	0.9408	1908877	Bionet1_001569	Brc1ccc(SCCN2C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K12	compound treatment	1.147	0.0283	0.38	1.25	-0.0309	-0.42	-0.0275	-0.0483	1908878	Bionet1_001570	Clc1cccc(Cl)c1CON/C=N/OCc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K13	compound treatment	1.073	-0.0457	-0.62	1.312	0.0311	0.42	-0.1355	-0.1811	1908879	Bionet1_001571	FC(F)(F)c1cccc(c1)n2nnnc2c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K14	compound treatment	1.152	0.0333	0.45	1.278	-0.00286	-0.04	0.2902	0.6433	1908880	Bionet1_001572	Fc1ccccc1C(C#N)(N2CCOCC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K15	compound treatment	1.098	-0.0207	-0.28	1.297	0.0161	0.22	-0.0417	-0.1173	1172509	Bionet1_001573	Clc1ccc(cc1)S(=O)(=O)CCNC(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K16	compound treatment	1.15	0.0313	0.42	1.308	0.0271	0.37	0.5604	0.9978	1908881	Bionet1_001574	COc1ccc(cc1)C(=O)n2cc(cn2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K17	compound treatment	1.141	0.0223	0.3	1.306	0.0251	0.34	0.4553	0.9979	1412820	Bionet1_001575	Cc1ccc(SCC(=O)Nc2ncc3CCc4ccccc4-c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K18	compound treatment	1.156	0.0373	0.5	1.301	0.0201	0.27	0.5502	0.9594	1908882	Bionet1_001576	CO/N=C/NC(=O)C(c1ccc(F)cc1)c2cccc(c2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K19	compound treatment	1.069	-0.0497	-0.67	1.324	0.0431	0.59	-0.058	-0.065	1908883	Bionet1_001577	Fc1ccc(cc1)C(=O)NCCSc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K20	compound treatment	1.138	0.0193	0.26	1.302	0.0211	0.29	0.3881	0.9987	1908884	Bionet1_001578	FC(F)(F)c1cnc(c2cnn(c2)C(=O)c3cccnc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K21	compound treatment	1.112	-0.00668	-0.09	1.296	0.0151	0.21	0.0822	0.365	1908885	Bionet1_001579	Fc1ccc(cc1)C(=O)NCCS(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	K22	compound treatment	1.202	0.0833	1.12	1.347	0.0661	0.9	1.4325	0.994	1908886	Bionet1_001580	FC(F)(F)c1cnc(c(Cl)c1)n2cccc2C(=O)NCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L03	compound treatment	1.14	0.0213	0.29	1.272	-0.00886	-0.12	0.1179	0.3779	1908887	Bionet1_001581	Fc1ccc(Cn2cc(cc(C#N)c2=O)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L04	compound treatment	1.111	-0.00768	-0.1	1.265	-0.0159	-0.22	-0.2262	-0.9432	1613963	Bionet1_001582	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L05	compound treatment	1.13	0.0113	0.15	1.235	-0.0459	-0.63	-0.3343	-0.5192	1908888	Bionet1_001583	FC(F)(F)c1cccc(c1)c2cc(C#N)c(=O)n(Cc3cccc(Cl)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L06	compound treatment	1.135	0.0163	0.22	1.272	-0.00886	-0.12	0.0702	0.2795	1908889	Bionet1_001584	COc1ccc(Sc2ncccc2c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L07	compound treatment	1.125	0.00632	0.09	1.231	-0.0499	-0.68	-0.4205	-0.6137	1908890	Bionet1_001585	FC(F)(F)c1cccc(c1)c2cc(C#N)c(=O)n(Cc3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L08	compound treatment	1.097	-0.0217	-0.29	1.209	-0.0719	-0.98	-0.8998	-0.8798	1908891	Bionet1_001586	Clc1ccc(Cn2c(nc3ccccc23)c4ccc(Cl)nc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L09	compound treatment	1.162	0.0433	0.58	1.261	-0.0199	-0.27	0.2217	0.3442	1908892	Bionet1_001587	FC(F)(F)c1cccc(c1)c2cnc(Oc3ccccc3Cl)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L10	compound treatment	1.131	0.0123	0.17	1.236	-0.0449	-0.61	-0.3151	-0.497	1366968	Bionet1_001588	Clc1ccc(Cn2c(nc3ccccc23)c4ccc(Cl)nc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L11	compound treatment	1.112	-0.00668	-0.09	1.345	0.0641	0.87	0.5547	0.6309	1908893	Bionet1_001589	FC(F)(F)c1cccc(c1)c2cnc(Oc3ccc(Cl)cc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L12	compound treatment	1.074	-0.0447	-0.6	1.297	0.0161	0.22	-0.2706	-0.4217	1908894	Bionet1_001590	Clc1ccc(cn1)c2nc3ccccc3n2Cc4ccc(Cl)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L13	compound treatment	1.094	-0.0247	-0.33	1.306	0.0251	0.34	0.0069	0.0145	1908895	Bionet1_001591	Fc1ccc(Oc2ncc(cc2C#N)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L14	compound treatment	1.139	0.0203	0.27	1.22	-0.0609	-0.83	-0.3931	-0.4497	1728237	Bionet1_001592	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L15	compound treatment	1.062	-0.0567	-0.76	1.268	-0.0129	-0.18	-0.6647	-0.8473	1908896	Bionet1_001593	Fc1ccc(Oc2ncc(cc2C#N)c3cccc(c3)C(F)(F)F)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L16	compound treatment	1.111	-0.00768	-0.1	1.247	-0.0339	-0.46	-0.3998	-0.8448	1385890	Bionet1_001594	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L17	compound treatment	1.144	0.0253	0.34	1.258	-0.0229	-0.31	0.0211	0.0455	1908897	Bionet1_001595	FC(F)(F)c1cccc(c1)c2cnc(Sc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L18	compound treatment	1.06	-0.0587	-0.79	1.256	-0.0249	-0.34	-0.7995	-0.9284	1226627	Bionet1_001596	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L19	compound treatment	1.139	0.0203	0.27	1.268	-0.0129	-0.18	0.0698	0.2145	1908898	Bionet1_001597	FC(F)(F)c1cccc(c1)c2cnc(Sc3cccc(Cl)c3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L20	compound treatment	1.126	0.00732	0.1	1.216	-0.0649	-0.88	-0.5556	-0.6243	1608690	Bionet1_001598	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3cccc(C)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L21	compound treatment	1.103	-0.0157	-0.21	1.279	-0.00186	-0.03	-0.1676	-0.7863	1908899	Bionet1_001599	FC(F)(F)c1cccc(c1)c2cnc(Sc3ccc(Cl)cc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	L22	compound treatment	1.085	-0.0337	-0.45	1.247	-0.0339	-0.46	-0.6478	-1.0	1322334	Bionet1_001600	COC(=O)c1c(C(=O)OC)c2CS(=O)Cn2c1c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M03	compound treatment	1.129	0.0103	0.14	1.317	0.0361	0.49	0.4469	0.8727	1908900	Bionet1_001601	Clc1ccccc1C(=O)NCCSc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M04	compound treatment	1.129	0.0103	0.14	1.298	0.0171	0.23	0.2637	0.9693	1908901	Bionet1_001602	FC(F)(F)c1cnc(c(Cl)c1)n2cccc2C(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M05	compound treatment	1.13	0.0113	0.15	1.304	0.0231	0.32	0.3311	0.9445	1908902	Bionet1_001603	CO/N=C/C(=N\Nc1ccc(OC)cc1)/C(=O)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M06	compound treatment	1.175	0.0563	0.76	1.277	-0.00386	-0.05	0.5	0.6565	1908903	Bionet1_001604	FC(F)(F)c1cnc(c(Cl)c1)n2cc(cc2C#N)C(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M07	compound treatment	1.127	0.00832	0.11	1.231	-0.0499	-0.68	-0.4015	-0.5826	1908904	Bionet1_001605	CO/N=C/C(=N\Nc1ccc(OC)cc1)/C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M08	compound treatment	1.127	0.00832	0.11	1.28	-8.62E-4	-0.01	0.071	0.6296	1908905	Bionet1_001606	FC(F)(F)c1cnc(c(Cl)c1)n2cccc2NC(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M09	compound treatment	1.119	3.17E-4	0.0	1.276	-0.00486	-0.07	-0.0439	-0.6602	1261702	Bionet1_001607	Clc1ccc(SCC(=O)Nc2ncc3CCc4ccccc4-c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M10	compound treatment	1.132	0.0133	0.18	1.343	0.0621	0.85	0.7262	0.8384	1908906	Bionet1_001608	Nc1nc(Br)c2c(F)cccc2c1c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M11	compound treatment	1.125	0.00632	0.09	1.292	0.0111	0.15	0.1677	0.9627	1908907	Bionet1_001609	CO/N=C/C(=N\Nc1ccc(C)c(C)c1)/C(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M12	compound treatment	1.126	0.00732	0.1	1.257	-0.0239	-0.33	-0.1603	-0.4714	1642271	Bionet1_001610	Nc1nc(Br)c2c(Cl)cccc2c1c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M13	compound treatment	1.122	0.00332	0.04	1.332	0.0511	0.7	0.5247	0.7509	1908908	Bionet1_001611	CO/N=C/C(=N/Nc1ccc(OC)cc1)/C(=O)c2ccc(cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M14	compound treatment	1.136	0.0173	0.23	1.286	0.00514	0.07	0.2147	0.8804	1908909	Bionet1_001612	COc1ccc(NC(=O)c2cccn2c3ncc(cc3Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M15	compound treatment	1.15	0.0313	0.42	1.299	0.0181	0.25	0.4736	0.9675	1256977	Bionet1_001613	OC(CNCc1ccc(Cl)cc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M16	compound treatment	1.067	-0.0517	-0.7	1.271	-0.00986	-0.13	-0.5881	-0.8282	1908910	Bionet1_001614	Cc1cc(C)cc(NC(=O)c2cccn2c3ncc(cc3Cl)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M17	compound treatment	1.081	-0.0377	-0.51	1.279	-0.00186	-0.03	-0.3774	-0.7415	1666388	Bionet1_001615	Cc1ccc(CNCC(O)(c2ccc(F)cc2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M18	compound treatment	1.163	0.0443	0.6	1.313	0.0321	0.44	0.7326	0.9883	1908911	Bionet1_001616	FC(F)(F)c1cc(c2ccc(nc2n1)C(C#N)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M19	compound treatment	1.115	-0.00368	-0.05	1.265	-0.0159	-0.22	-0.1881	-0.8475	1300997	Bionet1_001617	COc1ccc(CNCC(O)(c2ccc(F)cc2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M20	compound treatment	1.171	0.0523	0.71	1.334	0.0531	0.72	1.0114	0.9999	1146484	Bionet1_001618	NC(=O)C(c1ccc(Cl)cc1)c2ccc(cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M21	compound treatment	1.12	0.00132	0.02	1.326	0.0451	0.62	0.4478	0.7272	1701509	Bionet1_001619	COc1ccccc1CNCC(O)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	M22	compound treatment	1.181	0.0623	0.84	1.357	0.0761	1.04	1.3286	0.9945	1908912	Bionet1_001620	O/N=C/NC(=O)C(c1ccc(Cl)cc1)c2ccc(cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N03	compound treatment	1.11	-0.00868	-0.12	1.243	-0.0379	-0.52	-0.4479	-0.846	1908913	Bionet1_001621	COc1ccccc1Sc2ncc(cc2C#N)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N04	compound treatment	1.079	-0.0397	-0.54	1.188	-0.0929	-1.27	-1.274	-0.9266	1717312	Bionet1_001622	COC(=O)c1c(C(=O)OC)c2CS(=O)(=O)Cn2c1c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N05	compound treatment	1.121	0.00232	0.03	1.243	-0.0379	-0.52	-0.343	-0.6631	1908914	Bionet1_001623	FC(F)(F)c1cc(c2ccc(nc2n1)N3CCC(=O)CC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N06	compound treatment	1.109	-0.00968	-0.13	1.252	-0.0289	-0.39	-0.3707	-0.8939	1520882	Bionet1_001624	COC(=O)c1c(C(=O)OC)c2CSCn2c1c3ccc(cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N07	compound treatment	1.119	3.17E-4	0.0	1.252	-0.0289	-0.39	-0.2753	-0.6994	1908915	Bionet1_001625	FC(F)(F)c1nnc2c(nc3ccc(Cl)cc3n12)N4CCC(=O)CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N08	compound treatment	1.084	-0.0347	-0.47	1.251	-0.0299	-0.41	-0.6188	-0.9976	1908916	Bionet1_001626	FC(F)(F)c1cnc(Sc2nc3nccc(c4ccco4)n3n2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N09	compound treatment	1.108	-0.0107	-0.14	1.329	0.0481	0.66	0.3623	0.539	1908917	Bionet1_001627	C(O/N=C\1/CCCc2c1cc(c3ccccc3)n2c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N10	compound treatment	1.072	-0.0467	-0.63	1.273	-0.00786	-0.11	-0.5211	-0.8157	1908918	Bionet1_001628	COC(=O)c1sccc1OC(C)c2ccnc3nc(nn23)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N11	compound treatment	1.065	-0.0537	-0.72	1.29	0.00914	0.12	-0.424	-0.577	1908919	Bionet1_001629	COc1cc(cc(OC)c1OC)C(=O)NCCSc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N12	compound treatment	1.112	-0.00668	-0.09	1.203	-0.0779	-1.06	-0.8145	-0.7644	1908920	Bionet1_001630	CC(Oc1ccc(cc1)C(C)(C)C)c2ccnc3nc(/N=C/N(C)C)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N13	compound treatment	1.096	-0.0227	-0.31	1.271	-0.00986	-0.13	-0.3115	-0.9318	1908921	Bionet1_001631	COc1cccc(c1)C(=O)NCCSc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N14	compound treatment	1.09	-0.0287	-0.39	1.269	-0.0119	-0.16	-0.388	-0.9251	1908922	Bionet1_001632	CC(Oc1ccc(cc1)[N+](=O)[O-])c2ccnc3nc(/N=C/N(C)C)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N15	compound treatment	1.127	0.00832	0.11	1.291	0.0101	0.14	0.1771	0.9946	1345358	Bionet1_001633	O=C1c2ccccc2-c3nnc(cc13)c4ccc(Oc5ccccc5)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N16	compound treatment	1.037	-0.0817	-1.1	1.259	-0.0219	-0.3	-0.99	-0.8672	1908923	Bionet1_001634	CO/N=C/Nc1nc2nccc(C(C)Oc3ccc(cc3)[N+](=O)[O-])n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N17	compound treatment	1.178	0.0593	0.8	1.262	-0.0189	-0.26	0.384	0.4568	1908924	Bionet1_001635	CN(C)/C=N\c1nc2nccc(c3ccc(Oc4ccccc4)cc3)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N18	compound treatment	1.116	-0.00268	-0.04	1.238	-0.0429	-0.58	-0.4389	-0.7495	1908925	Bionet1_001636	CO/N=C/Nc1nc2nccc(C(C)Oc3ccc(Cl)cc3C)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N19	compound treatment	1.078	-0.0407	-0.55	1.269	-0.0119	-0.16	-0.5025	-0.8782	1908926	Bionet1_001637	CN(C)/C=N/c1nc2ncc(c(\N=C\N(C)C)n2n1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N20	compound treatment	1.068	-0.0507	-0.68	1.268	-0.0129	-0.18	-0.6075	-0.8606	1908927	Bionet1_001638	CO/N=C/Nc1nc2nccc(C(C)Oc3ccc(cc3)C(C)(C)C)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N21	compound treatment	1.162	0.0433	0.58	1.273	-0.00786	-0.11	0.3374	0.5679	1908928	Bionet1_001639	COc1ccc(cc1)c2cnc3nc(/N=C/N(C)C)nn3c2/N=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	N22	compound treatment	1.089	-0.0297	-0.4	1.225	-0.0559	-0.76	-0.8218	-0.9549	1908929	Bionet1_001640	CC(Oc1ccc(OC(C)C(=O)/C=C/N(C)C)cc1)C(=O)/C=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O03	compound treatment	1.124	0.00532	0.07	1.273	-0.00786	-0.11	-0.0251	-0.1945	1473133	Bionet1_001641	COc1ccc(CNCC(O)(c2ccc(F)cc2)c3ccc(F)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O04	compound treatment	1.176	0.0573	0.77	1.307	0.0261	0.36	0.7988	0.9382	1233894	Bionet1_001642	Clc1ccc(C(C#N)c2ccc(cc2)C(=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O05	compound treatment	1.152	0.0333	0.45	1.236	-0.0449	-0.61	-0.1148	-0.1512	1344327	Bionet1_001643	OC(CNCc1ccc(F)cc1)(c2ccc(F)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O06	compound treatment	1.126	0.00732	0.1	1.293	0.0121	0.17	0.1868	0.9695	1677560	Bionet1_001644	NC(=O)C(c1ccc(cc1)C(=O)c2ccccc2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O07	compound treatment	1.115	-0.00368	-0.05	1.258	-0.0229	-0.31	-0.2556	-0.8096	1580259	Bionet1_001645	OC(CNCc1ccc(Cl)cc1)(c2ccccc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O08	compound treatment	1.142	0.0233	0.31	1.261	-0.0199	-0.27	0.0309	0.0745	1908930	Bionet1_001646	FC(F)(F)c1cnc(c(Cl)c1)C2(CCC(=O)NC2=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O09	compound treatment	1.187	0.0683	0.92	1.361	0.0801	1.09	1.4244	0.9964	1644110	Bionet1_001647	COc1ccc(CNCC(O)(c2ccccc2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O10	compound treatment	1.086	-0.0327	-0.44	1.298	0.0171	0.23	-0.1465	-0.2936	1207820	Bionet1_001648	Fc1ccc(cc1)C(=O)c2ccc(cc2)C(C#N)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O11	compound treatment	1.097	-0.0217	-0.29	1.276	-0.00486	-0.07	-0.2537	-0.8459	1489678	Bionet1_001649	OC(CNCc1ccc(Cl)cc1Cl)(c2ccccc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O12	compound treatment	1.145	0.0263	0.36	1.323	0.0421	0.57	0.6574	0.9732	1517547	Bionet1_001650	Fc1ccc(cc1)C(=O)c2ccc(cc2)C(C#N)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O13	compound treatment	1.109	-0.00968	-0.13	1.247	-0.0339	-0.46	-0.4189	-0.8729	1132342	Bionet1_001651	OC(CNCc1ccc(Cl)c(Cl)c1)(c2ccccc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O14	compound treatment	1.123	0.00432	0.06	1.297	0.0161	0.22	0.1968	0.8645	1286508	Bionet1_001652	NC(=O)C(c1ccc(Br)cc1)c2ccc(cc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O15	compound treatment	1.137	0.0183	0.25	1.27	-0.0109	-0.15	0.07	0.2429	1175998	Bionet1_001653	COc1ccccc1CNCC(O)(c2ccccc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O16	compound treatment	1.119	3.17E-4	0.0	1.275	-0.00586	-0.08	-0.0535	-0.6684	1908931	Bionet1_001654	Fc1ccc(cc1)C(=O)c2ccc(cc2)C(C#N)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O17	compound treatment	1.134	0.0153	0.21	1.266	-0.0149	-0.2	0.0028	0.0097	1174626	Bionet1_001655	CC1N(C(=O)c2ccc(F)cc2)c3ccccc3N(Cc4ccc(C#N)cc4)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O18	compound treatment	1.133	0.0143	0.19	1.335	0.0541	0.74	0.6586	0.8631	1359301	Bionet1_001656	Cc1onc(c1NC(=O)Nc2c(C)onc2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O19	compound treatment	1.147	0.0283	0.38	1.284	0.00314	0.04	0.3004	0.7814	1656400	Bionet1_001657	CC1N(C(=O)c2ccc(F)cc2)c3ccccc3N(Cc4ccccc4F)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O20	compound treatment	1.139	0.0203	0.27	1.339	0.0581	0.79	0.7544	0.8993	1908932	Bionet1_001658	Cc1nn(C)c(Sc2ccc(Cl)cc2)c1C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O21	compound treatment	1.124	0.00532	0.07	1.311	0.0301	0.41	0.3413	0.8181	1908933	Bionet1_001659	CC1N(C(=O)C2CC2)c3ccccc3N(Cc4ccc(cc4)[N+](=O)[O-])C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	O22	compound treatment	1.169	0.0503	0.68	1.312	0.0311	0.42	0.7802	0.9745	1256882	Bionet1_001660	Cc1nn(C)c(Oc2ccc(Cl)cc2)c1C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P03	compound treatment	1.101	-0.0177	-0.24	1.299	0.0181	0.25	0.0062	0.0181	1908934	Bionet1_001661	CO/N=C/Nc1nc2nccc(c3ccc(Oc4ccccc4)cc3)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P04	compound treatment	1.131	0.0123	0.17	1.217	-0.0639	-0.87	-0.4983	-0.5621	1908935	Bionet1_001662	CCNC(=O)Nc1ccccc1Sc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P05	compound treatment	1.124	0.00532	0.07	1.25	-0.0309	-0.42	-0.2469	-0.5783	1313795	Bionet1_001663	Cc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3c(Cl)cccc3Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P06	compound treatment	1.113	-0.00568	-0.08	1.244	-0.0369	-0.5	-0.4097	-0.8056	1908936	Bionet1_001664	O=C(c1ccccc1)c2ccc(cc2)C3(CCC(=O)NC3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P07	compound treatment	1.107	-0.0117	-0.16	1.246	-0.0349	-0.48	-0.4476	-0.8937	1587719	Bionet1_001665	Cc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3ccc(Cl)c(Cl)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P08	compound treatment	1.137	0.0183	0.25	1.242	-0.0389	-0.53	-0.2	-0.342	1406062	Bionet1_001666	Fc1ccc(Cn2cc(ccc2=O)C(=O)Nc3ccc(Cl)cc3)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P09	compound treatment	0.995	-0.124	-1.67	1.154	-0.127	-1.73	-2.4031	-0.9998	1908937	Bionet1_001667	Cc1ccc(cc1)c2cc(C#N)c(=O)n(Cc3cccc(c3)C(F)(F)F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P10	compound treatment	0.12	-0.999	-13.47	0.274	-1.01	-13.73	-19.2353	-1.0	1693527	Bionet1_001668	Cc1ccc(NC(=O)c2ccc(=O)n(Cc3ccc(F)c(F)c3)c2)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P11	compound treatment	1.099	-0.0197	-0.27	1.252	-0.0289	-0.39	-0.4661	-0.9817	1181820	Bionet1_001669	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P12	compound treatment	1.1	-0.0187	-0.25	1.2	-0.0809	-1.1	-0.9579	-0.8469	1170430	Bionet1_001670	COC(=O)c1ccccc1NC(=O)c2ccc(=O)n(Cc3ccc(F)c(F)c3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P13	compound treatment	1.105	-0.0137	-0.18	1.276	-0.00486	-0.07	-0.1774	-0.9045	1414407	Bionet1_001671	CN(C)C(=S)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P14	compound treatment	1.066	-0.0527	-0.71	1.223	-0.0579	-0.79	-1.0605	-0.9986	1908938	Bionet1_001672	COC(=O)c1cccn(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P15	compound treatment	1.116	-0.00268	-0.04	1.267	-0.0139	-0.19	-0.1593	-0.8275	1908939	Bionet1_001673	Cc1cc(cc(C)c1O)C(=O)CS(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P16	compound treatment	1.06	-0.0587	-0.79	1.255	-0.0259	-0.35	-0.8092	-0.9337	1908940	Bionet1_001674	CN(C(=O)c1cccn(Cc2ccc(cc2)C(F)(F)F)c1=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P17	compound treatment	1.1	-0.0187	-0.25	1.243	-0.0379	-0.52	-0.5433	-0.9456	1908941	Bionet1_001675	Cc1cc(cc(C)c1O)C(=O)CS(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P18	compound treatment	1.066	-0.0527	-0.71	1.29	0.00914	0.12	-0.4145	-0.5744	1908942	Bionet1_001676	FC(F)(F)c1ccc(Cn2cccc(C(=O)Nc3ccccc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P19	compound treatment	1.128	0.00932	0.13	1.271	-0.00986	-0.13	-0.0062	-0.0338	1908943	Bionet1_001677	Clc1ccc(cc1)c2cnc(SCc3ccc(Cl)c(Cl)c3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P20	compound treatment	1.061	-0.0577	-0.78	1.272	-0.00886	-0.12	-0.6357	-0.8072	1908944	Bionet1_001678	CNC(=O)c1cccn(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P21	compound treatment	1.104	-0.0147	-0.2	1.309	0.0281	0.38	0.1312	0.3039	1908945	Bionet1_001679	FC(F)(F)c1cccc(CSc2ncc(cn2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.572	P22	compound treatment	1.157	0.0383	0.52	1.224	-0.0569	-0.78	-0.1828	-0.1961	1908946	Bionet1_001680	CN1CCN(CC1)C(=O)c2cccn(Cc3ccc(cc3)C(F)(F)F)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A03	compound treatment	1.137	0.00362	0.05	1.3	0.00646	0.09	0.0969	0.9613	1908947	Bionet1_001681	FC(F)(F)c1ccc(Cn2cccc(C(=O)N3CCOCC3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A04	compound treatment	1.168	0.0346	0.47	1.308	0.0145	0.2	0.4698	0.9265	1908948	Bionet1_001682	Nc1ccc(Oc2c(cc(cc2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A05	compound treatment	1.155	0.0216	0.29	1.334	0.0405	0.55	0.5964	0.9556	1908949	Bionet1_001683	FC(F)(F)c1ccc(Cn2cccc(C(=O)NCc3ccccc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A06	compound treatment	1.133	-3.76E-4	-0.01	1.35	0.0565	0.77	0.5409	0.7024	1908950	Bionet1_001684	CO/N=C\Cc1snc(Sc2ncc(cc2Cl)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A07	compound treatment	1.105	-0.0284	-0.38	1.285	-0.00854	-0.12	-0.353	-0.8822	1908951	Bionet1_001685	FC(F)(F)c1ccc(Cn2cccc(C(=O)Nc3cccnc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A08	compound treatment	1.146	0.0126	0.17	1.366	0.0725	0.99	0.8192	0.8169	1229496	Bionet1_001686	Clc1ccc(cc1)S(=O)(=O)Nc2ccc(Oc3ncccn3)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A09	compound treatment	1.105	-0.0284	-0.38	1.228	-0.0655	-0.89	-0.9026	-0.9284	1908952	Bionet1_001687	FC(F)(F)c1ccc(Cn2cc(ccc2=O)C(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A10	compound treatment	1.164	0.0306	0.41	1.306	0.0125	0.17	0.4123	0.923	1715222	Bionet1_001688	Fc1ccc(cc1)S(=O)(=O)Nc2ccc(Oc3ncccn3)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A11	compound treatment	1.132	-0.00138	-0.02	1.272	-0.0215	-0.29	-0.2208	-0.7503	1318775	Bionet1_001689	CCCSc1cc(=O)n(nc1C(=O)Nc2cccc(Cl)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A12	compound treatment	1.176	0.0426	0.58	1.354	0.0605	0.82	0.9896	0.9845	1908953	Bionet1_001690	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc(Oc3ncccn3)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A13	compound treatment	1.036	-0.0974	-1.31	1.322	0.0285	0.39	-0.6544	-0.4778	1693496	Bionet1_001691	CCCSc1cc(=O)n(nc1C(=O)Nc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A14	compound treatment	1.122	-0.0114	-0.15	1.31	0.0165	0.22	0.0502	0.1847	1908954	Bionet1_001692	CC(C)NC(=O)c1cnc(Sc2ncc(cc2Cl)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A15	compound treatment	1.043	-0.0904	-1.22	1.323	0.0295	0.4	-0.578	-0.4503	1908955	Bionet1_001693	NC(=O)c1ccc(n(Cc2ccc(Cl)c(Cl)c2)c1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A16	compound treatment	1.232	0.0986	1.33	1.373	0.0795	1.08	1.707	0.9948	1908956	Bionet1_001694	CCCNC(=O)c1cnc(Sc2ncc(cc2Cl)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A17	compound treatment	1.127	-0.00638	-0.09	1.311	0.0175	0.24	0.1076	0.4248	1908957	Bionet1_001695	NC(=O)c1ccc(n(Cc2ccc(cc2)C(F)(F)F)c1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A18	compound treatment	1.144	0.0106	0.14	1.32	0.0265	0.36	0.3565	0.9182	1908958	Bionet1_001696	COC(=O)c1cnc(Sc2ncc(cc2Cl)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A19	compound treatment	1.135	0.00162	0.02	1.254	-0.0395	-0.54	-0.3657	-0.6778	1908959	Bionet1_001697	Cc1ccc(NC(=O)c2cccn(Cc3ccc(cc3)C(F)(F)F)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A20	compound treatment	1.127	-0.00638	-0.09	1.289	-0.00454	-0.06	-0.1046	-0.9869	1908960	Bionet1_001698	CC(c1nnc(S)n1c2ccccc2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A21	compound treatment	1.145	0.0116	0.16	1.276	-0.0175	-0.24	-0.0582	-0.2035	1908961	Bionet1_001699	NC(=O)c1ccc(n(Cc2cccc(c2)C(F)(F)F)c1=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	A22	compound treatment	1.12	-0.0134	-0.18	1.327	0.0335	0.46	0.1951	0.3975	1908962	Bionet1_001700	CSc1nnc(C(C)c2ncc(cc2Cl)C(F)(F)F)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B03	compound treatment	1.143	0.00962	0.13	1.293	-5.36E-4	-0.01	0.0866	0.6662	1734321	Bionet1_001701	CC(O)(CS(=O)(=O)Cc1ccc(Cl)cc1Cl)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B04	compound treatment	1.11	-0.0234	-0.32	1.31	0.0165	0.22	-0.0642	-0.1659	1908963	Bionet1_001702	COc1ccc(cc1)c2cc(n[nH]2)C3CCN(Cc4ccc(cc4)[N+](=O)[O-])CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B05	compound treatment	1.179	0.0456	0.62	1.276	-0.0175	-0.24	0.2661	0.403	1408080	Bionet1_001703	CC(O)(CS(=O)(=O)Cc1ccc(Cl)cc1Cl)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B06	compound treatment	1.117	-0.0164	-0.22	1.287	-0.00654	-0.09	-0.2192	-0.9203	1908964	Bionet1_001704	[O-][N+](=O)c1ccc(CN2CCC(CC2)c3cc([nH]n3)c4ccco4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B07	compound treatment	1.141	0.00762	0.1	1.32	0.0265	0.36	0.3279	0.8738	1248384	Bionet1_001705	CC(O)(CS(=O)(=O)Cc1ccccc1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B08	compound treatment	1.133	-3.76E-4	-0.01	1.321	0.0275	0.37	0.2612	0.6975	1583003	Bionet1_001706	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3cc([nH]n3)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B09	compound treatment	1.124	-0.00938	-0.13	1.306	0.0125	0.17	0.0307	0.1451	1312341	Bionet1_001707	CC(O)(CS(=O)(=O)Cc1ccc(Cl)cc1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B10	compound treatment	1.122	-0.0114	-0.15	1.287	-0.00654	-0.09	-0.1715	-0.9666	1677585	Bionet1_001708	Clc1cccc(NC(=O)N2CCC(CC2)c3cc([nH]n3)c4ccco4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B11	compound treatment	1.131	-0.00238	-0.03	1.351	0.0575	0.78	0.5314	0.6776	1251378	Bionet1_001709	CC(O)(CS(=O)(=O)Cc1ccc(Cl)cc1)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B12	compound treatment	1.097	-0.0364	-0.49	1.319	0.0255	0.35	-0.1015	-0.1688	1908965	Bionet1_001710	N(/N=C(\C(=N/Nc1ccccc1)\c2ccccc2)/c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B13	compound treatment	1.142	0.00862	0.12	1.355	0.0615	0.84	0.6749	0.7976	1430279	Bionet1_001711	COc1ccc(CS(=O)(=O)CC(C)(O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B14	compound treatment	1.138	0.00462	0.06	1.298	0.00446	0.06	0.0872	0.9999	1908966	Bionet1_001712	CCOC(=O)C1=NOC(CNC(=O)C2CCN(CC2)c3ncccn3)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B15	compound treatment	1.173	0.0396	0.53	1.26	-0.0335	-0.46	0.0546	0.0776	1619236	Bionet1_001713	CC(O)(CS(=O)(=O)Cc1ccccc1Cl)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B16	compound treatment	1.119	-0.0144	-0.19	1.344	0.0505	0.69	0.3495	0.4888	1908967	Bionet1_001714	FC(F)(F)c1cnc(Sc2nccn2c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B17	compound treatment	1.131	-0.00238	-0.03	1.286	-0.00754	-0.1	-0.0953	-0.8856	1654437	Bionet1_001715	COC(=O)c1cccnc1N2CCN(CC2)C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B18	compound treatment	1.13	-0.00338	-0.05	1.276	-0.0175	-0.24	-0.2013	-0.8269	1908968	Bionet1_001716	CN(NC(=S)NC(=O)c1ccccc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B19	compound treatment	1.119	-0.0144	-0.19	1.367	0.0735	1.0	0.5712	0.5598	1908969	Bionet1_001717	COC(=O)c1ccccc1Sc2c(CO)c(nn2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B20	compound treatment	1.129	-0.00438	-0.06	1.293	-5.36E-4	-0.01	-0.0469	-0.7886	1377112	Bionet1_001718	COc1ccc(cc1)C(=O)N2CCOC32CCN(CC3)c4ccc(Cl)nn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B21	compound treatment	1.097	-0.0364	-0.49	1.343	0.0495	0.67	0.1299	0.1558	1412512	Bionet1_001719	Clc1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	B22	compound treatment	1.123	-0.0104	-0.14	1.311	0.0175	0.24	0.0694	0.2513	1908970	Bionet1_001720	CC(=O)C1=NOC(CNC(=O)c2c(C)onc2c3ccccc3Cl)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C03	compound treatment	1.104	-0.0294	-0.4	1.269	-0.0245	-0.33	-0.5168	-0.9965	1908971	Bionet1_001721	CN(C)C(=O)c1cc(Cl)cn(Cc2ccc(cc2)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C04	compound treatment	1.175	0.0416	0.56	1.298	0.00446	0.06	0.4401	0.7792	1908972	Bionet1_001722	CC(c1nnc(SCC=C)n1C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C05	compound treatment	1.126	-0.00738	-0.1	1.303	0.00946	0.13	0.0209	0.1282	1707687	Bionet1_001723	Cc1cc2nc(c3ccc(Cl)nc3)n(Cc4ccc(Cl)cc4)c2cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C06	compound treatment	1.154	0.0206	0.28	1.303	0.00946	0.13	0.288	0.939	1908973	Bionet1_001724	Sc1nnc(CSCc2c(Cl)cccc2Cl)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C07	compound treatment	1.132	-0.00138	-0.02	1.278	-0.0155	-0.21	-0.1629	-0.7661	1250698	Bionet1_001725	COc1ccc(Cn2c(nc3cc(C)c(C)cc23)c4ccc(Cl)nc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C08	compound treatment	1.171	0.0376	0.51	1.353	0.0595	0.81	0.9323	0.9745	1292960	Bionet1_001726	CC(C)(C)c1ccc(COc2ccsc2C(=O)Nc3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C09	compound treatment	1.14	0.00662	0.09	1.272	-0.0215	-0.29	-0.1445	-0.4706	1385613	Bionet1_001727	Cc1ccc(Cn2c(nc3cc(C)c(C)cc23)c4ccc(Cl)nc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C10	compound treatment	1.105	-0.0284	-0.38	1.325	0.0315	0.43	0.0327	0.0569	1908974	Bionet1_001728	CCn1c(S)nnc1CS(=O)Cc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C11	compound treatment	1.111	-0.0224	-0.3	1.346	0.0525	0.72	0.2924	0.3766	1908975	Bionet1_001729	CCOC(=O)Cn1c(nc2cc(Cl)c(Cl)cc12)c3cccnc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C12	compound treatment	1.197	0.0636	0.86	1.38	0.0865	1.18	1.4406	0.9878	1908976	Bionet1_001730	Sc1nnc(CSCc2ccc(Cl)cc2Cl)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C13	compound treatment	1.157	0.0236	0.32	1.359	0.0655	0.89	0.8566	0.9037	1908977	Bionet1_001731	FC(F)(F)c1cccc(Cn2nnnc2c3cc(Cl)cc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C14	compound treatment	1.181	0.0476	0.64	1.361	0.0675	0.92	1.1048	0.9846	1908978	Bionet1_001732	CSc1nnc(CSCc2ccc(Cl)cc2Cl)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C15	compound treatment	1.129	-0.00438	-0.06	1.276	-0.0175	-0.24	-0.2108	-0.856	1282281	Bionet1_001733	Cc1c(oc2c(Br)cc(Br)cc12)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C16	compound treatment	1.16	0.0266	0.36	1.351	0.0575	0.78	0.8081	0.9374	1908979	Bionet1_001734	CCn1c(S)nnc1CS(=O)Cc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C17	compound treatment	1.096	-0.0374	-0.5	1.327	0.0335	0.46	-0.0339	-0.0498	1182767	Bionet1_001735	Cc1c(oc2ccc(Br)cc12)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C18	compound treatment	1.126	-0.00738	-0.1	1.348	0.0545	0.74	0.4548	0.6069	1242855	Bionet1_001736	COc1ccc(COc2ccsc2C(=O)Nc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C19	compound treatment	1.139	0.00562	0.08	1.332	0.0385	0.52	0.4245	0.8011	1346812	Bionet1_001737	Cc1c(oc2ccc(Br)cc12)C(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C20	compound treatment	1.146	0.0126	0.17	1.301	0.00746	0.1	0.1924	0.9697	1222750	Bionet1_001738	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C21	compound treatment	1.179	0.0456	0.62	1.221	-0.0725	-0.99	-0.2642	-0.2268	1092671	Bionet1_001739	COC(=O)c1c(C(=O)OC)c2CCCn2c1c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	C22	compound treatment	1.187	0.0536	0.72	1.36	0.0665	0.91	1.1524	0.9938	1549187	Bionet1_001740	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D03	compound treatment	1.12	-0.0134	-0.18	1.326	0.0325	0.44	0.1854	0.3879	1716876	Bionet1_001741	Cn1c(SCc2ccccc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D04	compound treatment	1.137	0.00362	0.05	1.335	0.0415	0.57	0.4344	0.7654	1908980	Bionet1_001742	CCOC(=O)/C=C(\C)/NCCNc1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D05	compound treatment	1.121	-0.0124	-0.17	1.359	0.0655	0.89	0.5132	0.5651	1382998	Bionet1_001743	CCCn1c(SCc2ccccc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D06	compound treatment	1.072	-0.0614	-0.83	1.284	-0.00954	-0.13	-0.6774	-0.8083	1908981	Bionet1_001744	Cc1ccc(cc1)c2nnc(C)c(Sc3c(Cl)cccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D07	compound treatment	1.157	0.0236	0.32	1.269	-0.0245	-0.33	-0.0112	-0.0243	1331294	Bionet1_001745	C=CCn1c(SCc2ccccc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D08	compound treatment	1.084	-0.0494	-0.67	1.262	-0.0315	-0.43	-0.7751	-0.9776	1908982	Bionet1_001746	Cc1ccc(cc1)c2nnc(C)c(Sc3cccc(c3)C(F)(F)F)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D09	compound treatment	1.132	-0.00138	-0.02	1.329	0.0355	0.48	0.3288	0.6795	1182579	Bionet1_001747	C#CCn1c(SCc2ccccc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D10	compound treatment	1.108	-0.0254	-0.34	1.26	-0.0335	-0.46	-0.5654	-0.9898	1345564	Bionet1_001748	CCOC(=O)n1c(=O)n(Cc2ccc(Cl)cc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D11	compound treatment	1.103	-0.0304	-0.41	1.264	-0.0295	-0.4	-0.5746	-1.0	1908983	Bionet1_001749	Cn1nc(c(COC(=O)c2ccc(Cl)c(Cl)c2)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D12	compound treatment	1.156	0.0226	0.31	1.259	-0.0345	-0.47	-0.1172	-0.2088	1494248	Bionet1_001750	CCOC(=O)n1c(=O)n(Cc2ccc(Cl)c(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D13	compound treatment	1.187	0.0536	0.72	1.288	-0.00554	-0.08	0.4582	0.6299	1908984	Bionet1_001751	Cn1nc(c(COC(=O)c2ccc(Cl)cc2Cl)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D14	compound treatment	1.148	0.0146	0.2	1.255	-0.0385	-0.53	-0.2321	-0.4135	1238936	Bionet1_001752	CCOC(=O)n1c(=O)n(Cc2c(Cl)cccc2Cl)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D15	compound treatment	1.077	-0.0564	-0.76	1.306	0.0125	0.17	-0.4176	-0.5359	1908985	Bionet1_001753	Cn1nc(c(COC(=O)c2ccc(cc2)[N+](=O)[O-])c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D16	compound treatment	1.149	0.0156	0.21	1.319	0.0255	0.35	0.3946	0.9714	1908986	Bionet1_001754	CS(=O)(=O)c1ccccc1c2nnc(o2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D17	compound treatment	1.172	0.0386	0.52	1.27	-0.0235	-0.32	0.1415	0.2312	1908987	Bionet1_001755	Cn1c(SCc2ccc(Cl)cc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D18	compound treatment	1.16	0.0266	0.36	1.291	-0.00254	-0.03	0.2295	0.6361	1908988	Bionet1_001756	Clc1ccc(CSc2ccccc2c3nnc(o3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D19	compound treatment	1.158	0.0246	0.33	1.332	0.0385	0.52	0.6058	0.9757	1908989	Bionet1_001757	Cn1nc(c(CO)c1Sc2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D20	compound treatment	1.13	-0.00338	-0.05	1.318	0.0245	0.33	0.2037	0.605	1908990	Bionet1_001758	Cc1ccc(cc1)c2nnc(o2)c3ccccc3SCc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D21	compound treatment	1.144	0.0106	0.14	1.249	-0.0445	-0.61	-0.3281	-0.5258	1908991	Bionet1_001759	Cc1ccc(Oc2c(COC(=O)CCl)c(nn2C)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	D22	compound treatment	1.09	-0.0434	-0.59	1.316	0.0225	0.31	-0.1972	-0.2985	1908992	Bionet1_001760	O=S(=O)(Cc1ccccc1)c2ccccc2c3nnc(o3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E03	compound treatment	1.105	-0.0284	-0.38	1.31	0.0165	0.22	-0.1119	-0.2522	1908993	Bionet1_001761	COC(=O)c1c(C(=O)OC)c2CCCn2c1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E04	compound treatment	1.133	-3.76E-4	-0.01	1.292	-0.00154	-0.02	-0.0184	-0.8537	1375946	Bionet1_001762	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E05	compound treatment	1.092	-0.0414	-0.56	1.291	-0.00254	-0.03	-0.4192	-0.7495	1908994	Bionet1_001763	Cc1ccn2c(=O)nc(SCc3cccc(c3)C(F)(F)F)nc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E06	compound treatment	1.133	-3.76E-4	-0.01	1.311	0.0175	0.24	0.1648	0.6919	1534835	Bionet1_001764	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E07	compound treatment	1.16	0.0266	0.36	1.305	0.0115	0.16	0.3645	0.9306	1908995	Bionet1_001765	CN(C)/C=N/c1nc(N2CCN(CC2)c3ccccn3)c(C#N)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E08	compound treatment	1.158	0.0246	0.33	1.32	0.0265	0.36	0.4901	0.9991	1515561	Bionet1_001766	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E09	compound treatment	1.145	0.0116	0.16	1.309	0.0155	0.21	0.26	0.9894	1908996	Bionet1_001767	CC1=C(CC(=O)c2sccc2Br)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E10	compound treatment	1.162	0.0286	0.39	1.333	0.0395	0.54	0.6536	0.9867	1908997	Bionet1_001768	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E11	compound treatment	1.087	-0.0464	-0.63	1.266	-0.0275	-0.38	-0.7079	-0.9702	1908998	Bionet1_001769	Clc1cccc(CNCCNCc2cccc(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E12	compound treatment	1.108	-0.0254	-0.34	1.339	0.0455	0.62	0.1963	0.2772	1908999	Bionet1_001770	Oc1cc(nc(=O)n1Cc2ccccc2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E13	compound treatment	1.116	-0.0174	-0.23	1.373	0.0795	1.08	0.6005	0.5416	1909000	Bionet1_001771	FC(F)(F)c1cccc(Sc2nc3ccccc3nc2C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E14	compound treatment	1.127	-0.00638	-0.09	1.316	0.0225	0.31	0.1558	0.4896	1488811	Bionet1_001772	OC(CSc1ccc(Cl)cc1)CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E15	compound treatment	1.178	0.0446	0.6	1.321	0.0275	0.37	0.6905	0.9739	1909001	Bionet1_001773	CC(C)NS(=O)(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E16	compound treatment	1.144	0.0106	0.14	1.281	-0.0125	-0.17	-0.0195	-0.0876	1909002	Bionet1_001774	OC(CSc1cccc(c1)C(F)(F)F)CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E17	compound treatment	1.142	0.00862	0.12	1.335	0.0415	0.57	0.4821	0.8351	1909003	Bionet1_001775	CCCNS(=O)(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E18	compound treatment	1.13	-0.00338	-0.05	1.34	0.0465	0.63	0.4158	0.6546	1375708	Bionet1_001776	OC(CSc1cccc(Cl)c1)CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E19	compound treatment	1.164	0.0306	0.41	1.324	0.0305	0.42	0.5859	1.0	1909004	Bionet1_001777	N/C(=C(\C=C(C#N)C#N)/C#N)/N1CCN(CC1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E20	compound treatment	1.173	0.0396	0.53	1.367	0.0735	1.0	1.0864	0.9567	1659409	Bionet1_001778	OC(CSc1ccccc1Cl)CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E21	compound treatment	1.143	0.00962	0.13	1.327	0.0335	0.46	0.4145	0.8736	1909005	Bionet1_001779	CN(C)/C=N/c1nc(N2CCN(CC2)c3cccc(Cl)n3)c(C#N)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	E22	compound treatment	1.16	0.0266	0.36	1.339	0.0455	0.62	0.6924	0.9663	1477976	Bionet1_001780	OC(CSc1ccc(Cl)cc1)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F03	compound treatment	1.128	-0.00538	-0.07	1.301	0.00746	0.1	0.0207	0.1655	1909006	Bionet1_001781	Cn1nc(c(CO)c1Sc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F04	compound treatment	1.12	-0.0134	-0.18	1.24	-0.0535	-0.73	-0.6438	-0.8561	1909007	Bionet1_001782	Cc1ccc(CSc2ccccc2c3nnc(o3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F05	compound treatment	1.133	-3.76E-4	-0.01	1.316	0.0225	0.31	0.213	0.6953	1909008	Bionet1_001783	Cn1nc(c(COC(=O)Nc2ccc(Cl)cc2)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F06	compound treatment	1.112	-0.0214	-0.29	1.239	-0.0545	-0.74	-0.7298	-0.9149	1909009	Bionet1_001784	Cc1ccc(CSc2ccccc2c3nnc(o3)c4ccc(C)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F07	compound treatment	1.127	-0.00638	-0.09	1.259	-0.0345	-0.47	-0.3938	-0.8227	1909010	Bionet1_001785	CC(C)(C)c1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F08	compound treatment	1.128	-0.00538	-0.07	1.318	0.0245	0.33	0.1846	0.5407	1909011	Bionet1_001786	Cc1ccc(CSc2ccccc2c3nnc(o3)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F09	compound treatment	1.117	-0.0164	-0.22	1.246	-0.0475	-0.65	-0.6146	-0.8974	1909012	Bionet1_001787	Cn1nc(c(CO)c1Sc2c(Cl)cccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F10	compound treatment	1.099	-0.0344	-0.46	1.24	-0.0535	-0.73	-0.8441	-0.976	1909013	Bionet1_001788	Cc1ccc(CS(=O)c2ccccc2c3nnc(o3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F11	compound treatment	1.157	0.0236	0.32	1.287	-0.00654	-0.09	0.1623	0.4905	1909014	Bionet1_001789	COCc1c(Sc2c(Cl)cccc2Cl)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F12	compound treatment	1.14	0.00662	0.09	1.253	-0.0405	-0.55	-0.3277	-0.5852	1909015	Bionet1_001790	Cc1ccc(CS(=O)(=O)c2ccccc2c3nnc(o3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F13	compound treatment	1.17	0.0366	0.49	1.299	0.00546	0.07	0.4021	0.8046	1909016	Bionet1_001791	Cn1nc(c(COCc2c(Cl)cccc2Cl)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F14	compound treatment	1.12	-0.0134	-0.18	1.244	-0.0495	-0.68	-0.6052	-0.8656	1909017	Bionet1_001792	CNC(=O)c1cnn(c2nc(cs2)c3ccc(Cl)cc3)c1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F15	compound treatment	1.139	0.00562	0.08	1.286	-0.00754	-0.1	-0.019	-0.1489	1909018	Bionet1_001793	CN(C)c1nnnn1c2ccc(Oc3ncc(cc3Cl)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F16	compound treatment	1.135	0.00162	0.02	1.272	-0.0215	-0.29	-0.1922	-0.6525	1909019	Bionet1_001794	CNC(=O)c1cnn(c2nc(cs2)c3ccccc3)c1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F17	compound treatment	1.144	0.0106	0.14	1.326	0.0325	0.44	0.4144	0.8905	1909020	Bionet1_001795	CN(C)c1nnnn1c2cccc(Oc3ncc(cc3Cl)C(F)(F)F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F18	compound treatment	1.139	0.00562	0.08	1.221	-0.0725	-0.99	-0.6458	-0.651	1909021	Bionet1_001796	FC(F)(F)c1c(cnn1c2nc(cs2)c3ccccc3)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F19	compound treatment	1.113	-0.0204	-0.27	1.3	0.00646	0.09	-0.132	-0.4574	1909022	Bionet1_001797	CN(C)c1nnnn1c2ccccc2Oc3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F20	compound treatment	1.168	0.0346	0.47	1.29	-0.00354	-0.05	0.2962	0.6308	1909023	Bionet1_001798	COc1ccc(cc1)C(=O)NCCSc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F21	compound treatment	1.149	0.0156	0.21	1.292	-0.00154	-0.02	0.1342	0.6337	1909024	Bionet1_001799	CN(C)/C=N/c1nnc(s1)\C(=C\c2ccc(Cl)cc2Cl)\C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	F22	compound treatment	1.087	-0.0464	-0.63	1.274	-0.0195	-0.27	-0.6308	-0.9276	1909025	Bionet1_001800	Clc1ccc(SCCNC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G03	compound treatment	1.132	-0.00138	-0.02	1.277	-0.0165	-0.23	-0.1726	-0.7627	1390729	Bionet1_001801	Cc1c(oc2c(Cl)cc(Cl)cc12)C(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G04	compound treatment	1.145	0.0116	0.16	1.328	0.0345	0.47	0.4432	0.8946	1288139	Bionet1_001802	OC(CSc1ccc(F)cc1)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G05	compound treatment	1.108	-0.0254	-0.34	1.255	-0.0385	-0.53	-0.6137	-0.9784	1909026	Bionet1_001803	Cc1c(oc2c(Cl)cc(Cl)cc12)C(=O)c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G06	compound treatment	1.175	0.0416	0.56	1.298	0.00446	0.06	0.4401	0.7792	1650823	Bionet1_001804	OC(CSc1cccc(Cl)c1)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G07	compound treatment	1.127	-0.00638	-0.09	1.304	0.0105	0.14	0.0401	0.2405	1507563	Bionet1_001805	Cc1cc2nc([nH]c2cc1C)C(Cc3ccccc3)NC(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G08	compound treatment	1.126	-0.00738	-0.1	1.286	-0.00754	-0.1	-0.143	-0.9999	1693783	Bionet1_001806	Cc1ccc(SCC(O)CN2CCN(CC2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G09	compound treatment	1.139	0.00562	0.08	1.327	0.0335	0.46	0.3763	0.8135	1214826	Bionet1_001807	COc1cccc(c1)C(=O)NC(Cc2ccccc2)c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G10	compound treatment	1.149	0.0156	0.21	1.275	-0.0185	-0.25	-0.0297	-0.0902	1304653	Bionet1_001808	Cc1ccc(SCC(O)CN2CCN(CC2)c3ccccc3F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G11	compound treatment	1.126	-0.00738	-0.1	1.308	0.0145	0.2	0.0691	0.3128	1524482	Bionet1_001809	COc1cccc(c1)C(=O)NC(Cc2ccccc2)c3nc4cc(C)ccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G12	compound treatment	1.177	0.0436	0.59	1.3	0.00646	0.09	0.4785	0.804	1469852	Bionet1_001810	OC(CSc1ccc(F)cc1)CN2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G13	compound treatment	1.08	-0.0534	-0.72	1.323	0.0295	0.4	-0.2251	-0.2729	1650256	Bionet1_001811	Fc1ccccc1C(=O)NC(Cc2ccccc2)c3nc4ccccc4[nH]3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G14	compound treatment	1.139	0.00562	0.08	1.296	0.00246	0.03	0.0774	0.9329	1430519	Bionet1_001812	OC(CSc1ccccc1Cl)CN2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G15	compound treatment	1.178	0.0446	0.6	1.28	-0.0135	-0.18	0.2952	0.4688	1304217	Bionet1_001813	Cc1cc2nc([nH]c2cc1C)C(Cc3ccccc3)NC(=O)c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G16	compound treatment	1.163	0.0296	0.4	1.326	0.0325	0.44	0.5956	0.9987	1194683	Bionet1_001814	OC(CSc1ccccc1Cl)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G17	compound treatment	1.137	0.00362	0.05	1.276	-0.0175	-0.24	-0.1345	-0.5511	1415859	Bionet1_001815	CC(C)C(NC(=O)c1ccc(Cl)cc1Cl)c2nc3ccccc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G18	compound treatment	1.157	0.0236	0.32	1.313	0.0195	0.27	0.413	0.9959	1909027	Bionet1_001816	CCCCSc1nnc(CNS(=O)(=O)c2ccc(Cl)cc2)n1CC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G19	compound treatment	1.117	-0.0164	-0.22	1.291	-0.00254	-0.03	-0.1807	-0.808	1711863	Bionet1_001817	Clc1ccc(Cn2c(nc3ccccc23)c4cccnc4Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G20	compound treatment	1.15	0.0166	0.22	1.299	0.00546	0.07	0.2113	0.894	1909028	Bionet1_001818	CCn1c(CNS(=O)(=O)c2ccc(Cl)cc2)nnc1SCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G21	compound treatment	1.18	0.0466	0.63	1.33	0.0365	0.5	0.7964	0.9932	1909029	Bionet1_001819	Clc1ccc(Cn2c(nc3ccccc23)c4cccnc4Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	G22	compound treatment	1.17	0.0366	0.49	1.375	0.0815	1.11	1.1349	0.9334	1409296	Bionet1_001820	OC(CSc1ccc(Cl)cc1)CN2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H03	compound treatment	1.111	-0.0224	-0.3	1.311	0.0175	0.24	-0.0451	-0.1172	1909030	Bionet1_001821	CO/N=C/Nc1nnc(s1)/C(=C/c2ccc(Cl)cc2Cl)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H04	compound treatment	1.057	-0.0764	-1.03	1.25	-0.0435	-0.59	-1.1484	-0.9657	1909031	Bionet1_001822	FC(F)(F)c1cccc(c1)c2cc3ccccc3nc2Oc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H05	compound treatment	1.133	-3.76E-4	-0.01	1.318	0.0245	0.33	0.2323	0.6963	1909032	Bionet1_001823	COc1ccc(/C=C(\C#N)/c2nnc(\N=C\Nc3ccc(Cl)cc3)s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H06	compound treatment	1.084	-0.0494	-0.67	1.272	-0.0215	-0.29	-0.6787	-0.9323	1909033	Bionet1_001824	FC(F)(F)c1cccc(c1)c2cc3ccccc3nc2Oc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H07	compound treatment	1.155	0.0216	0.29	1.271	-0.0225	-0.31	-0.011	-0.026	1909034	Bionet1_001825	[O-][N+](=O)C(/C=N/OCc1c(F)cccc1Cl)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H08	compound treatment	1.12	-0.0134	-0.18	1.244	-0.0495	-0.68	-0.6052	-0.8656	1909035	Bionet1_001826	Fc1ccc(Oc2nc3ccccc3cc2c4cccc(c4)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H09	compound treatment	1.157	0.0236	0.32	1.301	0.00746	0.1	0.2973	0.8887	1909036	Bionet1_001827	Clc1cccc(Cl)c1CSc2nccc(/C=C/c3cccs3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H10	compound treatment	1.175	0.0416	0.56	1.278	-0.0155	-0.21	0.2473	0.412	1909037	Bionet1_001828	Cc1cc(C)cc(Oc2nc3ccccc3cc2c4cccc(c4)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H11	compound treatment	1.111	-0.0224	-0.3	1.316	0.0225	0.31	0.0032	0.0073	1909038	Bionet1_001829	FC(F)(F)c1cnc(Sc2nccc(/C=C/c3cccs3)n2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H12	compound treatment	1.131	-0.00238	-0.03	1.272	-0.0215	-0.29	-0.2303	-0.7797	1909039	Bionet1_001830	COc1ccc(Oc2nc3ccccc3cc2c4cccc(c4)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H13	compound treatment	1.112	-0.0214	-0.29	1.285	-0.00854	-0.12	-0.2862	-0.9204	1909040	Bionet1_001831	Cc1nc(c(s1)C(=O)NCc2cccc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H14	compound treatment	1.134	6.24E-4	0.01	1.346	0.0525	0.72	0.5118	0.7154	1508829	Bionet1_001832	Cc1ccc(C)c(SCc2nc3ccccc3c(=O)n2c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H15	compound treatment	1.146	0.0126	0.17	1.289	-0.00454	-0.06	0.0767	0.4232	1909041	Bionet1_001833	CN(C)/C=C(\C#N)/C(=O)CSc1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H16	compound treatment	1.09	-0.0434	-0.59	1.284	-0.00954	-0.13	-0.5057	-0.8437	1909042	Bionet1_001834	CCOC(=O)CN(c1ccccc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H17	compound treatment	1.116	-0.0174	-0.23	1.301	0.00746	0.1	-0.0938	-0.367	1716227	Bionet1_001835	Clc1ccc(cc1)c2onc3ccc(cc23)c4ccnn4c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H18	compound treatment	1.135	0.00162	0.02	1.257	-0.0365	-0.5	-0.3368	-0.6754	1909043	Bionet1_001836	COc1ccc(cc1)S(=O)(=O)N(CC(=O)NC(C)(C)C#C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H19	compound treatment	1.151	0.0176	0.24	1.203	-0.0905	-1.23	-0.7049	-0.5606	1321454	Bionet1_001837	CCOC(=O)c1nocc1C(=O)c2ccc3noc(c4ccc(Cl)cc4)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H20	compound treatment	1.125	-0.00838	-0.11	1.25	-0.0435	-0.59	-0.4997	-0.8269	1553649	Bionet1_001838	COc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H21	compound treatment	1.155	0.0216	0.29	1.318	0.0245	0.33	0.4422	0.9978	1909044	Bionet1_001839	C/C(=C(/C#N)\C(=O)N)/Nc1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	H22	compound treatment	1.095	-0.0384	-0.52	1.302	0.00846	0.12	-0.2845	-0.5363	1187229	Bionet1_001840	COc1ccc(cc1)S(=O)(=O)N(CC(=O)N2CCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I03	compound treatment	1.127	-0.00638	-0.09	1.346	0.0525	0.72	0.4451	0.6176	1909045	Bionet1_001841	COc1cccc(Cn2c(nc3ccccc23)c4cccnc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I04	compound treatment	1.128	-0.00538	-0.07	1.299	0.00546	0.07	0.0014	0.0135	1384369	Bionet1_001842	OC(CSc1ccc(Cl)c(Cl)c1)CN2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I05	compound treatment	1.1	-0.0334	-0.45	1.284	-0.00954	-0.13	-0.4103	-0.8755	1477856	Bionet1_001843	Clc1cccc(Cl)c1Cn2c(nc3ccccc23)c4cccnc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I06	compound treatment	1.174	0.0406	0.55	1.288	-0.00554	-0.08	0.3341	0.604	1909046	Bionet1_001844	CCOC(=O)C1=C(C)N(Cc2ccc(Cl)cc2Cl)c3ccccc3S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I07	compound treatment	1.119	-0.0144	-0.19	1.256	-0.0375	-0.51	-0.4991	-0.9118	1165855	Bionet1_001845	Fc1cccc(Cl)c1Cn2c(nc3ccccc23)c4cccnc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I08	compound treatment	1.154	0.0206	0.28	1.315	0.0215	0.29	0.4037	0.9997	1909047	Bionet1_001846	CCOC(=O)C1=C(C)N(Cc2c(Cl)cccc2Cl)c3ccccc3S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I09	compound treatment	1.134	6.24E-4	0.01	1.302	0.00846	0.12	0.0876	0.7567	1909048	Bionet1_001847	Clc1cccc(Cn2c(nc3ccccc23)c4cccnc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I10	compound treatment	1.124	-0.00938	-0.13	1.335	0.0415	0.57	0.3104	0.5357	1909049	Bionet1_001848	CCOC(=O)C1=C(C)N(Cc2c(F)cccc2Cl)c3ccccc3S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I11	compound treatment	1.114	-0.0194	-0.26	1.261	-0.0325	-0.44	-0.4986	-0.9682	1909050	Bionet1_001849	Clc1ccc(Cn2c(nc3ccccc23)c4cccnc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I12	compound treatment	1.115	-0.0184	-0.25	1.323	0.0295	0.4	0.1088	0.2305	1909051	Bionet1_001850	CCOC(=O)C1=C(C)N(Cc2ccccc2Cl)c3ccccc3S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I13	compound treatment	1.167	0.0336	0.45	1.303	0.00946	0.13	0.412	0.8736	1909052	Bionet1_001851	FC(F)(F)c1cccc(Cn2c(nc3ccccc23)c4cccnc4Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I14	compound treatment	1.135	0.00162	0.02	1.307	0.0135	0.18	0.1453	0.7859	1909053	Bionet1_001852	CCOC(=O)C1=C(C)N(Cc2cc(Cl)ccc2Cl)c3ccccc3S1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I15	compound treatment	1.115	-0.0184	-0.25	1.282	-0.0115	-0.16	-0.2865	-0.9759	1909054	Bionet1_001853	FC(F)(F)c1ccc(Cn2c(nc3ccccc23)c4cccnc4Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I16	compound treatment	1.156	0.0226	0.31	1.296	0.00246	0.03	0.2396	0.7802	1909055	Bionet1_001854	FC(F)(F)c1cnc(/C(=N/Nc2ccccc2)/c3cccnc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I17	compound treatment	1.119	-0.0144	-0.19	1.299	0.00546	0.07	-0.0845	-0.4065	1182447	Bionet1_001855	CC(C)C(NC(=O)c1ccccc1Cl)c2nc3cc(C)c(C)cc3[nH]2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I18	compound treatment	1.175	0.0416	0.56	1.214	-0.0795	-1.08	-0.3699	-0.3028	1909056	Bionet1_001856	CN1CCN(CC1)c2cc(cnc2C(=O)c3ccc(cc3)[N+](=O)[O-])C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I19	compound treatment	1.123	-0.0104	-0.14	1.373	0.0795	1.08	0.6672	0.6107	1652329	Bionet1_001857	Cc1ccc(SCc2nc3ccccc3n2CC(=O)Nc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I20	compound treatment	1.154	0.0206	0.28	1.373	0.0795	1.08	0.963	0.8607	1909057	Bionet1_001858	[O-][N+](=O)c1ccc(cc1)C(=O)c2ncc(cc2N3CCOCC3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I21	compound treatment	1.118	-0.0154	-0.21	1.335	0.0415	0.57	0.2531	0.4203	1909058	Bionet1_001859	COc1ccc(NC(=O)CS(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	I22	compound treatment	1.154	0.0206	0.28	1.356	0.0625	0.85	0.799	0.8917	1909059	Bionet1_001860	FC(F)(F)c1cnc(C(=O)c2ccc(Cl)cc2)c(c1)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J03	compound treatment	1.138	0.00462	0.06	1.33	0.0365	0.5	0.3957	0.7896	1909060	Bionet1_001861	CN(C)/C=C/c1nc(C)c(C#N)c(c1C#N)c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J04	compound treatment	1.126	-0.00738	-0.1	1.274	-0.0195	-0.27	-0.2587	-0.9098	1376871	Bionet1_001862	CN(C)C(=O)CN(c1ccccc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J05	compound treatment	1.121	-0.0124	-0.17	1.291	-0.00254	-0.03	-0.1425	-0.8358	1909061	Bionet1_001863	CN(C)/C=C/c1c(C#N)c(=O)ncn1N(C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J06	compound treatment	1.12	-0.0134	-0.18	1.234	-0.0595	-0.81	-0.7017	-0.8437	1909062	Bionet1_001864	Clc1ccc(cc1)S(=O)(=O)N(CC(=O)NCC=C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J07	compound treatment	1.135	0.00162	0.02	1.261	-0.0325	-0.44	-0.2982	-0.6714	1909063	Bionet1_001865	COc1ccc(CCn2cnc(=O)c(C#N)c2/C=C/N(C)C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J08	compound treatment	1.127	-0.00638	-0.09	1.27	-0.0235	-0.32	-0.2878	-0.8661	1389648	Bionet1_001866	Fc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J09	compound treatment	1.131	-0.00238	-0.03	1.286	-0.00754	-0.1	-0.0953	-0.8856	1909064	Bionet1_001867	C/C(=N/Nc1ccccc1F)/c2ccc3noc(c4ccc(F)cc4)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J10	compound treatment	1.124	-0.00938	-0.13	1.222	-0.0715	-0.98	-0.7792	-0.7922	1529841	Bionet1_001868	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J11	compound treatment	1.16	0.0266	0.36	1.293	-5.36E-4	-0.01	0.2488	0.6926	1909065	Bionet1_001869	Fc1ccc(cc1)c2onc3ccc(cc23)c4ccn(n4)c5cccc(F)c5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J12	compound treatment	1.142	0.00862	0.12	1.205	-0.0885	-1.21	-0.7714	-0.636	1554895	Bionet1_001870	CN(C)C(=O)CN(c1ccccc1)S(=O)(=O)c2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J13	compound treatment	1.154	0.0206	0.28	1.288	-0.00554	-0.08	0.1434	0.4973	1909066	Bionet1_001871	Fc1ccc(cc1)c2onc3ccc(cc23)c4ccn(n4)c5ccccc5F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J14	compound treatment	1.149	0.0156	0.21	1.213	-0.0805	-1.1	-0.6275	-0.5612	1416296	Bionet1_001872	Fc1ccc(cc1)S(=O)(=O)N(CC(=O)N2CCCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J15	compound treatment	1.127	-0.00638	-0.09	1.268	-0.0255	-0.35	-0.3071	-0.856	1909067	Bionet1_001873	FC(F)(F)c1cnc(NCCNc2cc[nH]c(=O)c2C#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J16	compound treatment	1.133	-3.76E-4	-0.01	1.231	-0.0625	-0.85	-0.6066	-0.7113	1200806	Bionet1_001874	Fc1ccc(cc1)S(=O)(=O)N(CC(=O)N2CCOCC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J17	compound treatment	1.143	0.00962	0.13	1.315	0.0215	0.29	0.2988	0.9331	1909068	Bionet1_001875	CCOC(=O)C(Cc1ccc(COC)cc1)(NC(=O)C)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J18	compound treatment	1.082	-0.0514	-0.69	1.27	-0.0235	-0.32	-0.717	-0.9388	1352110	Bionet1_001876	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J19	compound treatment	1.167	0.0336	0.45	1.314	0.0205	0.28	0.5181	0.9728	1255082	Bionet1_001877	Fc1ccc(cc1)c2onc3ccc(cc23)c4ccnc(n4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J20	compound treatment	1.122	-0.0114	-0.15	1.27	-0.0235	-0.32	-0.3355	-0.943	1513922	Bionet1_001878	COc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J21	compound treatment	1.167	0.0336	0.45	1.358	0.0645	0.88	0.9423	0.9526	1909069	Bionet1_001879	COC(=O)C1(NOC2C1C(=O)N(C2=O)c3ccc(Cl)cc3)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	J22	compound treatment	1.129	-0.00438	-0.06	1.253	-0.0405	-0.55	-0.4326	-0.7782	1446800	Bionet1_001880	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K03	compound treatment	1.123	-0.0104	-0.14	1.325	0.0315	0.43	0.2044	0.4529	1721912	Bionet1_001881	Fc1ccccc1NC(=O)Cn2c(CSc3ccccc3)nc4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K04	compound treatment	1.142	0.00862	0.12	1.302	0.00846	0.12	0.1639	1.0	1909070	Bionet1_001882	FC(F)(F)c1cnc(C(=O)c2ccc(Cl)cc2)c(c1)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K05	compound treatment	1.131	-0.00238	-0.03	1.327	0.0335	0.46	0.3	0.6558	1330692	Bionet1_001883	O=C(Cn1c(CSc2ccccc2)nc3ccccc13)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K06	compound treatment	1.123	-0.0104	-0.14	1.313	0.0195	0.27	0.0887	0.2956	1909071	Bionet1_001884	FC(F)(F)c1cnc(C(=O)c2ccc(Cl)cc2)c(c1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K07	compound treatment	1.113	-0.0204	-0.27	1.271	-0.0225	-0.31	-0.4117	-0.9985	1909072	Bionet1_001885	Cc1cccn2c(=O)nc(SCc3cccc(c3)C(F)(F)F)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K08	compound treatment	1.16	0.0266	0.36	1.306	0.0125	0.17	0.3742	0.9416	1909073	Bionet1_001886	FC(F)(F)c1cnc(C(=O)c2ccccc2)c(c1)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K09	compound treatment	1.168	0.0346	0.47	1.261	-0.0325	-0.44	0.0166	0.0257	1909074	Bionet1_001887	Cc1ccc2nc(SCc3cccc(c3)C(F)(F)F)nc(=O)n2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K10	compound treatment	1.151	0.0176	0.24	1.336	0.0425	0.58	0.5776	0.9227	1909075	Bionet1_001888	O/N=C(\c1ccc(Cl)cc1Cl)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K11	compound treatment	1.136	0.00262	0.04	1.33	0.0365	0.5	0.3766	0.7555	1909076	Bionet1_001889	COc1nc(N)c(cc1C#N)S(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K12	compound treatment	1.157	0.0236	0.32	1.259	-0.0345	-0.47	-0.1077	-0.1893	1909077	Bionet1_001890	FC(F)(F)c1cnc2c(nnc(c3ccccc3)c2c1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K13	compound treatment	1.085	-0.0484	-0.65	1.277	-0.0165	-0.23	-0.6209	-0.8993	1909078	Bionet1_001891	Nc1nc(cc(c1C#N)c2c(Cl)cccc2Cl)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K14	compound treatment	1.189	0.0556	0.75	1.343	0.0495	0.67	1.0076	0.9986	1909079	Bionet1_001892	COc1ccc(cc1)N2CCN(CC2)/C(=C/C#N)/NC(=O)Nc3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K15	compound treatment	1.134	6.24E-4	0.01	1.309	0.0155	0.21	0.1551	0.7347	1909080	Bionet1_001893	Nc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K16	compound treatment	1.149	0.0156	0.21	1.333	0.0395	0.54	0.5296	0.9163	1909081	Bionet1_001894	CN(N/C(=C/C#N)/NC(=O)NC(C)(C)C)c1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K17	compound treatment	1.138	0.00462	0.06	1.335	0.0415	0.57	0.4439	0.7804	1909082	Bionet1_001895	Nc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K18	compound treatment	1.141	0.00762	0.1	1.336	0.0425	0.58	0.4822	0.8199	1909083	Bionet1_001896	CN(NC(=O)NC(=O)c1c[nH]nc1C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K19	compound treatment	1.102	-0.0314	-0.42	1.316	0.0225	0.31	-0.0827	-0.1583	1490824	Bionet1_001897	COc1ccc(cc1)c2cc(nc(N)c2C#N)c3ccc(OC)c(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K20	compound treatment	1.139	0.00562	0.08	1.31	0.0165	0.22	0.2124	0.8963	1909084	Bionet1_001898	[O-][N+](=O)c1ccc(cc1)N2CCC3(CC2)NCCc4c3[nH]c5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K21	compound treatment	1.139	0.00562	0.08	1.343	0.0495	0.67	0.5306	0.7817	1729259	Bionet1_001899	COc1ccc(cc1)c2c(C)c(nc(N)c2C#N)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	K22	compound treatment	1.176	0.0426	0.58	1.352	0.0585	0.8	0.9703	0.9871	1909085	Bionet1_001900	CCOC(=O)/C(=C(/N)\N1CCN(CC1)c2ccc(OC)cc2)/SC#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L03	compound treatment	1.147	0.0136	0.18	1.271	-0.0225	-0.31	-0.0873	-0.2439	1909086	Bionet1_001901	CCOC(=O)C1=NOC2C1C(=O)N(C2=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L04	compound treatment	1.13	-0.00338	-0.05	1.275	-0.0185	-0.25	-0.2109	-0.8213	1909087	Bionet1_001902	FC(F)(F)c1nnc(NS(=O)(=O)c2cccc(c2)C(F)(F)F)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L05	compound treatment	1.142	0.00862	0.12	1.238	-0.0555	-0.76	-0.4532	-0.5915	1909088	Bionet1_001903	CCOC(=O)C1=NOC2C1C(=O)N(C2=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L06	compound treatment	1.142	0.00862	0.12	1.252	-0.0415	-0.57	-0.3182	-0.5504	1715321	Bionet1_001904	Clc1ccc(Oc2nc3ccccc3cc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L07	compound treatment	1.139	0.00562	0.08	1.246	-0.0475	-0.65	-0.4047	-0.6201	1909089	Bionet1_001905	COc1ccc(CO/N=C(/C)\c2ccc3noc(c4ccccc4)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L08	compound treatment	1.104	-0.0294	-0.4	1.234	-0.0595	-0.81	-0.8543	-0.9456	1189417	Bionet1_001906	COc1ccc(Oc2nc3ccccc3cc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L09	compound treatment	1.173	0.0396	0.53	1.284	-0.00954	-0.13	0.286	0.5199	1909090	Bionet1_001907	COc1ccc(N/C=C/C(=O)c2ccc3noc(c4ccccc4)c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L10	compound treatment	1.148	0.0146	0.2	1.252	-0.0415	-0.57	-0.261	-0.4352	1132092	Bionet1_001908	Cc1cc(C)cc(Oc2nc3ccccc3cc2c4ccc(Cl)cc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L11	compound treatment	1.125	-0.00838	-0.11	1.271	-0.0225	-0.31	-0.2972	-0.9077	1909091	Bionet1_001909	Clc1ccc(CSc2ccsc2C(=O)Nc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L12	compound treatment	1.096	-0.0374	-0.5	1.268	-0.0255	-0.35	-0.6028	-0.9837	1909092	Bionet1_001910	Cc1ccc(CNS(=O)(=O)NCc2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L13	compound treatment	1.109	-0.0244	-0.33	1.321	0.0275	0.37	0.0323	0.0648	1909093	Bionet1_001911	Cc1ccc(NC(=O)c2sccc2SCc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L14	compound treatment	1.16	0.0266	0.36	1.207	-0.0865	-1.18	-0.5804	-0.4706	1909094	Bionet1_001912	Cc1ccc(CNS(=O)(=O)NCc2cccc(c2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L15	compound treatment	1.084	-0.0494	-0.67	1.261	-0.0325	-0.44	-0.7847	-0.9805	1430573	Bionet1_001913	COC(=O)CS(=O)(=O)c1ccsc1C(=O)Nc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L16	compound treatment	1.11	-0.0234	-0.32	1.269	-0.0245	-0.33	-0.4596	-0.9996	1584425	Bionet1_001914	COc1ccc(CNS(=O)(=O)NCc2ccc(OC)c(OC)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L17	compound treatment	1.161	0.0276	0.37	1.274	-0.0195	-0.27	0.0751	0.164	1909095	Bionet1_001915	Clc1cccc(Cl)c1CSc2ccsc2C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L18	compound treatment	1.073	-0.0604	-0.81	1.277	-0.0165	-0.23	-0.7354	-0.8701	1909096	Bionet1_001916	Fc1ccccc1CNS(=O)(=O)NCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L19	compound treatment	1.159	0.0256	0.35	1.284	-0.00954	-0.13	0.1525	0.4129	1909097	Bionet1_001917	CNC(=O)c1sccc1S(=O)(=O)Cc2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L20	compound treatment	1.131	-0.00238	-0.03	1.227	-0.0665	-0.91	-0.6642	-0.7316	1222053	Bionet1_001918	COc1ccc(CNS(=O)(=O)NCc2ccc(C)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L21	compound treatment	1.124	-0.00938	-0.13	1.262	-0.0315	-0.43	-0.3935	-0.8779	1616476	Bionet1_001919	COC(=O)CS(=O)(=O)c1ccsc1C(=O)Nc2ccc(F)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	L22	compound treatment	1.122	-0.0114	-0.15	1.273	-0.0205	-0.28	-0.3065	-0.9599	1582662	Bionet1_001920	COc1ccc(CNS(=O)(=O)NCc2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M03	compound treatment	1.14	0.00662	0.09	1.272	-0.0215	-0.29	-0.1445	-0.4706	1909098	Bionet1_001921	Cc1c(nc(N)c(C#N)c1c2ccccc2Cl)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M04	compound treatment	1.148	0.0146	0.2	1.313	0.0195	0.27	0.3272	0.9893	1909099	Bionet1_001922	CN1O[C@H]2[C@@H]([C@H]1c3ccccc3)C(=O)N(C2=O)c4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M05	compound treatment	1.155	0.0216	0.29	1.316	0.0225	0.31	0.4229	0.9997	1909100	Bionet1_001923	FC(F)(F)c1cnc(c2cnn(c2)c3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M06	compound treatment	1.189	0.0556	0.75	1.284	-0.00954	-0.13	0.4387	0.576	1909101	Bionet1_001924	CN1O[C@H]2[C@@H]([C@H]1c3ccccc3)C(=O)N(C2=O)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M07	compound treatment	1.128	-0.00538	-0.07	1.269	-0.0245	-0.33	-0.2879	-0.8409	1909102	Bionet1_001925	CO/N=C/c1c(N)c(sc1Nc2ccccc2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M08	compound treatment	1.18	0.0466	0.63	1.322	0.0285	0.39	0.7192	0.9731	1909103	Bionet1_001926	O=C1[C@H]2ON(Cc3ccccc3)[C@@H]([C@H]2C(=O)N1Cc4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M09	compound treatment	1.108	-0.0254	-0.34	1.294	4.64E-4	0.01	-0.2376	-0.6939	1909104	Bionet1_001927	Clc1cccc(Cl)c1CSc2nccc(/C=C/c3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M10	compound treatment	1.129	-0.00438	-0.06	1.279	-0.0145	-0.2	-0.1819	-0.8795	1909105	Bionet1_001928	CN(NC(=O)NC(=O)c1cn(C)nc1C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M11	compound treatment	1.166	0.0326	0.44	1.283	-0.0105	-0.14	0.2096	0.4528	1909106	Bionet1_001929	FC(F)(F)c1cnc(Sc2nccc(/C=C/c3ccccc3)n2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M12	compound treatment	1.117	-0.0164	-0.22	1.31	0.0165	0.22	0.0025	0.008	1581123	Bionet1_001930	CCOC(=O)c1c(n2cccc2)c3ccccc3n1Cc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M13	compound treatment	1.148	0.0146	0.2	1.32	0.0265	0.36	0.3947	0.9596	1909107	Bionet1_001931	CCOC(=O)c1sc(=S)sc1SCC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M14	compound treatment	1.168	0.0346	0.47	1.318	0.0245	0.33	0.5662	0.9864	1909108	Bionet1_001932	CCOC(=O)NC(=O)/C(=C\Nc1c([nH]c2ccccc12)C(=O)OCC)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M15	compound treatment	1.197	0.0636	0.86	1.303	0.00946	0.13	0.6982	0.8044	1909109	Bionet1_001933	Clc1ccc(N/C=C/2\C(=O)CC3N(CCc4ccccc34)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M16	compound treatment	1.068	-0.0654	-0.88	1.294	4.64E-4	0.01	-0.6192	-0.702	1909110	Bionet1_001934	Cc1nn(C(=O)c2ccccc2)c(C)c1CS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M17	compound treatment	1.115	-0.0184	-0.25	1.273	-0.0205	-0.28	-0.3733	-0.9982	1909111	Bionet1_001935	FC(F)(F)c1cnc(CS/C=C\C(=O)c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M18	compound treatment	1.19	0.0566	0.76	1.309	0.0155	0.21	0.6893	0.8698	1909112	Bionet1_001936	Cc1nn(c(C)c1CS(=O)(=O)c2ccccc2)S(=O)(=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M19	compound treatment	1.133	-3.76E-4	-0.01	1.266	-0.0275	-0.38	-0.2691	-0.7166	1909113	Bionet1_001937	FC(F)(F)c1cnc(S/C=C\C(=O)c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M20	compound treatment	1.152	0.0186	0.25	1.347	0.0535	0.73	0.6932	0.8989	1909114	Bionet1_001938	Cc1nn(C(=O)c2cccnc2)c(C)c1CS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M21	compound treatment	1.159	0.0256	0.35	1.34	0.0465	0.63	0.6925	0.9594	1909115	Bionet1_001939	FC(F)(F)c1cnc(c(Cl)c1)c2cnc3cc(nn3c2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	M22	compound treatment	1.194	0.0606	0.82	1.368	0.0745	1.02	1.2963	0.9942	1909116	Bionet1_001940	Clc1ccc(cn1)c2nc3cc(Cl)c(Cl)cc3n2Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N03	compound treatment	1.104	-0.0294	-0.4	1.268	-0.0255	-0.35	-0.5265	-0.9979	1235719	Bionet1_001941	Clc1ccccc1CSc2nc(c([nH]2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N04	compound treatment	1.098	-0.0354	-0.48	1.216	-0.0775	-1.06	-1.0851	-0.9354	1129547	Bionet1_001942	COc1ccc(CNS(=O)(=O)NCc2ccc(Cl)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N05	compound treatment	1.137	0.00362	0.05	1.284	-0.00954	-0.13	-0.0574	-0.413	1283265	Bionet1_001943	Fc1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N06	compound treatment	1.111	-0.0224	-0.3	1.255	-0.0385	-0.53	-0.585	-0.9654	1909117	Bionet1_001944	CC(C)(C)c1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N07	compound treatment	1.141	0.00762	0.1	1.252	-0.0415	-0.57	-0.3278	-0.5694	1522118	Bionet1_001945	COc1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N08	compound treatment	1.095	-0.0384	-0.52	1.214	-0.0795	-1.08	-1.133	-0.9427	1909118	Bionet1_001946	COC(=O)N/N=C(/C)\c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N09	compound treatment	1.15	0.0166	0.22	1.299	0.00546	0.07	0.2113	0.894	1909119	Bionet1_001947	Cn1c(SCc2ccccc2Cl)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N10	compound treatment	1.079	-0.0544	-0.73	1.296	0.00246	0.03	-0.495	-0.674	1909120	Bionet1_001948	FC(F)(F)c1cnc(Oc2ccc(cc2)c3csnn3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N11	compound treatment	1.12	-0.0134	-0.18	1.28	-0.0135	-0.18	-0.2581	-0.9999	1649621	Bionet1_001949	Cn1c(SCc2ccc(F)cc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N12	compound treatment	1.144	0.0106	0.14	1.228	-0.0655	-0.89	-0.5306	-0.5862	1909121	Bionet1_001950	Clc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N13	compound treatment	1.095	-0.0384	-0.52	1.247	-0.0465	-0.63	-0.8148	-0.9949	1679641	Bionet1_001951	Fc1ccc(CSc2nc(c(c3ccccc3)n2CC#C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N14	compound treatment	1.133	-3.76E-4	-0.01	1.281	-0.0125	-0.17	-0.1245	-0.7278	1909122	Bionet1_001952	Clc1ccc(/C=C/C(=O)c2ccc(Br)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N15	compound treatment	1.163	0.0296	0.4	1.287	-0.00654	-0.09	0.2196	0.5362	1551171	Bionet1_001953	COc1ccc(CSc2nc(c(c3ccccc3)n2C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N16	compound treatment	1.069	-0.0644	-0.87	1.297	0.00346	0.05	-0.5807	-0.6677	1909123	Bionet1_001954	Clc1ccc(cc1)S(=O)(=O)Oc2ccccc2c3csnn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N17	compound treatment	1.19	0.0566	0.76	1.3	0.00646	0.09	0.6025	0.7835	1909124	Bionet1_001955	Cn1nc(c(CSc2c(Cl)cccc2Cl)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N18	compound treatment	1.119	-0.0144	-0.19	1.25	-0.0435	-0.59	-0.5569	-0.8917	1909125	Bionet1_001956	Nc1cccc(Cl)c1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N19	compound treatment	1.095	-0.0384	-0.52	1.262	-0.0315	-0.43	-0.6702	-0.9957	1909126	Bionet1_001957	Cn1nc(c(CSc2ccc(Br)cc2)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N20	compound treatment	1.089	-0.0444	-0.6	1.259	-0.0345	-0.47	-0.7563	-0.9929	1909127	Bionet1_001958	[O-][N+](=O)c1cc(Cl)ccc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N21	compound treatment	1.18	0.0466	0.63	1.292	-0.00154	-0.02	0.4299	0.6832	1909128	Bionet1_001959	Cn1nc(c(CSc2cccc(Cl)c2Cl)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	N22	compound treatment	1.067	-0.0664	-0.9	1.221	-0.0725	-0.99	-1.3326	-0.9988	1909129	Bionet1_001960	Nc1cc(Cl)ccc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O03	compound treatment	1.105	-0.0284	-0.38	1.3	0.00646	0.09	-0.2084	-0.5304	1909130	Bionet1_001961	FC(F)(F)c1cc(Cl)c(=S)n(/C=C/C(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O04	compound treatment	1.163	0.0296	0.4	1.303	0.00946	0.13	0.3738	0.8902	1414452	Bionet1_001962	Clc1cc2nc(c3ccc(=O)[nH]c3)n(Cc4ccccc4)c2cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O05	compound treatment	1.139	0.00562	0.08	1.273	-0.0205	-0.28	-0.1444	-0.4976	1909131	Bionet1_001963	Cc1nn2cc(cnc2c1Br)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O06	compound treatment	1.1	-0.0334	-0.45	1.347	0.0535	0.73	0.1971	0.2301	1219734	Bionet1_001964	Cc1ccccc1Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc(=O)[nH]c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O07	compound treatment	1.132	-0.00138	-0.02	1.256	-0.0375	-0.51	-0.3751	-0.7323	1909132	Bionet1_001965	FC(F)(F)c1cnc(c(Cl)c1)c2cnc3c(cnn3c2)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O08	compound treatment	1.131	-0.00238	-0.03	1.294	4.64E-4	0.01	-0.0182	-0.5568	1195809	Bionet1_001966	Fc1ccccc1Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc[nH]c4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O09	compound treatment	1.232	0.0986	1.33	1.342	0.0485	0.66	1.4081	0.9478	1909133	Bionet1_001967	FC(F)(F)c1cccc(NC(=O)N2CCc3ccccc3C2CC#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O10	compound treatment	1.122	-0.0114	-0.15	1.307	0.0135	0.18	0.0213	0.089	1641154	Bionet1_001968	Fc1cccc(Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc[nH]c4=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O11	compound treatment	1.123	-0.0104	-0.14	1.286	-0.00754	-0.1	-0.1716	-0.9885	1318947	Bionet1_001969	Clc1ccc(NC(=O)N2CCc3ccccc3C2CC#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O12	compound treatment	1.166	0.0326	0.44	1.348	0.0545	0.74	0.8364	0.9688	1493154	Bionet1_001970	Fc1ccc(Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc[nH]c4=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O13	compound treatment	1.107	-0.0264	-0.36	1.254	-0.0395	-0.54	-0.6328	-0.9797	1909134	Bionet1_001971	FC(F)(F)c1ccc(NC(=O)N2CCc3ccccc3C2CC#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O14	compound treatment	1.134	6.24E-4	0.01	1.296	0.00246	0.03	0.0297	0.8577	1389046	Bionet1_001972	Cc1ccccc1Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc[nH]c4=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O15	compound treatment	1.142	0.00862	0.12	1.285	-0.00854	-0.12	0.0	-3.0E-4	1909135	Bionet1_001973	COC(=O)c1sc2ncc(cc2c1N)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O16	compound treatment	1.1	-0.0334	-0.45	1.316	0.0225	0.31	-0.1018	-0.1869	1207705	Bionet1_001974	CC(O)(CS(=O)(=O)c1ccc(Br)cc1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O17	compound treatment	1.166	0.0326	0.44	1.288	-0.00554	-0.08	0.2578	0.5774	1909136	Bionet1_001975	CC(C(=O)Nc1ccc(Cl)cc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O18	compound treatment	1.141	0.00762	0.1	1.357	0.0635	0.87	0.6847	0.7856	1437669	Bionet1_001976	Cc1ccc(Cn2c(nc3cc(Cl)c(Cl)cc23)c4ccc[nH]c4=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O19	compound treatment	1.128	-0.00538	-0.07	1.271	-0.0225	-0.31	-0.2686	-0.8506	1909137	Bionet1_001977	COC(=O)C/1=C(C)NC(=O)\C1=C/Nc2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O20	compound treatment	1.143	0.00962	0.13	1.353	0.0595	0.81	0.6652	0.81	1277226	Bionet1_001978	CC(O)(CS(=O)(=O)Cc1ccc(Cl)cc1)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O21	compound treatment	1.132	-0.00138	-0.02	1.304	0.0105	0.14	0.0878	0.61	1909138	Bionet1_001979	CN(C)/C=C/c1snc(Sc2ncc(cc2Cl)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	O22	compound treatment	1.197	0.0636	0.86	1.336	0.0425	0.58	1.0164	0.9816	1604510	Bionet1_001980	COc1ccc(CS(=O)(=O)CC(C)(O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P03	compound treatment	1.137	0.00362	0.05	1.289	-0.00454	-0.06	-0.0092	-0.1163	1502958	Bionet1_001981	Fc1ccc(NC(=O)Cc2sc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P04	compound treatment	1.142	0.00862	0.12	1.234	-0.0595	-0.81	-0.4918	-0.5997	1909139	Bionet1_001982	FC(F)(F)c1cnc(NCCn2c(=O)cc(Cl)[nH]c2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P05	compound treatment	1.118	-0.0154	-0.21	1.259	-0.0345	-0.47	-0.4797	-0.9321	1220479	Bionet1_001983	O=C(Cc1sc(nc1c2ccccc2)c3ccccc3)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P06	compound treatment	1.075	-0.0584	-0.79	1.23	-0.0635	-0.87	-1.1695	-0.9989	1909140	Bionet1_001984	[O-][N+](=O)c1cccnc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P07	compound treatment	1.132	-0.00138	-0.02	1.251	-0.0425	-0.58	-0.4233	-0.7294	1563165	Bionet1_001985	Cc1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P08	compound treatment	1.13	-0.00338	-0.05	1.211	-0.0825	-1.13	-0.8281	-0.7351	1909141	Bionet1_001986	Nc1cccnc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P09	compound treatment	1.029	-0.104	-1.41	1.169	-0.125	-1.7	-2.1965	-0.9957	1909142	Bionet1_001987	[O-][N+](=O)c1ccc(CSc2nc(c([nH]2)c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P10	compound treatment	0.215	-0.918	-12.39	0.196	-1.1	-14.97	-19.3436	-0.9956	1909143	Bionet1_001988	Nc1cccnc1N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P11	compound treatment	1.097	-0.0364	-0.49	1.251	-0.0425	-0.58	-0.7572	-0.9965	1635916	Bionet1_001989	Cn1c(SCc2cccc(F)c2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P12	compound treatment	1.102	-0.0314	-0.42	1.181	-0.113	-1.53	-1.3844	-0.8697	1909144	Bionet1_001990	[O-][N+](=O)c1ccccc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P13	compound treatment	1.119	-0.0144	-0.19	1.272	-0.0215	-0.29	-0.3448	-0.9797	1121458	Bionet1_001991	Fc1cccc(CSc2nc(c(c3ccccc3)n2CC#C)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P14	compound treatment	1.066	-0.0674	-0.91	1.236	-0.0575	-0.78	-1.1975	-0.9973	1909145	Bionet1_001992	Nc1ccccc1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P15	compound treatment	1.143	0.00962	0.13	1.266	-0.0275	-0.38	-0.1737	-0.4372	1176989	Bionet1_001993	Cc1ccc(CSc2nc(c(c3ccccc3)n2C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P16	compound treatment	1.075	-0.0584	-0.79	1.281	-0.0125	-0.17	-0.6777	-0.841	1909146	Bionet1_001994	FC(F)(F)c1cnc(NCCn2c(=O)c(=O)[nH]c3cccnc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P17	compound treatment	1.109	-0.0244	-0.33	1.239	-0.0545	-0.74	-0.7584	-0.9327	1625015	Bionet1_001995	CCCn1c(SCc2ccc(C)cc2)nc(c1c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P18	compound treatment	1.084	-0.0494	-0.67	1.257	-0.0365	-0.5	-0.8233	-0.9898	1909147	Bionet1_001996	NNc1nc2cccnc2n(CCNc3ncc(cc3Cl)C(F)(F)F)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P19	compound treatment	1.173	0.0396	0.53	1.273	-0.0205	-0.28	0.18	0.2982	1507806	Bionet1_001997	Cc1ccc(CSc2nc(c(c3ccccc3)n2CC=C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P20	compound treatment	1.073	-0.0604	-0.81	1.269	-0.0245	-0.33	-0.8125	-0.9228	1909148	Bionet1_001998	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P21	compound treatment	1.094	-0.0394	-0.53	1.333	0.0395	0.54	0.0049	0.0065	1557672	Bionet1_001999	Cc1ccc(CSc2nc(c(c3ccccc3)n2CC#C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.573	P22	compound treatment	1.183	0.0496	0.67	1.228	-0.0655	-0.89	-0.1585	-0.142	1909149	Bionet1_002000	Nc1cc(ccc1NCCNc2ncc(cc2Cl)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A03	compound treatment	1.146	-0.0054	-0.07	1.252	-0.0367	-0.5	-0.4054	-0.8015	1909150	Bionet1_002001	Nc1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A04	compound treatment	1.166	0.0146	0.2	1.307	0.0183	0.25	0.3157	0.9932	1660363	Bionet1_002002	Clc1ccccc1c2nc(c(CC(=O)NCC=C)s2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A05	compound treatment	1.156	0.0046	0.06	1.307	0.0183	0.25	0.2203	0.8569	1909151	Bionet1_002003	NC(=O)Nc1ccc(cc1)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A06	compound treatment	1.132	-0.0194	-0.26	1.323	0.0343	0.47	0.1456	0.2718	1416546	Bionet1_002004	Clc1ccc(SCC(=O)Nc2nc(cs2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A07	compound treatment	1.147	-0.0044	-0.06	1.214	-0.0747	-1.02	-0.7623	-0.747	1214913	Bionet1_002005	CN(C)C(=O)CN(c1ccc(Cl)cc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A08	compound treatment	1.17	0.0186	0.25	1.328	0.0393	0.54	0.5563	0.9403	1241292	Bionet1_002006	Cc1ccc(SCC(=O)Nc2nc(cs2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A09	compound treatment	1.115	-0.0364	-0.49	1.251	-0.0377	-0.51	-0.7108	-0.9997	1909152	Bionet1_002007	Clc1ccc(cc1)N(CC(=O)NCC=C)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A10	compound treatment	1.185	0.0336	0.45	1.297	0.00829	0.11	0.4005	0.8573	1642983	Bionet1_002008	Clc1ccc(cc1)c2csc(NC(=O)CSc3cccc(Cl)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A11	compound treatment	1.175	0.0236	0.32	1.245	-0.0437	-0.6	-0.1963	-0.2905	1909153	Bionet1_002009	CN(C)C(=O)CN(c1cccc(c1)C(F)(F)F)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A12	compound treatment	1.199	0.0476	0.64	1.316	0.0273	0.37	0.7173	0.9664	1326719	Bionet1_002010	Clc1ccc(cc1)c2csc(NC(=O)CSc3ccccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A13	compound treatment	1.112	-0.0394	-0.53	1.232	-0.0567	-0.77	-0.9226	-0.9833	1460525	Bionet1_002011	CN(C)C(=O)CN(c1ccc(Cl)cc1)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A14	compound treatment	1.146	-0.0054	-0.07	1.325	0.0363	0.49	0.2985	0.5966	1593558	Bionet1_002012	Cc1cccc(SCC(=O)Nc2nc(cs2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A15	compound treatment	1.108	-0.0434	-0.59	1.303	0.0143	0.19	-0.2762	-0.4475	1909154	Bionet1_002013	Clc1ccc(cc1)N(CC(=O)NCC=C)S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A16	compound treatment	1.162	0.0106	0.14	1.327	0.0383	0.52	0.4704	0.8688	1539388	Bionet1_002014	Cc1ccc(SCC(=O)Nc2nc(cs2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A17	compound treatment	1.164	0.0126	0.17	1.304	0.0153	0.21	0.2677	0.9949	1698139	Bionet1_002015	Clc1ccc(cc1)N(CC(=O)N2CCOCC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A18	compound treatment	1.2	0.0486	0.66	1.293	0.00429	0.06	0.505	0.7672	1433634	Bionet1_002016	Clc1ccc(SCC(=O)Nc2nc(cs2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A19	compound treatment	1.154	0.0026	0.04	1.258	-0.0307	-0.42	-0.2713	-0.6456	1267968	Bionet1_002017	Cc1cccc(C)c1NC(=O)CN(c2ccccn2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A20	compound treatment	1.168	0.0166	0.22	1.225	-0.0637	-0.87	-0.4559	-0.5082	1557783	Bionet1_002018	Fc1ccc(cc1)c2csc(NC(=O)CSc3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A21	compound treatment	1.182	0.0306	0.41	1.237	-0.0517	-0.71	-0.2066	-0.2529	1551285	Bionet1_002019	O=C(CN(c1ccccn1)S(=O)(=O)c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	A22	compound treatment	1.158	0.0066	0.09	1.262	-0.0267	-0.36	-0.1945	-0.5189	1510003	Bionet1_002020	Cc1ccc(SCC(=O)Nc2nc(cs2)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B03	compound treatment	1.165	0.0136	0.18	1.272	-0.0167	-0.23	-0.0313	-0.1071	1909155	Bionet1_002021	[O-][N+](=O)c1cc(ccc1n2c3ccccc3c4ccccc24)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B04	compound treatment	1.13	-0.0214	-0.29	1.295	0.00629	0.09	-0.1434	-0.4762	1909156	Bionet1_002022	[O-][N+](=O)c1cccc(Cl)c1NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B05	compound treatment	1.199	0.0476	0.64	1.254	-0.0347	-0.47	0.1194	0.1497	1909157	Bionet1_002023	CC(C)(C)c1cc(/C=N\NC(=O)Nc2ccccc2)cc(c1O)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B06	compound treatment	1.162	0.0106	0.14	1.31	0.0213	0.29	0.3065	0.9468	1605306	Bionet1_002024	COc1ccc(cc1)c2nc(nc(N3CCN(C)CC3)c2C#N)c4cccc(C)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B07	compound treatment	1.157	0.0056	0.08	1.292	0.00329	0.04	0.0852	0.9691	1909158	Bionet1_002025	COC(=O)/C(=C/N(C)C)/C(=O)N1CCN(CC1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B08	compound treatment	1.169	0.0176	0.24	1.313	0.0243	0.33	0.4022	0.9867	1909159	Bionet1_002026	Fc1ccc(/C=C\2/SC(=S)N(N3C(=O)C4C5CC(C=C5)C4C3=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B09	compound treatment	1.131	-0.0204	-0.28	1.278	-0.0107	-0.15	-0.2978	-0.956	1909160	Bionet1_002027	CCOC(=O)c1noc(C)c1C(=O)Nc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B10	compound treatment	1.132	-0.0194	-0.26	1.278	-0.0107	-0.15	-0.2883	-0.962	1909161	Bionet1_002028	COc1cccc(/C=C/2\SC(=S)N(N3C(=O)CCCC3=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B11	compound treatment	1.137	-0.0144	-0.19	1.332	0.0433	0.59	0.2801	0.4507	1909162	Bionet1_002029	Cc1onc(C(=O)NN)c1C(=O)Nc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B12	compound treatment	1.108	-0.0434	-0.59	1.294	0.00529	0.07	-0.3629	-0.6152	1909163	Bionet1_002030	FC(F)(F)c1cccc(OCCO/N=C/c2sc3ccccc3c2Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B13	compound treatment	1.166	0.0146	0.2	1.343	0.0543	0.74	0.6628	0.8651	1236971	Bionet1_002031	Cc1onc(c2ccnn2c3ccc(C)cc3)c1C(=O)Nc4nccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B14	compound treatment	1.174	0.0226	0.3	1.239	-0.0497	-0.68	-0.2637	-0.3548	1909164	Bionet1_002032	COc1ccccc1/C=C/2\SC(=S)N(N3C(=O)CCCC3=O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B15	compound treatment	1.188	0.0366	0.49	1.238	-0.0507	-0.69	-0.1398	-0.1645	1909165	Bionet1_002033	COc1ccc(N/C=C/C(=O)c2noc(C)c2C(=O)Nc3nccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B16	compound treatment	1.171	0.0196	0.26	1.325	0.0363	0.49	0.537	0.9569	1909166	Bionet1_002034	COc1ccc(cc1)c2nc(nc(Cl)c2C#N)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B17	compound treatment	1.175	0.0236	0.32	1.266	-0.0227	-0.31	0.0062	0.014	1909167	Bionet1_002035	FC(F)(F)c1ccc(NC(=O)CC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B18	compound treatment	1.162	0.0106	0.14	1.226	-0.0627	-0.86	-0.5035	-0.5808	1909168	Bionet1_002036	CN(C)c1nc(N(C)C)n(n1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B19	compound treatment	1.139	-0.0124	-0.17	1.3	0.0113	0.15	-0.0094	-0.0412	1909169	Bionet1_002037	FC(F)(F)c1ccccc1NC(=O)CC(=O)Nc2ccccc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B20	compound treatment	1.149	-0.0024	-0.03	1.261	-0.0277	-0.38	-0.29	-0.7649	1909170	Bionet1_002038	CN(C)c1nc(N(C)C)n(n1)S(=O)(=O)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B21	compound treatment	1.201	0.0496	0.67	1.319	0.0303	0.41	0.7653	0.9731	1909171	Bionet1_002039	CN(C)C=C(C(=O)Nc1ccccc1Cl)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	B22	compound treatment	1.158	0.0066	0.09	1.28	-0.00871	-0.12	-0.021	-0.1413	1909172	Bionet1_002040	C/C(=N/Nc1nc(cs1)c2sccc2Cl)/c3c(O)cc(C)oc3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C03	compound treatment	1.124	-0.0274	-0.37	1.275	-0.0137	-0.19	-0.3935	-0.9501	1909173	Bionet1_002041	CC(=O)c1cc(C#N)c(SCc2ccc(Cl)c(Cl)c2)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C04	compound treatment	1.191	0.0396	0.53	1.299	0.0103	0.14	0.477	0.8636	1909174	Bionet1_002042	FC(F)(F)c1cnc(C#N)c(c1)S(=O)(=O)Cc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C05	compound treatment	1.166	0.0146	0.2	1.289	2.95E-4	0.0	0.1421	0.7214	1909175	Bionet1_002043	CC(=O)c1cc(C#N)c(SCc2cccc(c2)C(F)(F)F)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C06	compound treatment	1.152	6.02E-4	0.01	1.297	0.00829	0.11	0.0857	0.7559	1909176	Bionet1_002044	NC(=O)c1ncc(cc1S(=O)(=O)c2ccc(cn2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C07	compound treatment	1.111	-0.0404	-0.54	1.338	0.0493	0.67	0.0899	0.1039	1909177	Bionet1_002045	CC(=O)c1cc(C#N)c(SCc2ccc(Cl)cc2Cl)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C08	compound treatment	1.164	0.0126	0.17	1.325	0.0363	0.49	0.4702	0.8985	1909178	Bionet1_002046	CCC(=O)Nc1ccc(Sc2cc(cnc2C#N)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C09	compound treatment	1.142	-0.0094	-0.13	1.265	-0.0237	-0.32	-0.3182	-0.9165	1452833	Bionet1_002047	Fc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C10	compound treatment	1.138	-0.0134	-0.18	1.294	0.00529	0.07	-0.0768	-0.3944	1909179	Bionet1_002048	NC(=O)c1ncc(cc1Oc2cccc(c2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C11	compound treatment	1.124	-0.0274	-0.37	1.329	0.0403	0.55	0.1272	0.192	1639653	Bionet1_002049	COC(=O)c1cc(C#N)c(Oc2cc(Cl)c(Cl)cc2Cl)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C12	compound treatment	1.191	0.0396	0.53	1.318	0.0293	0.4	0.6602	0.9897	1909180	Bionet1_002050	FC(F)(F)c1cnc(c2nc[nH]n2)c(Sc3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C13	compound treatment	1.2	0.0486	0.66	1.307	0.0183	0.25	0.64	0.9123	1909181	Bionet1_002051	CCOC(=O)c1cnn(c2nc(cs2)c3ccc(OC)cc3)c1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C14	compound treatment	1.177	0.0256	0.35	1.334	0.0453	0.62	0.681	0.9623	1909182	Bionet1_002052	Fc1ccc(cc1)N2CCN(CC2)c3cc(cnc3C#N)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C15	compound treatment	1.145	-0.0064	-0.09	1.271	-0.0177	-0.24	-0.2318	-0.9039	1909183	Bionet1_002053	CNC(=O)c1cnn(c2nc(cs2)c3ccc(OC)cc3)c1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C16	compound treatment	1.157	0.0056	0.08	1.289	2.95E-4	0.0	0.0563	0.7437	1909184	Bionet1_002054	NC(=O)c1ncc(cc1Oc2ccc(cc2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C17	compound treatment	1.127	-0.0244	-0.33	1.342	0.0533	0.73	0.2811	0.3524	1909185	Bionet1_002055	FC(F)(F)c1ccc(cc1)C2=NNC(=O)C(C2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C18	compound treatment	1.147	-0.0044	-0.06	1.298	0.00929	0.13	0.0477	0.3406	1909186	Bionet1_002056	CN(C)/C=C/C(=O)c1ccc(Oc2cc(cnc2C#N)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C19	compound treatment	1.154	0.0026	0.04	1.275	-0.0137	-0.19	-0.1073	-0.5644	1909187	Bionet1_002057	COc1ccc(NC(=O)/C(=C(/Cl)\SCc2ccc(C)cc2)/Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C20	compound treatment	1.161	0.0096	0.13	1.232	-0.0567	-0.77	-0.4552	-0.5806	1909188	Bionet1_002058	COC(=O)c1c(noc1/C(=C/N(C)C)/C(=O)C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C21	compound treatment	1.177	0.0256	0.35	1.27	-0.0187	-0.26	0.0639	0.1487	1909189	Bionet1_002059	COc1ccc(CS/C(=C(/Cl)\C(=O)Nc2ccc(OC)nc2)/Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	C22	compound treatment	1.193	0.0416	0.56	1.286	-0.00271	-0.04	0.3708	0.6592	1909190	Bionet1_002060	FC(F)(F)c1cccc(c1)N2CCN(CC2)c3cc(cnc3C#N)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D03	compound treatment	1.142	-0.0094	-0.13	1.307	0.0183	0.25	0.0868	0.31	1909191	Bionet1_002061	CO/N=C/C(C(=O)Nc1ccccc1Cl)C(=O)Nc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D04	compound treatment	1.202	0.0506	0.68	1.338	0.0493	0.67	0.958	1.0	1909192	Bionet1_002062	CC(=O)CC(=O)c1c(C)nn(c1O)c2nc(cs2)c3sccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D05	compound treatment	1.159	0.0076	0.1	1.328	0.0393	0.54	0.4514	0.8274	1909193	Bionet1_002063	CN(C)C=C(C(=O)Nc1ccc(F)cc1F)C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D06	compound treatment	1.085	-0.0664	-0.9	1.277	-0.0117	-0.16	-0.7463	-0.8202	1909194	Bionet1_002064	Fc1ccc(cc1)N2CCN(CC2)c3[nH]c(cc3C#N)c4sccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D07	compound treatment	1.176	0.0246	0.33	1.271	-0.0177	-0.24	0.064	0.1558	1909195	Bionet1_002065	CO/N=C/C(C(=O)Nc1ccc(F)cc1F)C(=O)Nc2ccc(F)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D08	compound treatment	1.116	-0.0354	-0.48	1.282	-0.00671	-0.09	-0.4023	-0.8275	1909196	Bionet1_002066	Fc1ccc(cc1)n2nc(C#N)c(=O)n(Cc3ccc(cc3)C(F)(F)F)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D09	compound treatment	1.15	-0.0014	-0.02	1.322	0.0333	0.45	0.3077	0.6771	1909197	Bionet1_002067	CC(=O)OCc1c(Sc2ccccc2Cl)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D10	compound treatment	1.135	-0.0164	-0.22	1.266	-0.0227	-0.31	-0.3754	-0.9864	1909198	Bionet1_002068	Cc1ccc(cc1)n2cc(cn2)c3nn(c4cc(C)cc(C)c4)c(=O)n(C)c3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D11	compound treatment	1.135	-0.0164	-0.22	1.274	-0.0147	-0.2	-0.2982	-0.9988	1909199	Bionet1_002069	Cc1cccc(C)c1n2c(CCl)nc3c(Cl)cc(Cl)cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D12	compound treatment	1.094	-0.0574	-0.77	1.216	-0.0727	-0.99	-1.2486	-0.9925	1909200	Bionet1_002070	COC(=O)C1CCN(CC1)c2[nH]c(cc2C#N)c3sccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D13	compound treatment	1.187	0.0356	0.48	1.246	-0.0427	-0.58	-0.0722	-0.0956	1175235	Bionet1_002071	Clc1ccc(SCC(=O)Nc2nc(cs2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D14	compound treatment	1.123	-0.0284	-0.38	1.186	-0.103	-1.4	-1.2612	-0.8686	1909201	Bionet1_002072	COC(=O)C1CCN(CC1)c2[nH]c(cc2C#N)c3sccc3Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D15	compound treatment	1.074	-0.0774	-1.04	1.27	-0.0187	-0.26	-0.9187	-0.8547	1318903	Bionet1_002073	Clc1cccc(SCc2nc3ccccc3c(=O)n2c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D16	compound treatment	1.133	-0.0184	-0.25	1.197	-0.0917	-1.25	-1.0598	-0.8312	1909202	Bionet1_002074	COC(=O)C1CCN(CC1)c2[nH]c(cc2C(=O)OC)c3sccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D17	compound treatment	1.195	0.0436	0.59	1.235	-0.0537	-0.73	-0.1019	-0.1085	1526136	Bionet1_002075	Clc1cccc(SCC(=O)Nc2nc(cs2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D18	compound treatment	1.169	0.0176	0.24	1.285	-0.00371	-0.05	0.1322	0.5445	1909203	Bionet1_002076	Cn1c(=O)c(nn(c2ccc(F)cc2F)c1=O)C(=O)CBr
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D19	compound treatment	1.156	0.0046	0.06	1.328	0.0393	0.54	0.4228	0.7838	1647762	Bionet1_002077	Clc1ccc(c2csc(NC(=O)CSc3ccccc3)n2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D20	compound treatment	1.159	0.0076	0.1	1.271	-0.0177	-0.24	-0.0982	-0.3744	1909204	Bionet1_002078	Cn1c(=O)c(nn(c2ccc(Cl)cc2)c1=O)c3ccnn3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D21	compound treatment	1.134	-0.0174	-0.23	1.24	-0.0487	-0.66	-0.6356	-0.9023	1220284	Bionet1_002079	Clc1ccc(cc1)c2csc(NC(=O)CSc3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	D22	compound treatment	1.116	-0.0354	-0.48	1.261	-0.0277	-0.38	-0.6048	-0.9933	1440353	Bionet1_002080	Cn1c(=O)c(nn(c2ccc(F)cc2F)c1=O)c3csc(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E03	compound treatment	1.117	-0.0344	-0.46	1.286	-0.00271	-0.04	-0.3542	-0.7609	1909205	Bionet1_002081	COc1ccc(NC(=O)/C(=C(/Cl)\S(=O)Cc2ccccc2)/Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E04	compound treatment	1.146	-0.0054	-0.07	1.292	0.00329	0.04	-0.0197	-0.2305	1909206	Bionet1_002082	FC(F)(F)c1cnc(C#N)c(Oc2ccc(Cl)c3cccnc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E05	compound treatment	1.115	-0.0364	-0.49	1.293	0.00429	0.06	-0.3058	-0.6184	1909207	Bionet1_002083	COc1ccc(NC(=O)/C(=C(/Cl)\S(=O)Cc2ccc(C)cc2)/Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E06	compound treatment	1.169	0.0176	0.24	1.285	-0.00371	-0.05	0.1322	0.5445	1909208	Bionet1_002084	COC(=O)c1c(noc1c2cnc(N)nc2C(F)(F)F)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E07	compound treatment	1.128	-0.0234	-0.32	1.309	0.0203	0.28	-0.0275	-0.0655	1909209	Bionet1_002085	Cc1ccc(SCCC(=O)NCCSc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E08	compound treatment	1.178	0.0266	0.36	1.328	0.0393	0.54	0.6327	0.981	1909210	Bionet1_002086	COC(=O)c1c(noc1c2cnc(N)nc2C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E09	compound treatment	1.143	-0.0084	-0.11	1.286	-0.00271	-0.04	-0.1062	-0.8913	1909211	Bionet1_002087	Clc1ccc(SCCNC(=O)CCSc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E10	compound treatment	1.174	0.0226	0.3	1.319	0.0303	0.41	0.5077	0.9888	1909212	Bionet1_002088	COc1ccc(cc1)N2CCN(CC2)c3cc(cnc3C#N)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E11	compound treatment	1.154	0.0026	0.04	1.32	0.0313	0.43	0.3266	0.7627	1909213	Bionet1_002089	Clc1cccc(Cl)c1SCC(=O)NCCSc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E12	compound treatment	1.123	-0.0284	-0.38	1.326	0.0373	0.51	0.0887	0.1393	1909214	Bionet1_002090	CN(C)/C=C(\C(=O)C(F)(F)F)/c1onc(c1C#N)c2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E13	compound treatment	1.171	0.0196	0.26	1.288	-7.05E-4	-0.01	0.1802	0.6809	1909215	Bionet1_002091	Clc1cccc(Cl)c1SCCC(=O)NCCSc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E14	compound treatment	1.124	-0.0274	-0.37	1.294	0.00529	0.07	-0.2103	-0.5584	1909216	Bionet1_002092	COC(=O)C1CC(Cl)CN1S(=O)(=O)c2ccc(OC)c(OC)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E15	compound treatment	1.189	0.0376	0.51	1.295	0.00629	0.09	0.4194	0.8152	1909217	Bionet1_002093	O=C(CCS(=O)(=O)c1ccccc1)NCCS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E16	compound treatment	1.149	-0.0024	-0.03	1.258	-0.0307	-0.42	-0.3189	-0.7595	1909218	Bionet1_002094	NNC(=O)C1=NOC2COC3(CCN(CC3)c4ccc(cc4)[N+](=O)[O-])OCC21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E17	compound treatment	1.168	0.0166	0.22	1.335	0.0463	0.63	0.6048	0.9028	1909219	Bionet1_002095	Fc1ccc(cc1)S(=O)(=O)CC(=O)NCCS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E18	compound treatment	1.14	-0.0114	-0.15	1.322	0.0333	0.45	0.2123	0.4429	1909220	Bionet1_002096	CN(N1C(=O)C2ON=C(C2C1=O)C(=O)C)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E19	compound treatment	1.176	0.0246	0.33	1.26	-0.0287	-0.39	-0.0421	-0.082	1909221	Bionet1_002097	COC(=O)c1ccccc1SC(C)C(=O)NCCSc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E20	compound treatment	1.176	0.0246	0.33	1.32	0.0313	0.43	0.5364	0.9923	1909222	Bionet1_002098	CCOC(=O)C1=NOC2COC3(CCN(CC3)c4ncccn4)OCC21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E21	compound treatment	1.185	0.0336	0.45	1.318	0.0293	0.4	0.603	0.998	1909223	Bionet1_002099	Clc1ccc(Sc2ccccc2CSc3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	E22	compound treatment	1.201	0.0496	0.67	1.309	0.0203	0.28	0.6689	0.9237	1909224	Bionet1_002100	CN(NS(=O)(=O)c1ccc(Cl)cc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F03	compound treatment	1.151	-3.98E-4	-0.01	1.252	-0.0367	-0.5	-0.3577	-0.7147	1457569	Bionet1_002101	Cc1ccccc1SCC(=O)Nc2nc(cs2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F04	compound treatment	1.131	-0.0204	-0.28	1.264	-0.0247	-0.34	-0.4328	-0.995	1909225	Bionet1_002102	Cn1c(=O)c(nn(c2ccc(Cl)cc2)c1=O)c3ccnc(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F05	compound treatment	1.189	0.0376	0.51	1.321	0.0323	0.44	0.6701	0.9975	1690949	Bionet1_002103	Cc1ccc(cc1)S(=O)(=O)CC(=O)Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F06	compound treatment	1.111	-0.0404	-0.54	1.232	-0.0567	-0.77	-0.9321	-0.9853	1460474	Bionet1_002104	Cn1c(=O)c(nn(c2cc(Cl)cc(Cl)c2)c1=O)c3csc(N)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F07	compound treatment	1.144	-0.0074	-0.1	1.282	-0.00671	-0.09	-0.1352	-0.999	1523184	Bionet1_002105	Clc1ccc(cc1)S(=O)(=O)CC(=O)Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F08	compound treatment	1.131	-0.0204	-0.28	1.316	0.0273	0.37	0.0686	0.1482	1909226	Bionet1_002106	CN(C)/C=C/C(=O)c1nn(c2cccc(c2)C(F)(F)F)c(=O)n(C)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F09	compound treatment	1.108	-0.0434	-0.59	1.297	0.00829	0.11	-0.334	-0.5601	1414598	Bionet1_002107	Cc1cccc(c1)S(=O)(=O)CC(=O)Nc2nc(cs2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F10	compound treatment	1.152	6.02E-4	0.01	1.239	-0.0497	-0.68	-0.4735	-0.6986	1909227	Bionet1_002108	C=CCOc1ccccc1/C=C/2\C(=O)N(N=C2c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F11	compound treatment	1.147	-0.0044	-0.06	1.3	0.0113	0.15	0.067	0.4056	1217857	Bionet1_002109	Clc1ccc(cc1)c2csc(NC(=O)CS(=O)(=O)c3ccccc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F12	compound treatment	1.146	-0.0054	-0.07	1.225	-0.0637	-0.87	-0.6658	-0.7637	1909228	Bionet1_002110	CN(C)/C=C\C(=O)c1nn(c2ccc(cc2)C(F)(F)F)c(=O)n(C)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F13	compound treatment	1.19	0.0386	0.52	1.283	-0.00571	-0.08	0.3132	0.5949	1327423	Bionet1_002111	COc1ccc(SCC(=O)Nc2nc(cs2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F14	compound treatment	1.133	-0.0184	-0.25	1.231	-0.0577	-0.79	-0.7319	-0.8871	1909229	Bionet1_002112	[O-][N+](=O)c1ccc(Cn2c(=O)c(C#N)nn(c3ccc(F)cc3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F15	compound treatment	1.141	-0.0104	-0.14	1.302	0.0133	0.18	0.029	0.1265	1909230	Bionet1_002113	CC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F16	compound treatment	1.163	0.0116	0.16	1.247	-0.0417	-0.57	-0.2915	-0.4941	1255507	Bionet1_002114	Fc1ccc(cc1)n2nc(C#N)c(=O)n(Cc3ccc(Cl)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F17	compound treatment	1.176	0.0246	0.33	1.324	0.0353	0.48	0.575	0.9835	1909231	Bionet1_002115	FC(F)(F)c1nnc(NC(=O)CSc2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F18	compound treatment	1.151	-3.98E-4	-0.01	1.252	-0.0367	-0.5	-0.3577	-0.7147	1432583	Bionet1_002116	Fc1cccc(F)c1n2nc(C#N)c(=O)n(Cc3ccc(Cl)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F19	compound treatment	1.12	-0.0314	-0.42	1.258	-0.0307	-0.42	-0.5956	-1.0	1909232	Bionet1_002117	FC(F)(F)c1nnc(NC(=O)CSc2ccc(Cl)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F20	compound treatment	1.175	0.0236	0.32	1.281	-0.00771	-0.11	0.1508	0.4499	1909233	Bionet1_002118	FC(F)(F)c1cccc(c1)C(=O)Nc2nc(cs2)c3sccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F21	compound treatment	1.144	-0.0074	-0.1	1.292	0.00329	0.04	-0.0388	-0.3545	1909234	Bionet1_002119	FC(F)(F)c1nnc(NC(=O)CSc2ccccc2Cl)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	F22	compound treatment	1.104	-0.0474	-0.64	1.272	-0.0167	-0.23	-0.6132	-0.9034	1322477	Bionet1_002120	Cc1ccc(cc1)S(=O)(=O)CCNC(=O)Cc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G03	compound treatment	1.16	0.0086	0.12	1.27	-0.0187	-0.26	-0.0983	-0.3508	1909235	Bionet1_002121	FC(F)(F)c1cccc(CN2N=C(CCC2=O)/C=C/c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G04	compound treatment	1.182	0.0306	0.41	1.319	0.0303	0.41	0.584	1.0	1239262	Bionet1_002122	COC(=O)C1CSC(N1C(=O)Nc2ccc(Cl)cc2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G05	compound treatment	1.128	-0.0234	-0.32	1.273	-0.0157	-0.21	-0.3746	-0.9821	1909236	Bionet1_002123	Clc1ccc(CN2N=C(CCC2=O)/C=C/c3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G06	compound treatment	1.19	0.0386	0.52	1.3	0.0113	0.15	0.4771	0.8786	1909237	Bionet1_002124	COc1ccc(cc1)S(=O)(=O)NN(C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G07	compound treatment	1.151	-3.98E-4	-0.01	1.309	0.0203	0.28	0.1919	0.6933	1909238	Bionet1_002125	CC(C)c1ccc(/C=C/C2=NN(Cc3cccc(c3)C(F)(F)F)C(=O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G08	compound treatment	1.139	-0.0124	-0.17	1.263	-0.0257	-0.35	-0.3661	-0.9427	1489822	Bionet1_002126	COC(=O)C1CSC(N1C(=O)Nc2ccc(Cl)c(Cl)c2)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G09	compound treatment	1.134	-0.0174	-0.23	1.322	0.0333	0.45	0.1551	0.3034	1909239	Bionet1_002127	Cc1ccc(/C=C/C2=NN(Cc3ccc(Cl)c(Cl)c3)C(=O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G10	compound treatment	1.156	0.0046	0.06	1.301	0.0123	0.17	0.1624	0.9086	1909240	Bionet1_002128	CC(=O)C1=NOC2COC3(CCN(CC3)c4ccc(cc4)[N+](=O)[O-])OCC21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G11	compound treatment	1.141	-0.0104	-0.14	1.305	0.0163	0.22	0.0579	0.2204	1428207	Bionet1_002129	Cc1ccc(Sc2ccc(C#N)cc2NC(=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G12	compound treatment	1.202	0.0506	0.68	1.315	0.0263	0.36	0.7363	0.9548	1485122	Bionet1_002130	COC(=O)C1SCC2N1C(=O)CN(Cc3ccc(Cl)cc3)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G13	compound treatment	1.166	0.0146	0.2	1.301	0.0123	0.17	0.2578	0.9968	1281515	Bionet1_002131	Cc1ccc(Sc2ccc(C#N)cc2NC(=O)c3ccccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G14	compound treatment	1.142	-0.0094	-0.13	1.288	-7.05E-4	-0.01	-0.0965	-0.7586	1909241	Bionet1_002132	COC(=O)c1ccccc1N/C=C/c2nccc3c2cnc4c(C#N)cnn43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G15	compound treatment	1.166	0.0146	0.2	1.266	-0.0227	-0.31	-0.0796	-0.217	1185688	Bionet1_002133	Cc1ccc(Sc2ccc(C#N)cc2NC(=O)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G16	compound treatment	1.185	0.0336	0.45	1.28	-0.00871	-0.12	0.2366	0.5049	1909242	Bionet1_002134	CCOC(=O)/C(=C\N(C)C)/Sc1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G17	compound treatment	1.183	0.0316	0.43	1.308	0.0193	0.26	0.4875	0.9731	1247894	Bionet1_002135	COc1cccc(c1)C(=O)Nc2cc(C#N)ccc2Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G18	compound treatment	1.139	-0.0124	-0.17	1.293	0.00429	0.06	-0.0769	-0.4337	1590978	Bionet1_002136	CCOC(=O)CN1C(=C(C(CC1=O)c2ccc(Cl)cc2)C(=O)OCC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G19	compound treatment	1.18	0.0286	0.39	1.276	-0.0127	-0.17	0.1503	0.3554	1527802	Bionet1_002137	Clc1ccc(Sc2ccc(C#N)cc2NC(=O)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G20	compound treatment	1.154	0.0026	0.04	1.288	-7.05E-4	-0.01	0.018	0.4951	1909243	Bionet1_002138	COc1ccc(OC)c(N/C=C/c2nccc3c2cnc4c(C#N)cnn43)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G21	compound treatment	1.194	0.0426	0.57	1.382	0.0933	1.27	1.306	0.9355	1556695	Bionet1_002139	Clc1ccc(Sc2ccc(C#N)cc2NC(=O)c3ccc(Cl)nc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	G22	compound treatment	1.182	0.0306	0.41	1.355	0.0663	0.9	0.9312	0.9369	1909244	Bionet1_002140	FC(F)(F)c1ccc(N/C=C/c2nccc3c2cnc4c(C#N)cnn43)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H03	compound treatment	1.129	-0.0224	-0.3	1.288	-7.05E-4	-0.01	-0.2205	-0.7292	1909245	Bionet1_002141	FC(F)(F)c1nnc(NC(=O)CSc2cccc(Cl)c2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H04	compound treatment	1.068	-0.0834	-1.13	1.257	-0.0317	-0.43	-1.1013	-0.9137	1909246	Bionet1_002142	Cc1ccc(CC(=O)NCCSc2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H05	compound treatment	1.157	0.0056	0.08	1.335	0.0463	0.63	0.4998	0.7861	1909247	Bionet1_002143	FC(F)(F)c1nnc(NC(=O)CSc2cccc(Cl)c2Cl)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H06	compound treatment	1.113	-0.0384	-0.52	1.269	-0.0197	-0.27	-0.5563	-0.9533	1694109	Bionet1_002144	Clc1ccc(CC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H07	compound treatment	1.156	0.0046	0.06	1.27	-0.0187	-0.26	-0.1365	-0.5198	1909248	Bionet1_002145	COC(=O)c1ccccc1SCC(=O)Nc2nnc(s2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H08	compound treatment	1.148	-0.0034	-0.05	1.267	-0.0217	-0.3	-0.2417	-0.807	1217604	Bionet1_002146	Cc1ccc(CC(=O)NCCS(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H09	compound treatment	1.161	0.0096	0.13	1.275	-0.0137	-0.19	-0.0406	-0.1784	1909249	Bionet1_002147	COc1ccc(cc1)S(=O)(=O)CC(=O)Nc2nnc(s2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H10	compound treatment	1.151	-3.98E-4	-0.01	1.295	0.00629	0.09	0.0569	0.6616	1411721	Bionet1_002148	Cc1ccc(CC(=O)NCCS(=O)(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H11	compound treatment	1.113	-0.0384	-0.52	1.316	0.0273	0.37	-0.1031	-0.1616	1909250	Bionet1_002149	FC(F)(F)c1nnc(NC(=O)CS(=O)(=O)c2cccc(Cl)c2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H12	compound treatment	1.124	-0.0274	-0.37	1.317	0.0283	0.39	0.0115	0.0215	1909251	Bionet1_002150	Cc1ccc(Oc2ncccc2/C=N/OCc3ccc(Cl)cc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H13	compound treatment	1.122	-0.0294	-0.4	1.283	-0.00571	-0.08	-0.3355	-0.83	1909252	Bionet1_002151	Cc1ccc(cc1)S(=O)(=O)CC(=O)Nc2nnc(s2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H14	compound treatment	1.121	-0.0304	-0.41	1.338	0.0493	0.67	0.1853	0.2354	1909253	Bionet1_002152	Cc1ccc(Oc2ncccc2/C=N/OCc3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H15	compound treatment	1.154	0.0026	0.04	1.313	0.0243	0.33	0.2591	0.7777	1909254	Bionet1_002153	FC(F)(F)c1nnc(NC(=O)CSc2cc(Cl)ccc2Cl)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H16	compound treatment	1.087	-0.0644	-0.87	1.295	0.00629	0.09	-0.5536	-0.6342	1909255	Bionet1_002154	Clc1ccc(CO/N=C/c2cccnc2Sc3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H17	compound treatment	1.141	-0.0104	-0.14	1.287	-0.00171	-0.02	-0.1156	-0.8132	1909256	Bionet1_002155	CCOC(=O)c1nnc(nc1Sc2ccc(OC)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H18	compound treatment	1.132	-0.0194	-0.26	1.274	-0.0147	-0.2	-0.3268	-0.9914	1909257	Bionet1_002156	Clc1ccc(CO/N=C/c2cccnc2Sc3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H19	compound treatment	1.166	0.0146	0.2	1.287	-0.00171	-0.02	0.1228	0.6193	1909258	Bionet1_002157	CCOC(=O)c1nnc(nc1Sc2ccccc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H20	compound treatment	1.147	-0.0044	-0.06	1.269	-0.0197	-0.27	-0.232	-0.8429	1618073	Bionet1_002158	Cc1ccc(Sc2ncccc2COC(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H21	compound treatment	1.183	0.0316	0.43	1.332	0.0433	0.59	0.7189	0.9872	1909259	Bionet1_002159	CCOC(=O)c1nnc(nc1Sc2cc(C)ccc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	H22	compound treatment	1.126	-0.0254	-0.34	1.332	0.0433	0.59	0.1752	0.2566	1489075	Bionet1_002160	Cc1ccc(Sc2ncccc2COC(=O)Nc3cccc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I03	compound treatment	1.14	-0.0114	-0.15	1.317	0.0283	0.39	0.1641	0.3951	1909260	Bionet1_002161	COc1ccc(NC(=O)/C(=C(/Cl)\SCc2ccccc2)/Cl)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I04	compound treatment	1.125	-0.0264	-0.36	1.279	-0.00971	-0.13	-0.3454	-0.9091	1909261	Bionet1_002162	Ic1ccc(N/C=C/C(=O)c2ccc3ccccc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I05	compound treatment	1.146	-0.0054	-0.07	1.267	-0.0217	-0.3	-0.2608	-0.8556	1909262	Bionet1_002163	CC1(C)CN(C1=O)c2ccc(Oc3ncc(cc3Cl)C(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I06	compound treatment	1.159	0.0076	0.1	1.258	-0.0307	-0.42	-0.2236	-0.5186	1177842	Bionet1_002164	COC(=O)C(CC(=O)c1ccc(Cl)cc1)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I07	compound treatment	1.105	-0.0464	-0.63	1.253	-0.0357	-0.49	-0.7869	-0.9923	1909263	Bionet1_002165	CC(=C)C(=O)Nc1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I08	compound treatment	1.171	0.0196	0.26	1.335	0.0463	0.63	0.6334	0.9254	1472974	Bionet1_002166	COC(=O)C(CC(=O)c1ccc(Cl)cc1)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I09	compound treatment	1.134	-0.0174	-0.23	1.312	0.0233	0.32	0.0587	0.1485	1909264	Bionet1_002167	CC1(C)CN(C1=O)c2ccc(cc2)C(=O)C/C=N/OCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I10	compound treatment	1.202	0.0506	0.68	1.35	0.0613	0.84	1.0737	0.9949	1570637	Bionet1_002168	COC(=O)C(CC(=O)c1ccc(Cl)cc1)c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I11	compound treatment	1.191	0.0396	0.53	1.276	-0.0127	-0.17	0.2553	0.4545	1909265	Bionet1_002169	CC1(C)CN(C1=O)c2ccc(cc2)C(=O)/C=C/c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I12	compound treatment	1.166	0.0146	0.2	1.337	0.0483	0.66	0.605	0.8801	1909266	Bionet1_002170	Clc1ccc(cc1)C2=NNC(=O)C(C2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I13	compound treatment	1.208	0.0566	0.76	1.277	-0.0117	-0.16	0.4271	0.5475	1909267	Bionet1_002171	CC1(C)CN(C1=O)c2cccc(Oc3ncc(cc3Cl)C(F)(F)F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I14	compound treatment	1.148	-0.0034	-0.05	1.269	-0.0197	-0.27	-0.2224	-0.816	1909268	Bionet1_002172	Clc1ccc(cc1)C2=NNC(=O)C(C2)c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I15	compound treatment	1.14	-0.0114	-0.15	1.33	0.0413	0.56	0.2894	0.4959	1236270	Bionet1_002173	CC1(C)CN(C1=O)c2ccc(cc2)c3ccnn3c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I16	compound treatment	1.172	0.0206	0.28	1.325	0.0363	0.49	0.5465	0.9628	1909269	Bionet1_002174	Clc1ccc(cc1)C2CC(=NNC2=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I17	compound treatment	1.162	0.0106	0.14	1.264	-0.0247	-0.34	-0.1371	-0.3746	1909270	Bionet1_002175	C(Sc1ccccc1)c2cc(nc(n2)c3ccccc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I18	compound treatment	1.203	0.0516	0.7	1.213	-0.0757	-1.03	-0.2377	-0.1909	1909271	Bionet1_002176	Clc1ccc(cc1)C2CC(=NNC2=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I19	compound treatment	1.133	-0.0184	-0.25	1.364	0.0753	1.03	0.5505	0.5212	1909272	Bionet1_002177	CSc1cc(CSc2ccc(Cl)cc2)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I20	compound treatment	1.201	0.0496	0.67	1.371	0.0823	1.12	1.2667	0.9695	1909273	Bionet1_002178	Clc1ccc(cc1)C2=NNC(=O)C(C2)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I21	compound treatment	1.191	0.0396	0.53	1.351	0.0623	0.85	0.9784	0.975	1909274	Bionet1_002179	CSc1cc(CS(=O)(=O)c2ccccc2)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	I22	compound treatment	1.157	0.0056	0.08	1.37	0.0813	1.11	0.8373	0.7536	1909275	Bionet1_002180	FC(F)(F)c1cnc(c(Cl)c1)n2cc(c3c[nH][nH]c3=O)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J03	compound treatment	1.161	0.0096	0.13	1.336	0.0473	0.64	0.5476	0.8325	1909276	Bionet1_002181	CCOC(=O)c1nnc(nc1Sc2ccccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J04	compound treatment	1.151	-3.98E-4	-0.01	1.262	-0.0267	-0.36	-0.2613	-0.7175	1405036	Bionet1_002182	Cc1ccc(Sc2ncccc2COC(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J05	compound treatment	1.145	-0.0064	-0.09	1.299	0.0103	0.14	0.0382	0.232	1909277	Bionet1_002183	CCOC(=O)c1nnc(nc1Sc2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J06	compound treatment	1.123	-0.0284	-0.38	1.255	-0.0337	-0.46	-0.5959	-0.9959	1459348	Bionet1_002184	Cc1ccc(Sc2ncccc2COC(=O)Nc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J07	compound treatment	1.119	-0.0324	-0.44	1.269	-0.0197	-0.27	-0.4991	-0.9727	1909278	Bionet1_002185	CCOC(=O)c1nnc(nc1Sc2ccc(F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J08	compound treatment	1.164	0.0126	0.17	1.299	0.0103	0.14	0.2195	0.9955	1626986	Bionet1_002186	Clc1ccc(NC(=O)c2ccccc2Sc3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J09	compound treatment	1.173	0.0216	0.29	1.262	-0.0267	-0.36	-0.0514	-0.1103	1909279	Bionet1_002187	CCOC(=O)c1nnc(nc1Sc2ccccc2C(=O)OC)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J10	compound treatment	1.122	-0.0294	-0.4	1.264	-0.0247	-0.34	-0.5187	-0.9967	1909280	Bionet1_002188	FC(F)(F)c1cccc(NC(=O)c2ccccc2Sc3ccccc3C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J11	compound treatment	1.159	0.0076	0.1	1.32	0.0313	0.43	0.3743	0.8528	1909281	Bionet1_002189	CCOC(=O)c1nnc(nc1Oc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J12	compound treatment	1.153	0.0016	0.02	1.226	-0.0627	-0.86	-0.5893	-0.689	1161119	Bionet1_002190	COc1ccc(NC(=O)c2ccccc2Sc3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J13	compound treatment	1.133	-0.0184	-0.25	1.277	-0.0117	-0.16	-0.2884	-0.9772	1909282	Bionet1_002191	CCOC(=O)c1nnc(nc1Oc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J14	compound treatment	1.184	0.0326	0.44	1.26	-0.0287	-0.39	0.0342	0.0581	1222321	Bionet1_002192	Clc1ccc(NC(=O)c2ccccc2S(=O)c3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J15	compound treatment	1.134	-0.0174	-0.23	1.278	-0.0107	-0.15	-0.2692	-0.9739	1909283	Bionet1_002193	CCOC(=O)c1nnc(nc1Oc2c(Cl)cccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J16	compound treatment	1.137	-0.0144	-0.19	1.247	-0.0417	-0.57	-0.5395	-0.8977	1703051	Bionet1_002194	Clc1ccc(NC(=O)c2ccccc2S(=O)(=O)c3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J17	compound treatment	1.188	0.0366	0.49	1.322	0.0333	0.45	0.6702	0.9991	1909284	Bionet1_002195	CCOC(=O)c1nnc(nc1Oc2ccccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J18	compound treatment	1.114	-0.0374	-0.5	1.284	-0.00471	-0.06	-0.4021	-0.7907	1315840	Bionet1_002196	COc1ccc(NC(=O)c2ccccc2S(=O)c3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J19	compound treatment	1.208	0.0566	0.76	1.289	2.95E-4	0.0	0.5428	0.7108	1909285	Bionet1_002197	CCOC(=O)c1nnc(nc1Oc2ccc(OC)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J20	compound treatment	1.141	-0.0104	-0.14	1.261	-0.0277	-0.38	-0.3663	-0.909	1208169	Bionet1_002198	COc1ccc(NC(=O)c2ccccc2S(=O)(=O)c3ccccc3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J21	compound treatment	1.181	0.0296	0.4	1.364	0.0753	1.03	1.0084	0.9153	1909286	Bionet1_002199	CCOC(=O)c1nnc(nc1Oc2ccccc2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	J22	compound treatment	1.134	-0.0174	-0.23	1.259	-0.0297	-0.41	-0.4524	-0.9663	1536537	Bionet1_002200	O=C(Nc1ccccc1)c2ccccc2S(=O)(=O)c3ccccc3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K03	compound treatment	1.118	-0.0334	-0.45	1.267	-0.0217	-0.3	-0.5279	-0.9792	1909287	Bionet1_002201	O=S(=O)(Cc1cc(nc(n1)c2ccccn2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K04	compound treatment	1.138	-0.0134	-0.18	1.283	-0.00571	-0.08	-0.1828	-0.9291	1909288	Bionet1_002202	NC(=O)Cc1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K05	compound treatment	1.064	-0.0874	-1.18	1.288	-7.05E-4	-0.01	-0.8405	-0.7129	1137727	Bionet1_002203	O=S(=O)(Cc1cc(nc(n1)c2ccncc2)N3CCCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K06	compound treatment	1.297	0.146	1.96	1.305	0.0163	0.22	1.5461	0.7821	1909289	Bionet1_002204	COC(=O)C1CCN(CC1)c2c(cc(cc2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K07	compound treatment	1.086	-0.0654	-0.88	1.31	0.0213	0.29	-0.4185	-0.4506	1240316	Bionet1_002205	C(Sc1ccccc1)c2cc(nc(n2)c3ccncc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K08	compound treatment	1.159	0.0076	0.1	1.313	0.0243	0.33	0.3068	0.8846	1619521	Bionet1_002206	COc1ccc(cc1)C2CC(=O)C(CS(=O)(=O)c3ccccc3)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K09	compound treatment	1.192	0.0406	0.55	1.269	-0.0197	-0.27	0.1973	0.3234	1163902	Bionet1_002207	Clc1ccc(cc1Cl)C(=O)Nc2ccc(Sc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K10	compound treatment	1.222	0.0706	0.95	1.317	0.0283	0.39	0.9463	0.9209	1909290	Bionet1_002208	ClC1=C(CS(=O)(=O)c2ccccc2)C(=O)CC(C1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K11	compound treatment	1.163	0.0116	0.16	1.309	0.0203	0.28	0.3064	0.9636	1909291	Bionet1_002209	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc(Sc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K12	compound treatment	1.177	0.0256	0.35	1.274	-0.0147	-0.2	0.1024	0.2565	1909292	Bionet1_002210	C/[N+](=C/c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13)/[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K13	compound treatment	1.117	-0.0344	-0.46	1.327	0.0383	0.52	0.0411	0.0589	1507420	Bionet1_002211	Clc1ccc(cc1)C(=O)Nc2ccc(Sc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K14	compound treatment	1.207	0.0556	0.75	1.311	0.0223	0.3	0.7454	0.9209	1909293	Bionet1_002212	NC(=O)C(=O)c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K15	compound treatment	1.187	0.0356	0.48	1.295	0.00629	0.09	0.4003	0.8205	1909294	Bionet1_002213	Clc1ccc(cc1)S(=O)Cc2cc(nc(n2)c3ccccn3)N4CCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K16	compound treatment	1.158	0.0066	0.09	1.305	0.0163	0.22	0.2201	0.9194	1909295	Bionet1_002214	FC(F)(F)c1cnc(c(Cl)c1)n2cc(C=C(C#N)C#N)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K17	compound treatment	1.095	-0.0564	-0.76	1.317	0.0283	0.39	-0.2652	-0.3108	1723501	Bionet1_002215	Clc1cc(Cl)cc(c1)C(=O)Nc2ccc(Sc3ccccc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K18	compound treatment	1.187	0.0356	0.48	1.307	0.0183	0.25	0.516	0.9534	1909296	Bionet1_002216	CO/N=C\c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K19	compound treatment	1.128	-0.0234	-0.32	1.305	0.0163	0.22	-0.0661	-0.1712	1909297	Bionet1_002217	Clc1ccc(SCc2cc(nc(n2)c3ccccc3)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K20	compound treatment	1.157	0.0056	0.08	1.338	0.0493	0.67	0.5288	0.7817	1909298	Bionet1_002218	CCOC(=O)/C=C\c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K21	compound treatment	1.127	-0.0244	-0.33	1.322	0.0333	0.45	0.0883	0.1575	1287437	Bionet1_002219	Cc1ccc(Sc2ccc(NC(=O)c3ccc(F)cc3)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	K22	compound treatment	1.212	0.0606	0.82	1.335	0.0463	0.63	1.0245	0.9918	1909299	Bionet1_002220	CC(=O)/C=C\c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L03	compound treatment	1.147	-0.0044	-0.06	1.251	-0.0377	-0.51	-0.4055	-0.7835	1909300	Bionet1_002221	CCOC(=O)c1nnc(nc1Sc2ccccc2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L04	compound treatment	1.135	-0.0164	-0.22	1.283	-0.00571	-0.08	-0.2114	-0.9017	1909301	Bionet1_002222	Cc1ccc(CO/N=C\2/c3ccccc3-c4nnc(cc24)c5ccc(C)cc5)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L05	compound treatment	1.157	0.0056	0.08	1.252	-0.0367	-0.5	-0.3005	-0.5936	1909302	Bionet1_002223	CCOC(=O)c1nnc(nc1Sc2ccccc2Cl)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L06	compound treatment	1.142	-0.0094	-0.13	1.255	-0.0337	-0.46	-0.4147	-0.8697	1258226	Bionet1_002224	Clc1ccc(cc1)C(=O)c2c[nH]cc2c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L07	compound treatment	1.15	-0.0014	-0.02	1.256	-0.0327	-0.45	-0.3287	-0.7364	1909303	Bionet1_002225	CCOC(=O)c1nnc(nc1Sc2cccc(Cl)c2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L08	compound treatment	1.09	-0.0614	-0.83	1.22	-0.0687	-0.94	-1.2482	-0.9981	1909304	Bionet1_002226	Clc1ccc(cc1)C(=O)c2c[nH]cc2c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L09	compound treatment	1.18	0.0286	0.39	1.278	-0.0107	-0.15	0.1696	0.4111	1909305	Bionet1_002227	CCOC(=O)c1nnc(nc1Sc2ccc(Cl)cc2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L10	compound treatment	1.172	0.0206	0.28	1.264	-0.0247	-0.34	-0.0417	-0.0955	1909306	Bionet1_002228	Clc1ccc(cc1)C(=O)c2c[nH]cc2c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L11	compound treatment	1.138	-0.0134	-0.18	1.326	0.0373	0.51	0.2318	0.4295	1909307	Bionet1_002229	CCOC(=O)c1nnc(nc1Oc2ccccc2Cl)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L12	compound treatment	1.12	-0.0314	-0.42	1.281	-0.00771	-0.11	-0.3738	-0.8566	1909308	Bionet1_002230	Clc1ccc(cc1)C(=O)c2c[nH]cc2c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L13	compound treatment	1.126	-0.0254	-0.34	1.329	0.0403	0.55	0.1463	0.2259	1403197	Bionet1_002231	Cn1nc(c(C(O)C#Cc2ccccc2)c1Sc3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L14	compound treatment	1.178	0.0266	0.36	1.242	-0.0467	-0.64	-0.1966	-0.2689	1909309	Bionet1_002232	Clc1ccc(cc1)C(=O)c2c[nH]cc2c3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L15	compound treatment	1.097	-0.0544	-0.73	1.305	0.0163	0.22	-0.3618	-0.4719	1909310	Bionet1_002233	CCCCC#CC(O)c1c(Sc2ccc(C)cc2)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L16	compound treatment	1.147	-0.0044	-0.06	1.26	-0.0287	-0.39	-0.3187	-0.8051	1291198	Bionet1_002234	COc1ccc(cc1OC)C(=O)c2c[nH]cc2c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L17	compound treatment	1.19	0.0386	0.52	1.282	-0.00671	-0.09	0.3036	0.5742	1909311	Bionet1_002235	CCCCC#CC(O)c1c(Sc2ccccc2)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L18	compound treatment	1.107	-0.0444	-0.6	1.244	-0.0447	-0.61	-0.8546	-1.0	1909312	Bionet1_002236	CSCc1cc(Sc2ccc(Cl)cc2)nc(n1)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L19	compound treatment	1.197	0.0456	0.62	1.268	-0.0207	-0.28	0.2354	0.3477	1909313	Bionet1_002237	Cc1ccc(Sc2c(C(O)c3cccs3)c(nn2C)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L20	compound treatment	1.145	-0.0064	-0.09	1.232	-0.0567	-0.77	-0.6078	-0.7812	1909314	Bionet1_002238	CS(=O)(=O)Cc1cc(Sc2ccc(Cl)cc2)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L21	compound treatment	1.133	-0.0184	-0.25	1.273	-0.0157	-0.21	-0.3269	-0.9973	1909315	Bionet1_002239	CCOC(=O)c1nnc(nc1Oc2ccc(OC)cc2)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	L22	compound treatment	1.131	-0.0204	-0.28	1.266	-0.0227	-0.31	-0.4135	-0.9983	1728928	Bionet1_002240	CSc1cc(c2ccccc2)n(Cc3ccc(Cl)cc3)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M03	compound treatment	1.15	-0.0014	-0.02	1.293	0.00429	0.06	0.0281	0.4563	1546846	Bionet1_002241	Cc1ccc(Sc2ccc(NC(=O)c3ccccc3C)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M04	compound treatment	1.172	0.0206	0.28	1.306	0.0173	0.24	0.3633	0.9967	1909316	Bionet1_002242	[O-][N+](=O)/C=C\c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M05	compound treatment	1.171	0.0196	0.26	1.323	0.0343	0.47	0.5177	0.9636	1243374	Bionet1_002243	Cc1ccc(Sc2ccc(NC(=O)c3ccccc3Cl)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M06	compound treatment	1.205	0.0536	0.72	1.276	-0.0127	-0.17	0.3888	0.5229	1632338	Bionet1_002244	Clc1ccc(nn1)N2CCC(CC2)C(=O)NCC3CC4CCCCN4O3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M07	compound treatment	1.193	0.0416	0.56	1.287	-0.00171	-0.02	0.3804	0.6772	1635382	Bionet1_002245	Fc1ccc(cc1)C(=O)Nc2ccc(Sc3ccc(Cl)cc3)c(C#N)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M08	compound treatment	1.204	0.0526	0.71	1.302	0.0133	0.18	0.63	0.8601	1909317	Bionet1_002246	Cc1c(Br)c2ccccc2n1c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M09	compound treatment	1.113	-0.0384	-0.52	1.262	-0.0267	-0.36	-0.6238	-0.9851	1909318	Bionet1_002247	CN(C)c1cc(CS(=O)c2ccc(Cl)cc2)nc(n1)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M10	compound treatment	1.142	-0.0094	-0.13	1.266	-0.0227	-0.31	-0.3086	-0.9223	1909319	Bionet1_002248	FC(F)(F)c1cnc(c(Cl)c1)n2cc(Br)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M11	compound treatment	1.149	-0.0024	-0.03	1.282	-0.00671	-0.09	-0.0875	-0.9025	1449907	Bionet1_002249	Cc1ccccc1Sc2ccc(NC(=O)c3ccc(F)cc3)cc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M12	compound treatment	1.165	0.0136	0.18	1.305	0.0163	0.22	0.2869	0.9955	1568934	Bionet1_002250	Clc1ccc(cc1)C2CC(=O)C(CS(=O)(=O)c3ccccc3)C(=O)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M13	compound treatment	1.123	-0.0284	-0.38	1.282	-0.00671	-0.09	-0.3356	-0.8519	1443702	Bionet1_002251	Cc1ccccc1Sc2ccc(NC(=O)c3ccccc3Cl)cc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M14	compound treatment	1.172	0.0206	0.28	1.301	0.0123	0.17	0.3151	0.9707	1909320	Bionet1_002252	CN(C)/C=C/C(=O)c1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M15	compound treatment	1.21	0.0586	0.79	1.286	-0.00271	-0.04	0.5329	0.6734	1154525	Bionet1_002253	Cc1ccccc1Sc2ccc(NC(=O)c3cccc(Cl)c3)cc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M16	compound treatment	1.083	-0.0684	-0.92	1.287	-0.00171	-0.02	-0.6689	-0.7247	1909321	Bionet1_002254	NNC(=O)Cc1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M17	compound treatment	1.119	-0.0324	-0.44	1.319	0.0303	0.41	-0.0169	-0.0282	1297917	Bionet1_002255	Cc1ccc(Sc2ccc(NC(=O)c3cccc(C)c3)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M18	compound treatment	1.185	0.0336	0.45	1.318	0.0293	0.4	0.603	0.998	1909322	Bionet1_002256	FC(F)(F)Oc1ccc(N/C=C\2/CCN(C2=O)c3ncccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M19	compound treatment	1.191	0.0396	0.53	1.288	-7.05E-4	-0.01	0.371	0.6943	1229272	Bionet1_002257	COc1ccc(Sc2ccc(NC(=O)c3ccccc3Cl)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M20	compound treatment	1.191	0.0396	0.53	1.347	0.0583	0.79	0.9399	0.9813	1909323	Bionet1_002258	COc1ccc(/C=C(\C#N)/c2ccc(s2)C(=O)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M21	compound treatment	1.193	0.0416	0.56	1.357	0.0683	0.93	1.0554	0.9706	1643147	Bionet1_002259	COc1ccc(Sc2ccc(NC(=O)c3c(F)cccc3F)cc2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	M22	compound treatment	1.2	0.0486	0.66	1.351	0.0623	0.85	1.0643	0.9918	1909324	Bionet1_002260	COc1ccc(/C=C(\C#N)/c2ccc(s2)C(=O)c3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N03	compound treatment	1.138	-0.0134	-0.18	1.253	-0.0357	-0.49	-0.4721	-0.909	1909325	Bionet1_002261	Brc1ccc(Sc2nc3ccccc3cc2c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N04	compound treatment	1.12	-0.0314	-0.42	1.224	-0.0647	-0.88	-0.9234	-0.9435	1909326	Bionet1_002262	CSc1cc(c2ccccc2)n(Cc3cccc(c3)C(F)(F)F)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N05	compound treatment	1.163	0.0116	0.16	1.275	-0.0137	-0.19	-0.0215	-0.0881	1909327	Bionet1_002263	Clc1ccc(Sc2nc3ccccc3cc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N06	compound treatment	1.122	-0.0294	-0.4	1.267	-0.0217	-0.3	-0.4897	-0.9896	1703342	Bionet1_002264	CSc1cc(c2ccccc2)n(Cc3ccc(cc3)C(C)(C)C)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N07	compound treatment	1.137	-0.0144	-0.19	1.267	-0.0217	-0.3	-0.3466	-0.9791	1460201	Bionet1_002265	Fc1ccc(Sc2nc3ccccc3cc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N08	compound treatment	1.104	-0.0474	-0.64	1.263	-0.0257	-0.35	-0.7	-0.96	1144549	Bionet1_002266	CSc1cc(c2ccc(Cl)cc2)n(Cc3ccc(F)cc3)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N09	compound treatment	1.147	-0.0044	-0.06	1.342	0.0533	0.73	0.4719	0.6472	1629546	Bionet1_002267	COc1ccc(Sc2nc3ccccc3cc2c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N10	compound treatment	1.096	-0.0554	-0.75	1.312	0.0233	0.32	-0.3038	-0.3742	1450985	Bionet1_002268	CSc1cc(c2ccc(Cl)cc2)n(Cc3ccc(C)cc3)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N11	compound treatment	1.087	-0.0644	-0.87	1.29	0.00129	0.02	-0.6018	-0.6926	1909328	Bionet1_002269	Clc1ccc(cc1)c2cc3ccccc3nc2Sc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N12	compound treatment	1.15	-0.0014	-0.02	1.224	-0.0647	-0.88	-0.6373	-0.7221	1208224	Bionet1_002270	CSc1cc(c2ccc(Cl)cc2)n(Cc3ccccc3C)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N13	compound treatment	1.113	-0.0384	-0.52	1.247	-0.0417	-0.57	-0.7684	-0.9989	1909329	Bionet1_002271	Clc1ccc(cc1)c2cc3ccccc3nc2Sc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N14	compound treatment	1.146	-0.0054	-0.07	1.291	0.00229	0.03	-0.0294	-0.3705	1119335	Bionet1_002272	CSc1cc(c2ccc(Cl)cc2)n(Cc3ccccc3)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N15	compound treatment	1.182	0.0306	0.41	1.293	0.00429	0.06	0.3333	0.7994	1909330	Bionet1_002273	Clc1ccc(Cl)c(Sc2nc3ccccc3cc2c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N16	compound treatment	1.065	-0.0864	-1.17	1.281	-0.00771	-0.11	-0.8985	-0.7677	1479016	Bionet1_002274	CCOC(=O)Cn1c(cc(SC)c(C#N)c1=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N17	compound treatment	1.208	0.0566	0.76	1.293	0.00429	0.06	0.5814	0.7591	1909331	Bionet1_002275	Clc1ccc(Sc2nc3ccccc3cc2c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N18	compound treatment	1.165	0.0136	0.18	1.265	-0.0237	-0.32	-0.0988	-0.2659	1173778	Bionet1_002276	CSc1cc(c2ccccc2)n(Cc3cccc(F)c3)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N19	compound treatment	1.122	-0.0294	-0.4	1.294	0.00529	0.07	-0.2294	-0.569	1909332	Bionet1_002277	Cc1ccc(cc1)c2cc3ccccc3nc2Sc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N20	compound treatment	1.118	-0.0334	-0.45	1.293	0.00429	0.06	-0.2772	-0.6101	1523934	Bionet1_002278	CSc1cc(c2ccccc2)n(Cc3ccccc3Cl)c(=O)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N21	compound treatment	1.212	0.0606	0.82	1.283	-0.00571	-0.08	0.5231	0.6369	1909333	Bionet1_002279	Cc1ccc(cc1)c2cc3ccccc3nc2Sc4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	N22	compound treatment	1.101	-0.0504	-0.68	1.261	-0.0277	-0.38	-0.7479	-0.9615	1909334	Bionet1_002280	CC(Sc1ncc(cc1Cl)C(F)(F)F)c2ccnc3c(C#N)cnn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O03	compound treatment	1.153	0.0016	0.02	1.283	-0.00571	-0.08	-0.0397	-0.4921	1567916	Bionet1_002281	Cc1ccc(cc1)S(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O04	compound treatment	1.158	0.0066	0.09	1.332	0.0433	0.59	0.4804	0.8047	1909335	Bionet1_002282	CN(C)c1ccc(/C=C(\C#N)/c2ccc(s2)C(=O)c3ccccc3F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O05	compound treatment	1.169	0.0176	0.24	1.28	-0.00871	-0.12	0.084	0.3163	1677425	Bionet1_002283	Cc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)c3ccccc3C)cc2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O06	compound treatment	1.138	-0.0134	-0.18	1.337	0.0483	0.66	0.3379	0.4947	1909336	Bionet1_002284	Cc1ccsc1/C=C(\C#N)/c2ccc(s2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O07	compound treatment	1.135	-0.0164	-0.22	1.264	-0.0247	-0.34	-0.3946	-0.9792	1909337	Bionet1_002285	CC(C)c1ccc(/C=C/c2ccc(=O)n(Cc3cccc(c3)C(F)(F)F)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O08	compound treatment	1.16	0.0086	0.12	1.298	0.00929	0.13	0.1717	0.999	1909338	Bionet1_002286	Fc1ccc(cc1)C(=O)c2ccc(s2)/C(=C/c3ccc(Cl)cc3)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O09	compound treatment	1.225	0.0736	0.99	1.396	0.107	1.46	1.7367	0.9822	1909339	Bionet1_002287	Cc1ccc(/C=C/c2ccc(=O)n(Cc3ccc(cc3)C(C)(C)C)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O10	compound treatment	1.139	-0.0124	-0.17	1.336	0.0473	0.64	0.3378	0.507	1909340	Bionet1_002288	Fc1ccccc1C(=O)c2ccc(s2)/C(=C/c3ccc(Cl)cc3)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O11	compound treatment	1.128	-0.0234	-0.32	1.292	0.00329	0.04	-0.1914	-0.6004	1909341	Bionet1_002289	Cc1ccc(/C=C/c2ccc(=O)n(Cc3ccc(Cl)cc3Cl)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O12	compound treatment	1.163	0.0116	0.16	1.349	0.0603	0.82	0.6921	0.8269	1909342	Bionet1_002290	FC(F)(F)c1cnc(Oc2ccc(NC(=O)CCCCl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O13	compound treatment	1.146	-0.0054	-0.07	1.262	-0.0267	-0.36	-0.309	-0.832	1313798	Bionet1_002291	COC(=O)c1cc(C#N)c(NCc2ccc(Cl)cc2Cl)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O14	compound treatment	1.133	-0.0184	-0.25	1.276	-0.0127	-0.17	-0.298	-0.9846	1909343	Bionet1_002292	FC(F)(F)c1cnc(Oc2cccc(NC(=O)CCCCl)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O15	compound treatment	1.194	0.0426	0.57	1.263	-0.0257	-0.35	0.1585	0.2355	1354365	Bionet1_002293	CCOC(=O)c1cc(C#N)c(Sc2ccccc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O16	compound treatment	1.152	6.02E-4	0.01	1.295	0.00629	0.09	0.0664	0.7706	1909344	Bionet1_002294	Cc1ccc(cc1)n2cc(c(n2)C(F)(F)F)c3ccc4ccccc4c3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O17	compound treatment	1.182	0.0306	0.41	1.279	-0.00971	-0.13	0.1983	0.4575	1909345	Bionet1_002295	CCOC(=O)c1cc(C#N)c(Sc2ccc(Cl)cc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O18	compound treatment	1.178	0.0266	0.36	1.366	0.0773	1.05	0.9991	0.8973	1625467	Bionet1_002296	CCOC(=O)c1sc(NC(=O)Nc2ccccc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O19	compound treatment	1.164	0.0126	0.17	1.264	-0.0247	-0.34	-0.118	-0.3127	1305867	Bionet1_002297	CCOC(=O)c1cc(C#N)c(Sc2ccc(OC)cc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O20	compound treatment	1.162	0.0106	0.14	1.328	0.0393	0.54	0.48	0.8655	1909346	Bionet1_002298	CCOC(=O)C(=CNc1nc(cs1)c2ccc(Cl)cc2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O21	compound treatment	1.181	0.0296	0.4	1.349	0.0603	0.82	0.8638	0.945	1909347	Bionet1_002299	FC(F)(F)c1cccc(Cn2nc(/C=C/c3ccccc3)ccc2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	O22	compound treatment	1.196	0.0446	0.6	1.316	0.0273	0.37	0.6887	0.9733	1909348	Bionet1_002300	Cc1ccc(SCc2ccc(CSc3ccc(C)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P03	compound treatment	1.116	-0.0354	-0.48	1.302	0.0133	0.18	-0.2095	-0.4101	1909349	Bionet1_002301	Cc1ccc(cc1)c2cc3ccccc3nc2Sc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P04	compound treatment	1.142	-0.0094	-0.13	1.237	-0.0517	-0.71	-0.5882	-0.8211	1159528	Bionet1_002302	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P05	compound treatment	1.164	0.0126	0.17	1.264	-0.0247	-0.34	-0.118	-0.3127	1909350	Bionet1_002303	Cc1ccc(cc1)c2cc3ccccc3nc2Sc4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P06	compound treatment	1.11	-0.0414	-0.56	1.266	-0.0227	-0.31	-0.6138	-0.9613	1909351	Bionet1_002304	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P07	compound treatment	1.134	-0.0174	-0.23	1.295	0.00629	0.09	-0.1053	-0.4212	1663387	Bionet1_002305	CC1CN(CC(C)O1)c2nc3ccccc3cc2c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P08	compound treatment	1.144	-0.0074	-0.1	1.254	-0.0347	-0.47	-0.4052	-0.8378	1081417	Bionet1_002306	CC1(C)CC(=O)C2=C(C1)Nc3ccccc3NC2c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P09	compound treatment	1.03	-0.121	-1.64	1.232	-0.0567	-0.77	-1.7048	-0.9413	1909352	Bionet1_002307	FC(F)(F)c1cccc(c1)c2cc3ccccc3nc2N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P10	compound treatment	0.165	-0.986	-13.31	0.422	-0.867	-11.82	-17.7667	-0.9983	1572032	Bionet1_002308	Cc1cc2NC(C3=C(CCCC3=O)Nc2cc1C)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P11	compound treatment	1.116	-0.0354	-0.48	1.238	-0.0507	-0.69	-0.8266	-0.9837	1909353	Bionet1_002309	Fc1ccc(OCc2ncc(cn2)c3ncc(cc3Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P12	compound treatment	1.121	-0.0304	-0.41	1.229	-0.0597	-0.81	-0.8657	-0.9496	1462066	Bionet1_002310	Cc1cc2NC(C3=C(CCCC3=O)Nc2cc1C)c4ccc(Br)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P13	compound treatment	1.147	-0.0044	-0.06	1.302	0.0133	0.18	0.0862	0.4521	1486895	Bionet1_002311	Clc1ccc(CN2CCC(CC2)c3cc([nH]n3)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P14	compound treatment	1.107	-0.0444	-0.6	1.234	-0.0547	-0.75	-0.951	-0.9941	1909354	Bionet1_002312	Cc1cc2NC(C3=C(CCCC3=O)Nc2cc1C)c4ccc(cc4)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P15	compound treatment	1.151	-3.98E-4	-0.01	1.287	-0.00171	-0.02	-0.0202	-0.8481	1652067	Bionet1_002313	CCOC(=O)c1cnc2c(cc(Cl)cc2c1O)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P16	compound treatment	1.102	-0.0494	-0.67	1.281	-0.00771	-0.11	-0.5455	-0.8086	1187202	Bionet1_002314	Cc1cc2NC(C3=C(CCCC3=O)Nc2cc1C)c4cccc(Br)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P17	compound treatment	1.086	-0.0654	-0.88	1.181	-0.108	-1.47	-1.6624	-0.9703	1909355	Bionet1_002315	FC(F)(F)c1cnc(c(Cl)c1)C(C#N)(N2CCOCC2)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P18	compound treatment	1.068	-0.0834	-1.13	1.289	2.95E-4	0.0	-0.7927	-0.7046	1303113	Bionet1_002316	Cc1ccc(cc1)C2Nc3cc(C)c(C)cc3NC4=C2C(=O)CC(C)(C)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P19	compound treatment	1.178	0.0266	0.36	1.29	0.00129	0.02	0.2662	0.741	1909356	Bionet1_002317	[O-][N+](=O)c1ccc(CN2CCC(CC2)c3cc([nH]n3)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P20	compound treatment	1.094	-0.0574	-0.77	1.279	-0.00971	-0.13	-0.6411	-0.8161	1909357	Bionet1_002318	C/C(=N\Nc1ccc(OC(F)(F)F)cc1)/C(=N/O)/C(=O)Nc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P21	compound treatment	1.138	-0.0134	-0.18	1.363	0.0743	1.01	0.5886	0.5719	1909358	Bionet1_002319	FC(F)(F)c1cc(N/N=C\2/C(=O)OC(=O)c3ccccc23)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.574	P22	compound treatment	1.209	0.0576	0.78	1.258	-0.0307	-0.42	0.2534	0.2871	1563610	Bionet1_002320	COc1ccc(cc1)C2Nc3cc(C)c(C)cc3NC4=C2C(=O)CC(C)(C)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A03	compound treatment	1.16	-0.00603	-0.08	1.293	-0.00727	-0.1	-0.1276	-0.9952	1909359	Bionet1_002321	Fc1ccccc1CO/N=C/CC(=O)c2cnc(s2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A04	compound treatment	1.191	0.025	0.34	1.319	0.0187	0.26	0.4189	0.9907	1909360	Bionet1_002322	CC1=C(C(NC(=S)N1)c2ccc(Cl)cc2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A05	compound treatment	1.135	-0.031	-0.42	1.303	0.00273	0.04	-0.2696	-0.6416	1909361	Bionet1_002323	COc1ccc(cc1)S(=O)(=O)n2ccc(n2)c3cnc(s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A06	compound treatment	1.17	0.00397	0.05	1.325	0.0247	0.34	0.2764	0.8093	1909362	Bionet1_002324	CC1=C(C(NC(=S)N1)c2c(F)cccc2Cl)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A07	compound treatment	1.155	-0.011	-0.15	1.267	-0.0333	-0.45	-0.426	-0.8923	1909363	Bionet1_002325	O=S(=O)(c1cccs1)n2ccc(n2)c3cnc(s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A08	compound treatment	1.189	0.023	0.31	1.358	0.0577	0.79	0.7758	0.917	1909364	Bionet1_002326	CC1=C(C(N2C(=O)CSC2=N1)c3ccc(Cl)cc3)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A09	compound treatment	1.125	-0.041	-0.55	1.239	-0.0613	-0.84	-0.9821	-0.98	1909365	Bionet1_002327	O=S(=O)(c1ccccc1)n2ccc(n2)c3cnc(s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A10	compound treatment	1.204	0.038	0.51	1.267	-0.0333	-0.45	0.0415	0.0606	1452419	Bionet1_002328	CCOC(=O)C1=C(C)NC2=C(C1c3ccc(OC)cc3)C(=O)CC(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A11	compound treatment	1.158	-0.00803	-0.11	1.267	-0.0333	-0.45	-0.3974	-0.852	1909366	Bionet1_002329	Fc1ccc(cc1)S(=O)(=O)n2ccc(n2)c3cnc(s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A12	compound treatment	1.194	0.028	0.38	1.304	0.00373	0.05	0.3028	0.7953	1228507	Bionet1_002330	CCOC(=O)c1c(C)nc2CC(C)(C)CC(=O)c2c1c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A13	compound treatment	1.117	-0.049	-0.66	1.315	0.0147	0.2	-0.3256	-0.4711	1743309	Bionet1_002331	COc1ccc(cc1)C(=O)n2ccc(n2)c3cnc(s3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A14	compound treatment	1.161	-0.00503	-0.07	1.334	0.0337	0.46	0.2773	0.5964	1909367	Bionet1_002332	CN(C)/C=C(\c1ccc(Cl)cc1)/S(=O)(=O)\C=C\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A15	compound treatment	1.156	-0.01	-0.14	1.225	-0.0753	-1.03	-0.8214	-0.7934	1909368	Bionet1_002333	FC(F)(F)c1ccc(Oc2ccc(NC(=O)C3CC3)cc2Cl)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A16	compound treatment	1.215	0.049	0.66	1.337	0.0367	0.5	0.8214	0.9907	1909369	Bionet1_002334	COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(F)cc2C)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A17	compound treatment	1.181	0.015	0.2	1.275	-0.0253	-0.34	-0.1008	-0.2524	1909370	Bionet1_002335	Cc1c(sc(C#N)c1c2ccccc2)C(=O)N/C=N/OCc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A18	compound treatment	1.233	0.067	0.9	1.304	0.00373	0.05	0.6749	0.7458	1909371	Bionet1_002336	Cc1ccc(cc1)c2nc(ncc2N=Nc3cccc(C)c3C)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A19	compound treatment	1.147	-0.019	-0.26	1.224	-0.0763	-1.04	-0.9169	-0.856	1909372	Bionet1_002337	COc1cc(NC(=O)c2ccccc2CC[N+](=O)[O-])cc(OC)c1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A20	compound treatment	1.214	0.048	0.65	1.26	-0.0403	-0.55	0.0694	0.0817	1909373	Bionet1_002338	CCOC(=O)C1=C(NC2=C(C1c3ccc(F)cc3)C(=O)CCC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A21	compound treatment	1.166	-2.82E-5	0.0	1.262	-0.0383	-0.52	-0.3693	-0.7076	1909374	Bionet1_002339	[O-][N+](=O)CCc1ccccc1NC(=O)N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	A22	compound treatment	1.19	0.024	0.32	1.277	-0.0233	-0.32	0.0043	0.0096	1909375	Bionet1_002340	O=c1n(c(SCc2ccccc2)nc3ccsc13)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B03	compound treatment	1.176	0.00997	0.13	1.278	-0.0223	-0.3	-0.1196	-0.3601	1909376	Bionet1_002341	CS(=O)c1ccccc1c2nc(no2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B04	compound treatment	1.152	-0.014	-0.19	1.317	0.0167	0.23	0.0275	0.0929	1909377	Bionet1_002342	Clc1ccc(Cn2nc(/C=C/c3ccccc3)ccc2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B05	compound treatment	1.217	0.051	0.69	1.273	-0.0273	-0.37	0.2233	0.2857	1909378	Bionet1_002343	CS(=O)(=O)c1ccccc1c2nc(no2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B06	compound treatment	1.177	0.011	0.15	1.332	0.0317	0.43	0.4107	0.8979	1909379	Bionet1_002344	CCOC(=O)c1cc(C#N)c(Sc2ccccc2Cl)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B07	compound treatment	1.194	0.028	0.38	1.302	0.00173	0.02	0.2835	0.7499	1503315	Bionet1_002345	CC(C)(C)c1ccc(cc1)c2noc(n2)c3ccccc3S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B08	compound treatment	1.182	0.016	0.22	1.3	-2.66E-4	0.0	0.1498	0.6951	1135151	Bionet1_002346	CCOC(=O)c1cc(C#N)c(Oc2cc(C)cc(C)c2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B09	compound treatment	1.166	-2.82E-5	0.0	1.281	-0.0193	-0.26	-0.186	-0.7081	1909380	Bionet1_002347	CS(=O)c1ccccc1c2nc(no2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B10	compound treatment	1.137	-0.029	-0.39	1.293	-0.00727	-0.1	-0.347	-0.859	1554904	Bionet1_002348	CCOC(=O)c1cc(C#N)c(Oc2ccc(F)cc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B11	compound treatment	1.177	0.011	0.15	1.329	0.0287	0.39	0.3817	0.9114	1909381	Bionet1_002349	CS(=O)(=O)c1ccccc1c2nc(no2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B12	compound treatment	1.124	-0.042	-0.57	1.309	0.00873	0.12	-0.3167	-0.5467	1909382	Bionet1_002350	CCOC(=O)c1cc(C#N)c(Oc2ccccc2OC)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B13	compound treatment	1.189	0.023	0.31	1.317	0.0167	0.23	0.3805	0.9887	1909383	Bionet1_002351	COc1ccc(cc1)C(=O)O/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B14	compound treatment	1.169	0.00297	0.04	1.258	-0.0423	-0.58	-0.3792	-0.6563	1651941	Bionet1_002352	CCOC(=O)c1cc(C#N)c(Oc2ccc(Cl)cc2C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B15	compound treatment	1.179	0.013	0.17	1.247	-0.0533	-0.73	-0.3899	-0.5218	1909384	Bionet1_002353	Cc1ccc(cc1)C(=O)O/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B16	compound treatment	1.171	0.00497	0.07	1.341	0.0407	0.56	0.4402	0.7868	1227034	Bionet1_002354	O=S(=O)(Cc1cc(nc(n1)c2ccncc2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B17	compound treatment	1.18	0.014	0.19	1.277	-0.0233	-0.32	-0.0911	-0.2468	1909385	Bionet1_002355	Clc1ccc(cc1)C(=O)O/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B18	compound treatment	1.156	-0.01	-0.14	1.244	-0.0563	-0.77	-0.6382	-0.8191	1458986	Bionet1_002356	O=S(Cc1cc(nc(n1)c2ccccc2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B19	compound treatment	1.159	-0.00703	-0.09	1.316	0.0157	0.21	0.0847	0.3609	1909386	Bionet1_002357	Clc1ccccc1C(=O)O/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B20	compound treatment	1.154	-0.012	-0.16	1.292	-0.00827	-0.11	-0.1944	-0.9842	1718922	Bionet1_002358	CCOC(=O)c1cc(C#N)c(NCc2ccccc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B21	compound treatment	1.157	-0.00903	-0.12	1.318	0.0177	0.24	0.0849	0.3135	1909387	Bionet1_002359	Cc1ccccc1C(=O)O/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	B22	compound treatment	1.156	-0.01	-0.14	1.279	-0.0213	-0.29	-0.3007	-0.9397	1175752	Bionet1_002360	CCOC(=O)c1cc(C#N)c(nc1c2ccccc2)N(C)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C03	compound treatment	1.186	0.02	0.27	1.279	-0.0213	-0.29	-0.0145	-0.0367	1909388	Bionet1_002361	[O-][N+](=O)CCc1ccccc1NC(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C04	compound treatment	1.211	0.045	0.61	1.307	0.00673	0.09	0.4939	0.805	1909389	Bionet1_002362	FC(F)(F)c1cccc(Sc2nnc(cc2C#N)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C05	compound treatment	1.177	0.011	0.15	1.295	-0.00527	-0.07	0.0539	0.3275	1909390	Bionet1_002363	CCOc1ccccc1N2CCN(CC2)c3cc(Cl)nc(SC)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C06	compound treatment	1.18	0.014	0.19	1.294	-0.00627	-0.09	0.0729	0.352	1909391	Bionet1_002364	Cc1ccc(cc1)c2nc(C)ncc2N=Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C07	compound treatment	1.17	0.00397	0.05	1.347	0.0467	0.64	0.4885	0.7639	1909392	Bionet1_002365	CSc1nc(Cl)cc(n1)N2CCN(CC2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C08	compound treatment	1.207	0.041	0.55	1.343	0.0427	0.58	0.8029	0.9997	1909393	Bionet1_002366	COc1ccc(N=Nc2cnc(nc2c3ccc(OC)cc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C09	compound treatment	1.11	-0.056	-0.76	1.283	-0.0173	-0.24	-0.701	-0.8854	1413630	Bionet1_002367	Cc1cc(nc(SCc2ccc(Cl)cc2Cl)n1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C10	compound treatment	1.158	-0.00803	-0.11	1.315	0.0147	0.2	0.0655	0.2869	1909394	Bionet1_002368	COc1ccc(N=Nc2cnc(nc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C11	compound treatment	1.145	-0.021	-0.28	1.312	0.0117	0.16	-0.0875	-0.2685	1909395	Bionet1_002369	Clc1ccc(CSCc2cc(Cl)nc(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C12	compound treatment	1.215	0.049	0.66	1.335	0.0347	0.47	0.8021	0.9867	1909396	Bionet1_002370	COc1ccc(N=Nc2cnc(nc2c3ccccc3)c4ccncc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C13	compound treatment	1.235	0.069	0.93	1.258	-0.0423	-0.58	0.2504	0.2288	1909397	Bionet1_002371	Cc1nc(CSc2ccc(Cl)cc2)cc(OCc3cccc(Cl)c3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C14	compound treatment	1.198	0.032	0.43	1.351	0.0507	0.69	0.7942	0.9741	1909398	Bionet1_002372	Cc1cccc(N=Nc2cnc(nc2c3cccs3)c4ccncc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C15	compound treatment	1.185	0.019	0.26	1.262	-0.0383	-0.52	-0.188	-0.3235	1909399	Bionet1_002373	Cc1nc(CS(=O)(=O)c2ccccc2)cc(Sc3ccc(Cl)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C16	compound treatment	1.2	0.034	0.46	1.29	-0.0103	-0.14	0.2251	0.4697	1909400	Bionet1_002374	Cc1cccc(N=Nc2cnc(nc2c3cccs3)c4ccccn4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C17	compound treatment	1.15	-0.016	-0.22	1.283	-0.0173	-0.24	-0.3194	-0.9991	1909401	Bionet1_002375	Cc1ccc(Sc2cc(CS(=O)(=O)c3ccccc3)nc(C)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C18	compound treatment	1.165	-0.00103	-0.01	1.351	0.0507	0.69	0.4794	0.6928	1909402	Bionet1_002376	Clc1ccc(N=Nc2cnc(nc2c3cccs3)c4cccnc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C19	compound treatment	1.18	0.014	0.19	1.307	0.00673	0.09	0.1982	0.9454	1909403	Bionet1_002377	Cc1nc(CS(=O)(=O)c2ccccc2)cc(Sc3ccccc3Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C20	compound treatment	1.169	0.00297	0.04	1.29	-0.0103	-0.14	-0.0706	-0.4851	1552166	Bionet1_002378	CCOC(=O)c1cc(nnc1Sc2ccc(F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C21	compound treatment	1.208	0.042	0.57	1.303	0.00273	0.04	0.4267	0.752	1909404	Bionet1_002379	COc1ccc(Sc2cc(CS(=O)(=O)c3ccccc3)nc(C)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	C22	compound treatment	1.19	0.024	0.32	1.326	0.0257	0.35	0.4768	0.9992	1909405	Bionet1_002380	COc1ccc(cc1)c2nc(ncc2N=Nc3ccc(F)cc3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D03	compound treatment	1.16	-0.00603	-0.08	1.326	0.0257	0.35	0.1906	0.5292	1909406	Bionet1_002381	Clc1ccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D04	compound treatment	1.176	0.00997	0.13	1.31	0.00973	0.13	0.189	1.0	1591763	Bionet1_002382	CCOC(=O)c1cc(C#N)c(NCc2ccc(Cl)cc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D05	compound treatment	1.166	-2.82E-5	0.0	1.358	0.0577	0.79	0.5564	0.7068	1909407	Bionet1_002383	Fc1cccc(Cl)c1CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D06	compound treatment	1.132	-0.034	-0.46	1.277	-0.0233	-0.32	-0.549	-0.9837	1232522	Bionet1_002384	CCOC(=O)c1cc(C#N)c(NCc2ccccc2OC)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D07	compound treatment	1.199	0.033	0.44	1.267	-0.0333	-0.45	-0.0062	-0.0098	1909408	Bionet1_002385	CC(C)(C)c1ccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D08	compound treatment	1.129	-0.037	-0.5	1.259	-0.0413	-0.56	-0.7511	-0.9982	1313129	Bionet1_002386	CCOC(=O)c1cc(C#N)c(NCc2cccc(Cl)c2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D09	compound treatment	1.177	0.011	0.15	1.329	0.0287	0.39	0.3817	0.9114	1909409	Bionet1_002387	FC(F)(F)c1cccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D10	compound treatment	1.132	-0.034	-0.46	1.284	-0.0163	-0.22	-0.4815	-0.9443	1456466	Bionet1_002388	CCOC(=O)c1cc(C#N)c(NCc2ccc(C)cc2)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D11	compound treatment	1.15	-0.016	-0.22	1.29	-0.0103	-0.14	-0.2519	-0.9779	1909410	Bionet1_002389	Clc1cccc(Cl)c1CO/N=C\2/C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D12	compound treatment	1.138	-0.028	-0.38	1.28	-0.0203	-0.28	-0.4628	-0.9881	1909411	Bionet1_002390	FC(F)(F)c1cc(Nc2nnnc3ccccc23)cc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D13	compound treatment	1.195	0.029	0.39	1.29	-0.0103	-0.14	0.1774	0.4272	1909412	Bionet1_002391	On1c(nc2ccc(Br)cc2c1=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D14	compound treatment	1.166	-2.82E-5	0.0	1.243	-0.0573	-0.78	-0.5525	-0.7075	1909413	Bionet1_002392	O=S(Cc1cc(Oc2ccccc2)nc(n1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D15	compound treatment	1.111	-0.055	-0.74	1.309	0.00873	0.12	-0.4407	-0.5862	1240287	Bionet1_002393	On1c(nc2ccc(Br)cc2c1=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D16	compound treatment	1.206	0.04	0.54	1.273	-0.0273	-0.37	0.1184	0.1807	1909414	Bionet1_002394	[O-][N+](=O)c1ccc(Oc2nc(nc3ccccc23)C(F)(F)F)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D17	compound treatment	1.224	0.058	0.78	1.291	-0.00927	-0.13	0.4637	0.5853	1734265	Bionet1_002395	On1c(nc2ccc(Br)cc2c1=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D18	compound treatment	1.168	0.00197	0.03	1.301	7.34E-4	0.01	0.0259	0.9107	1909415	Bionet1_002396	FC(F)(F)c1nc(N/N=C/c2ccc(Cl)cc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D19	compound treatment	1.193	0.027	0.36	1.348	0.0477	0.65	0.7176	0.9622	1312519	Bionet1_002397	On1c(nc2ccc(Br)cc2c1=O)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D20	compound treatment	1.168	0.00197	0.03	1.281	-0.0193	-0.26	-0.167	-0.6323	1909416	Bionet1_002398	[O-][N+](=O)c1cccc(/C=N/Nc2nc(nc3ccccc23)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D21	compound treatment	1.157	-0.00903	-0.12	1.293	-0.00727	-0.1	-0.1562	-0.9948	1719573	Bionet1_002399	On1c(nc2ccc(Br)cc2c1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	D22	compound treatment	1.121	-0.045	-0.61	1.284	-0.0163	-0.22	-0.5864	-0.9067	1909417	Bionet1_002400	[O-][N+](=O)c1cccc(c1)c2nnc3c4ccccc4nc(n23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E03	compound treatment	1.142	-0.024	-0.32	1.298	-0.00227	-0.03	-0.2511	-0.771	1183316	Bionet1_002401	Cc1nc(CS(=O)(=O)c2ccc(Cl)cc2)cc(n1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E04	compound treatment	1.168	0.00197	0.03	1.302	0.00173	0.02	0.0355	0.9983	1909418	Bionet1_002402	Cc1ccc(cc1)c2nc(N)ncc2N=Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E05	compound treatment	1.156	-0.01	-0.14	1.291	-0.00927	-0.13	-0.185	-0.9994	1909419	Bionet1_002403	COc1cc(c(Cl)cc1Cl)n2nnnc2c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E06	compound treatment	1.191	0.025	0.34	1.273	-0.0273	-0.37	-0.0247	-0.0492	1909420	Bionet1_002404	Cc1nn(nc1C(=O)Nc2ccc(Br)cc2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E07	compound treatment	1.132	-0.034	-0.46	1.322	0.0217	0.3	-0.115	-0.2105	1909421	Bionet1_002405	COc1cc(NC(=O)c2cccc(c2)C(F)(F)F)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E08	compound treatment	1.201	0.035	0.47	1.323	0.0227	0.31	0.5528	0.9793	1658815	Bionet1_002406	Cc1snc2sc(C(=O)c3ccc(Br)cc3)c(N)c12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E09	compound treatment	1.095	-0.071	-0.96	1.302	0.00173	0.02	-0.6608	-0.6895	1727351	Bionet1_002407	CC(C)Oc1cc(NC(=O)c2ccc(Cl)c(Cl)c2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E10	compound treatment	1.219	0.053	0.71	1.326	0.0257	0.35	0.7534	0.9464	1250104	Bionet1_002408	Cc1cc(C)n(Cc2ccccc2)c(=O)c1S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E11	compound treatment	1.152	-0.014	-0.19	1.309	0.00873	0.12	-0.0496	-0.2219	1909422	Bionet1_002409	COc1cc(c(Cl)cc1Cl)n2nnnc2c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E12	compound treatment	1.159	-0.00703	-0.09	1.34	0.0397	0.54	0.3161	0.5746	1649533	Bionet1_002410	Cc1cc(C)n(Cc2ccc(Cl)cc2)c(=O)c1S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E13	compound treatment	1.161	-0.00503	-0.07	1.272	-0.0283	-0.39	-0.3205	-0.819	1909423	Bionet1_002411	COc1cc(c(Cl)cc1Cl)n2nnnc2c3c(F)cccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E14	compound treatment	1.149	-0.017	-0.23	1.299	-0.00127	-0.02	-0.1746	-0.7581	1163023	Bionet1_002412	Cc1cc(C)c(c(SCc2ccccc2)n1)S(=O)(=O)c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E15	compound treatment	1.213	0.047	0.63	1.309	0.00873	0.12	0.5323	0.8255	1909424	Bionet1_002413	COCCOc1cc(NC(=O)c2ccccc2Cl)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E16	compound treatment	1.179	0.013	0.17	1.273	-0.0273	-0.37	-0.1392	-0.3387	1909425	Bionet1_002414	CCCCSc1nc(C)cc(C)c1S(=O)(=O)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E17	compound treatment	1.184	0.018	0.24	1.361	0.0607	0.83	0.7571	0.8773	1909426	Bionet1_002415	COCCOc1cc(NC(=O)c2cccc(OC)c2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E18	compound treatment	1.154	-0.012	-0.16	1.364	0.0637	0.87	0.4998	0.5653	1562043	Bionet1_002416	Cc1cc([nH]c(=O)c1S(=O)(=O)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E19	compound treatment	1.201	0.035	0.47	1.341	0.0407	0.56	0.7264	0.9967	1133687	Bionet1_002417	CCOC(=O)COc1cc(NC(=O)c2ccc(OC)cc2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E20	compound treatment	1.205	0.039	0.53	1.35	0.0497	0.68	0.8513	0.9921	1280487	Bionet1_002418	CC(C)CSc1nc(C)cc(C)c1S(=O)(=O)c2ccccc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E21	compound treatment	1.204	0.038	0.51	1.33	0.0297	0.41	0.6489	0.9933	1909427	Bionet1_002419	CC(C)Oc1cc(c(Cl)cc1Cl)n2nnnc2c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	E22	compound treatment	1.215	0.049	0.66	1.307	0.00673	0.09	0.5321	0.7977	1145208	Bionet1_002420	Cc1cc(C)c(c(Oc2ccccc2)n1)S(=O)(=O)c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F03	compound treatment	1.162	-0.00403	-0.05	1.281	-0.0193	-0.26	-0.2242	-0.8357	1710801	Bionet1_002421	CCOC(=O)COc1cc(N2C(=O)CSCC2=O)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F04	compound treatment	1.132	-0.034	-0.46	1.26	-0.0403	-0.55	-0.7129	-0.996	1909428	Bionet1_002422	COc1ccc(cc1)C(=O)NN(C)c2nc(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F05	compound treatment	1.188	0.022	0.3	1.309	0.00873	0.12	0.2938	0.9197	1335341	Bionet1_002423	Clc1cc(Cl)c(cc1OCc2ccccc2)N3C(=O)CSCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F06	compound treatment	1.155	-0.011	-0.15	1.259	-0.0413	-0.56	-0.5031	-0.8644	1909429	Bionet1_002424	FC(F)(F)c1nc(NNC(=O)c2ccc(Cl)cc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F07	compound treatment	1.155	-0.011	-0.15	1.286	-0.0143	-0.19	-0.2428	-0.9912	1909430	Bionet1_002425	COCCOc1cc(N2C(=O)CSCC2=O)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F08	compound treatment	1.14	-0.026	-0.35	1.323	0.0227	0.31	-0.0291	-0.0621	1909431	Bionet1_002426	CN(NC(=O)c1ccccc1F)c2nc(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F09	compound treatment	1.118	-0.048	-0.65	1.296	-0.00427	-0.06	-0.4993	-0.7675	1909432	Bionet1_002427	Clc1ccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F10	compound treatment	1.158	-0.00803	-0.11	1.267	-0.0333	-0.45	-0.3974	-0.852	1460281	Bionet1_002428	O=S(=O)(N1CCN(CC1)c2ccccn2)c3ccc(s3)c4csnn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F11	compound treatment	1.169	0.00297	0.04	1.27	-0.0303	-0.41	-0.2635	-0.6354	1909433	Bionet1_002429	COc1ccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F12	compound treatment	1.166	-2.82E-5	0.0	1.236	-0.0643	-0.88	-0.62	-0.7074	1909434	Bionet1_002430	COc1ccc(OS(=O)(=O)c2ccc(s2)c3csnn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F13	compound treatment	1.22	0.054	0.73	1.28	-0.0203	-0.28	0.3194	0.4102	1909435	Bionet1_002431	Clc1cccc(CO/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F14	compound treatment	1.162	-0.00403	-0.05	1.267	-0.0333	-0.45	-0.3592	-0.7862	1909436	Bionet1_002432	CC(C)(C)c1ccc(OS(=O)(=O)c2ccc(s2)c3csnn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F15	compound treatment	1.158	-0.00803	-0.11	1.313	0.0127	0.17	0.0462	0.2257	1909437	Bionet1_002433	COc1ccnc(Oc2ccc(F)cc2)c1C(=O)N/C=N/OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F16	compound treatment	1.178	0.012	0.16	1.264	-0.0363	-0.49	-0.2355	-0.4527	1909438	Bionet1_002434	Clc1ccc(OS(=O)(=O)c2ccc(s2)c3csnn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F17	compound treatment	1.178	0.012	0.16	1.317	0.0167	0.23	0.2756	0.9857	1166185	Bionet1_002435	COc1ccnc(Nc2ccc(I)cc2)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F18	compound treatment	1.145	-0.021	-0.28	1.239	-0.0613	-0.84	-0.7914	-0.8969	1909439	Bionet1_002436	Cc1cc(C)cc(OS(=O)(=O)c2ccc(s2)c3csnn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F19	compound treatment	1.137	-0.029	-0.39	1.257	-0.0433	-0.59	-0.6941	-0.9802	1737568	Bionet1_002437	COc1ccnc(N2CCN(CC2)C(c3ccccc3)c4ccccc4)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F20	compound treatment	1.204	0.038	0.51	1.3	-2.66E-4	0.0	0.3597	0.7021	1909440	Bionet1_002438	CC(=O)Nc1cccc(OS(=O)(=O)c2ccc(s2)c3csnn3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F21	compound treatment	1.147	-0.019	-0.26	1.348	0.0477	0.65	0.2788	0.3984	1909441	Bionet1_002439	COc1ccnc(N/C=N/OCc2cccc(c2)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	F22	compound treatment	1.117	-0.049	-0.66	1.299	-0.00127	-0.02	-0.4799	-0.7253	1909442	Bionet1_002440	NC(=O)C(c1ccc(Cl)cc1)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G03	compound treatment	1.161	-0.00503	-0.07	1.282	-0.0183	-0.25	-0.2241	-0.8681	1909443	Bionet1_002441	COCCOc1cc(c(Cl)cc1Cl)n2nnnc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G04	compound treatment	1.186	0.02	0.27	1.324	0.0237	0.32	0.4194	0.9958	1433540	Bionet1_002442	Cc1cc(C)c(c(NCc2ccccc2)n1)S(=O)(=O)c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G05	compound treatment	1.174	0.00797	0.11	1.272	-0.0283	-0.39	-0.1965	-0.4911	1909444	Bionet1_002443	COCCOc1cc(c(Cl)cc1Cl)n2nnnc2c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G06	compound treatment	1.209	0.043	0.58	1.323	0.0227	0.31	0.6291	0.957	1274557	Bionet1_002444	Cc1ccccc1S(=O)(=O)c2c(C)c(c(C)nc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G07	compound treatment	1.154	-0.012	-0.16	1.333	0.0327	0.45	0.2009	0.423	1909445	Bionet1_002445	COCCOc1cc(c(Cl)cc1Cl)n2nnnc2c3cccc(OC)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G08	compound treatment	1.149	-0.017	-0.23	1.275	-0.0253	-0.34	-0.4061	-0.9806	1332850	Bionet1_002446	Cc1cc(C)c(c(OCCN2CCOCC2)n1)S(=O)(=O)c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G09	compound treatment	1.15	-0.016	-0.22	1.33	0.0297	0.41	0.1338	0.2912	1171195	Bionet1_002447	COc1cc(c(Cl)cc1Cl)n2c(S)nc3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G10	compound treatment	1.172	0.00597	0.08	1.299	-0.00127	-0.02	0.0448	0.5432	1909446	Bionet1_002448	COc1cccc(c1)C(=O)O/N=C/c2ccc(Sc3ccc(C)cc3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G11	compound treatment	1.149	-0.017	-0.23	1.305	0.00473	0.06	-0.1168	-0.4895	1169258	Bionet1_002449	COc1cc(c(Cl)cc1Cl)n2c(SC)nc3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G12	compound treatment	1.207	0.041	0.55	1.335	0.0347	0.47	0.7258	0.997	1909447	Bionet1_002450	Cc1ccc(Oc2ccc(/C=N/OCc3ccc(Cl)cc3Cl)cn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G13	compound treatment	1.201	0.035	0.47	1.32	0.0197	0.27	0.5239	0.9646	1514662	Bionet1_002451	COc1cc(c(Cl)cc1Cl)n2c(SCC=C)nc3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G14	compound treatment	1.236	0.07	0.94	1.302	0.00173	0.02	0.6842	0.7246	1909448	Bionet1_002452	Fc1ccc(CO/N=C/c2ccc(Sc3ccc(Cl)cc3)nc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G15	compound treatment	1.194	0.028	0.38	1.269	-0.0313	-0.43	-0.0347	-0.0609	1909449	Bionet1_002453	COc1cc(NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G16	compound treatment	1.199	0.033	0.44	1.298	-0.00227	-0.03	0.2927	0.6564	1909450	Bionet1_002454	COc1ccc(cc1)C(=O)O/N=C/c2ccc(Sc3ccc(Cl)cc3)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G17	compound treatment	1.19	0.024	0.32	1.326	0.0257	0.35	0.4768	0.9992	1909451	Bionet1_002455	COc1cc(NS(=O)(=O)c2ccc(F)cc2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G18	compound treatment	1.177	0.011	0.15	1.296	-0.00427	-0.06	0.0635	0.3994	1909452	Bionet1_002456	Cc1ccc(Sc2ccc(/C=N/OC(=O)c3ccccc3Cl)cn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G19	compound treatment	1.182	0.016	0.22	1.309	0.00873	0.12	0.2366	0.9609	1215028	Bionet1_002457	CC(C)Oc1cc(NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G20	compound treatment	1.191	0.025	0.34	1.304	0.00373	0.05	0.2742	0.8048	1909453	Bionet1_002458	CC(C)CC(=O)O/N=C/c1ccc(nc1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G21	compound treatment	1.199	0.033	0.44	1.338	0.0377	0.51	0.6784	0.9974	1909454	Bionet1_002459	Clc1ccc(CSCc2cc(nc(n2)c3ccccc3)N4CCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	G22	compound treatment	1.187	0.021	0.28	1.382	0.0817	1.11	0.9882	0.8593	1909455	Bionet1_002460	CSc1ccccc1c2nnc(SCc3ccc(Cl)cc3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H03	compound treatment	1.141	-0.025	-0.34	1.287	-0.0133	-0.18	-0.3667	-0.9572	1909456	Bionet1_002461	COc1ccnc(N/C=N/OCCOc2cccc(c2)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H04	compound treatment	1.074	-0.092	-1.24	1.25	-0.0503	-0.69	-1.3626	-0.9608	1909457	Bionet1_002462	CCn1ncc(NCCNc2ncc(cc2Cl)C(F)(F)F)c(Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H05	compound treatment	1.183	0.017	0.23	1.346	0.0457	0.62	0.6029	0.9075	1469928	Bionet1_002463	COc1ccnc(Oc2ccc(cc2)S(=O)(=O)N3CCOCC3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H06	compound treatment	1.112	-0.054	-0.73	1.269	-0.0313	-0.43	-0.8169	-0.9674	1183788	Bionet1_002464	COc1ccc(cc1)n2ncc(ON3C(=O)CCC3=O)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H07	compound treatment	1.174	0.00797	0.11	1.294	-0.00627	-0.09	0.0156	0.1137	1909458	Bionet1_002465	COc1ccnc(N/C=N/OCc2cccc(Cl)c2Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H08	compound treatment	1.167	9.72E-4	0.01	1.286	-0.0143	-0.19	-0.1283	-0.658	1543954	Bionet1_002466	COc1ccc(cc1)n2ncc(N(C)CCOC(=O)C3CC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H09	compound treatment	1.173	0.00697	0.09	1.29	-0.0103	-0.14	-0.0325	-0.1926	1909459	Bionet1_002467	COc1ccnc(N2CCN(CC2)c3cccc(c3)C(F)(F)F)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H10	compound treatment	1.147	-0.019	-0.26	1.293	-0.00727	-0.1	-0.2516	-0.9143	1601814	Bionet1_002468	COc1ccc(cc1)n2ncc(NCCc3ccccn3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H11	compound treatment	1.153	-0.013	-0.18	1.333	0.0327	0.45	0.1913	0.3989	1330160	Bionet1_002469	COc1ccnc(Oc2ccc(cc2)S(=O)(=O)NC(C)(C)C)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H12	compound treatment	1.143	-0.023	-0.31	1.326	0.0257	0.35	0.0285	0.0607	1909460	Bionet1_002470	CN(CCO)c1cnn(c2ncc(cc2Cl)C(F)(F)F)c(=O)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H13	compound treatment	1.154	-0.012	-0.16	1.333	0.0327	0.45	0.2009	0.423	1909461	Bionet1_002471	COc1ccnc(c1C#N)n2cccc2/C=N/OCc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H14	compound treatment	1.148	-0.018	-0.24	1.33	0.0297	0.41	0.1147	0.2426	1909462	Bionet1_002472	FC(F)(F)c1cnc(c(Cl)c1)n2ncc(N3CCNCC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H15	compound treatment	1.189	0.023	0.31	1.345	0.0447	0.61	0.6505	0.9507	1909463	Bionet1_002473	COc1cccc(CO/N=C/c2cccn2c3nccc(OC)c3C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H16	compound treatment	1.119	-0.047	-0.63	1.308	0.00773	0.11	-0.374	-0.5816	1909464	Bionet1_002474	FC(F)(F)c1cnc(c(Cl)c1)n2nccc2c3sccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H17	compound treatment	1.159	-0.00703	-0.09	1.304	0.00373	0.05	-0.031	-0.2885	1909465	Bionet1_002475	COc1ccnc(c1C#N)n2cccc2/C=N/OCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H18	compound treatment	1.156	-0.01	-0.14	1.294	-0.00627	-0.09	-0.1561	-0.9754	1401731	Bionet1_002476	Clc1ccc(c(Cl)c1)n2ncc(N3CCC(=O)CC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H19	compound treatment	1.192	0.026	0.35	1.302	0.00173	0.02	0.2645	0.7531	1909466	Bionet1_002477	COc1ccnc(c1C#N)n2cccc2/C=N/OCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H20	compound treatment	1.155	-0.011	-0.15	1.255	-0.0453	-0.62	-0.5417	-0.8531	1238514	Bionet1_002478	COc1ccc(cc1)n2ncc(N3CCC(CC3)C(=O)N)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H21	compound treatment	1.196	0.03	0.4	1.349	0.0487	0.66	0.7558	0.9716	1909467	Bionet1_002479	CO/N=C/NC(=O)c1c(OC)ccnc1Oc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	H22	compound treatment	1.114	-0.052	-0.7	1.324	0.0237	0.32	-0.2675	-0.346	1909468	Bionet1_002480	FC(F)(F)c1cnc(c(Cl)c1)n2ncc(N3CCOCC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I03	compound treatment	1.149	-0.017	-0.23	1.356	0.0557	0.76	0.375	0.4723	1909469	Bionet1_002481	CN(C)c1cc(CSCc2ccc(Cl)cc2)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I04	compound treatment	1.145	-0.021	-0.28	1.294	-0.00627	-0.09	-0.261	-0.881	1471760	Bionet1_002482	CS(=O)c1ccccc1COC(=O)Nc2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I05	compound treatment	1.158	-0.00803	-0.11	1.326	0.0257	0.35	0.1715	0.4671	1296388	Bionet1_002483	Sc1nccn1c2cc(OCc3ccccc3)c(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I06	compound treatment	1.214	0.048	0.65	1.313	0.0127	0.17	0.5804	0.8662	1909470	Bionet1_002484	CS(=O)(=O)c1ccccc1COC(=O)Nc2cc(Cl)cc(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I07	compound treatment	1.128	-0.038	-0.51	1.296	-0.00427	-0.06	-0.4039	-0.7823	1490195	Bionet1_002485	COc1cc(c(Cl)cc1Cl)n2ccnc2SCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I08	compound treatment	1.164	-0.00203	-0.03	1.322	0.0217	0.3	0.1902	0.6391	1909471	Bionet1_002486	CSc1ccccc1c2nnc(SCc3ccc(Cl)c(Cl)c3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I09	compound treatment	1.111	-0.055	-0.74	1.308	0.00773	0.11	-0.4504	-0.6006	1705425	Bionet1_002487	CSc1nccn1c2cc(OCc3ccccc3)c(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I10	compound treatment	1.156	-0.01	-0.14	1.328	0.0277	0.38	0.1718	0.4276	1909472	Bionet1_002488	CSc1ccccc1c2nnc(SCc3ccc(cc3)C(C)(C)C)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I11	compound treatment	1.173	0.00697	0.09	1.339	0.0387	0.53	0.44	0.8201	1909473	Bionet1_002489	COCCOc1cc(NS(=O)(=O)c2ccccc2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I12	compound treatment	1.149	-0.017	-0.23	1.329	0.0287	0.39	0.1146	0.2524	1909474	Bionet1_002490	FC(F)(F)c1cccc(NC(=O)NNC(=O)C2Cc3cncn3C(=O)N2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I13	compound treatment	1.207	0.041	0.55	1.259	-0.0413	-0.56	-0.0071	-0.009	1209136	Bionet1_002491	CS(=O)(=O)Cc1cc(NCc2ccccc2)nc(n1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I14	compound treatment	1.174	0.00797	0.11	1.298	-0.00227	-0.03	0.0542	0.4843	1669035	Bionet1_002492	CCOC(=O)Cc1ncccc1C(=O)Nc2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I15	compound treatment	1.156	-0.01	-0.14	1.327	0.0267	0.36	0.1621	0.4169	1909475	Bionet1_002493	CS(=O)(=O)Cc1cc(Sc2ccccc2)nc(n1)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I16	compound treatment	1.166	-2.82E-5	0.0	1.336	0.0357	0.49	0.3443	0.7066	1909476	Bionet1_002494	CCOC(=O)Cc1ncccc1C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I17	compound treatment	1.197	0.031	0.42	1.309	0.00873	0.12	0.3797	0.8739	1909477	Bionet1_002495	CSCc1cc(Sc2ccc(Cl)cc2)nc(n1)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I18	compound treatment	1.21	0.044	0.59	1.268	-0.0323	-0.44	0.1083	0.1467	1909478	Bionet1_002496	CCOC(=O)Cc1ncccc1C(=O)Nc2ccc(OC(F)(F)F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I19	compound treatment	1.182	0.016	0.22	1.356	0.0557	0.76	0.6898	0.8732	1909479	Bionet1_002497	COc1cc(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I20	compound treatment	1.209	0.043	0.58	1.354	0.0537	0.73	0.928	0.9933	1722980	Bionet1_002498	COc1ccc(NC(=O)CC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I21	compound treatment	1.196	0.03	0.4	1.369	0.0687	0.94	0.9487	0.9294	1909480	Bionet1_002499	CN(NC(=O)Nc1ccc(Cl)cc1)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	I22	compound treatment	1.182	0.016	0.22	1.361	0.0607	0.83	0.738	0.8624	1466830	Bionet1_002500	Clc1ccc(NC(=O)CC(=O)Nc2ccc(Cl)c(Cl)c2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J03	compound treatment	1.184	0.018	0.24	1.345	0.0447	0.61	0.6028	0.9183	1909481	Bionet1_002501	COc1ccnc(Oc2ccccc2)c1C(=O)N/C=N/OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J04	compound treatment	1.162	-0.00403	-0.05	1.263	-0.0373	-0.51	-0.3978	-0.7783	1909482	Bionet1_002502	CN1C(=O)N(C)C(=O)C(=Cc2c(C)nn(c2OCC=C)c3ccccc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J05	compound treatment	1.156	-0.01	-0.14	1.32	0.0197	0.27	0.0946	0.3141	1909483	Bionet1_002503	COc1ccnc(Oc2ccccc2)c1C(=O)N/C=N/OCc3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J06	compound treatment	1.118	-0.048	-0.65	1.257	-0.0433	-0.59	-0.8753	-0.9989	1327076	Bionet1_002504	COc1ccc(cc1)N2CCN(CC2)c3cc(O)n(C4CCCCC4)c(=O)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J07	compound treatment	1.162	-0.00403	-0.05	1.281	-0.0193	-0.26	-0.2242	-0.8357	1909484	Bionet1_002505	COc1ccc(cc1)N2C(=O)/C(=C/c3ccc(cc3)C(C)C)/NC2=S
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J08	compound treatment	1.155	-0.011	-0.15	1.294	-0.00627	-0.09	-0.1656	-0.9653	1653614	Bionet1_002506	Oc1cc(nc(=O)n1C2CCCCC2)N3CCN(CC3)c4cccc(Cl)n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J09	compound treatment	1.17	0.00397	0.05	1.284	-0.0163	-0.22	-0.119	-0.5213	1909485	Bionet1_002507	CCOC(=O)CNC(=S)NNc1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J10	compound treatment	1.129	-0.037	-0.5	1.255	-0.0453	-0.62	-0.7897	-0.9945	1909486	Bionet1_002508	Clc1ccsc1C(=O)c2conc2c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J11	compound treatment	1.183	0.017	0.23	1.326	0.0257	0.35	0.41	0.9786	1909487	Bionet1_002509	FC(F)(F)c1nc2ccccc2nc1SCC(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J12	compound treatment	1.161	-0.00503	-0.07	1.265	-0.0353	-0.48	-0.388	-0.7989	1909488	Bionet1_002510	Clc1ccc(/C=C/C(=O)c2sccc2Br)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J13	compound treatment	1.163	-0.00303	-0.04	1.322	0.0217	0.3	0.1807	0.6039	1909489	Bionet1_002511	FC(F)(F)c1ccc(N/C=C(\C=C\C#N)/S(=O)(=O)c2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J14	compound treatment	1.205	0.039	0.53	1.243	-0.0573	-0.78	-0.1804	-0.1917	1909490	Bionet1_002512	CS(=O)c1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J15	compound treatment	1.162	-0.00403	-0.05	1.3	-2.66E-4	0.0	-0.041	-0.7527	1909491	Bionet1_002513	COC(=O)/C=C/C(=C\Nc1ccc(OC)cc1)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J16	compound treatment	1.152	-0.014	-0.19	1.258	-0.0423	-0.58	-0.5414	-0.8924	1624052	Bionet1_002514	CSc1ccc(NC(=O)c2ccccc2C(=O)c3ccc(F)cc3)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J17	compound treatment	1.203	0.037	0.5	1.314	0.0137	0.19	0.4851	0.9105	1909492	Bionet1_002515	COC(=O)c1ccccc1N/C=C/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J18	compound treatment	1.141	-0.025	-0.34	1.277	-0.0233	-0.32	-0.4631	-0.9995	1656894	Bionet1_002516	CS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J19	compound treatment	1.222	0.056	0.76	1.315	0.0147	0.2	0.676	0.8651	1909493	Bionet1_002517	COC(=O)/C=C/C(=C\Nc1ccc(F)cc1)/S(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J20	compound treatment	1.153	-0.013	-0.18	1.269	-0.0313	-0.43	-0.4258	-0.9232	1559389	Bionet1_002518	CS(=O)(=O)c1ccc(NC(=O)c2cc(F)c(F)cc2Cl)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J21	compound treatment	1.193	0.027	0.36	1.383	0.0827	1.13	1.055	0.89	1909494	Bionet1_002519	Cc1cc(C)c(CSC(C)(C)CNC(=O)c2cccc(c2)[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	J22	compound treatment	1.14	-0.026	-0.35	1.273	-0.0273	-0.37	-0.5112	-0.9996	1121925	Bionet1_002520	CS(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K03	compound treatment	1.123	-0.043	-0.58	1.286	-0.0143	-0.19	-0.548	-0.8952	1909495	Bionet1_002521	FC(F)(F)c1nc2ccccc2nc1N/N=C/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K04	compound treatment	1.131	-0.035	-0.47	1.306	0.00573	0.08	-0.2789	-0.5822	1909496	Bionet1_002522	CN(/N=C/C1CC(=O)NC(=C1C#N)C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K05	compound treatment	1.216	0.05	0.67	1.271	-0.0293	-0.4	0.1945	0.2483	1909497	Bionet1_002523	FC(F)(F)c1nc2ccccc2nc1N/N=C/c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K06	compound treatment	1.149	-0.017	-0.23	1.315	0.0147	0.2	-0.0204	-0.0667	1909498	Bionet1_002524	FC(F)(F)c1cccc(CO/N=C\2/COc3ccc4ccccc4c23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K07	compound treatment	1.081	-0.085	-1.15	1.332	0.0317	0.43	-0.5051	-0.412	1909499	Bionet1_002525	FC(F)(F)c1nc2ccccc2n3c(nnc13)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K08	compound treatment	1.176	0.00997	0.13	1.317	0.0167	0.23	0.2565	0.9682	1909500	Bionet1_002526	FC(F)(F)c1cccc(OCCO/N=C\2/COc3ccc4ccccc4c23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K09	compound treatment	1.159	-0.00703	-0.09	1.274	-0.0263	-0.36	-0.3203	-0.8645	1909501	Bionet1_002527	Cc1ccc(cc1)S(=O)(=O)NNc2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K10	compound treatment	1.163	-0.00303	-0.04	1.351	0.0507	0.69	0.4603	0.6642	1279015	Bionet1_002528	Clc1ccc(cc1Cl)c2cnc3c(NC(=O)c4cccs4)cccn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K11	compound treatment	1.174	0.00797	0.11	1.321	0.0207	0.28	0.276	0.9123	1909502	Bionet1_002529	CN(NC(=O)c1ccccc1C)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K12	compound treatment	1.18	0.014	0.19	1.291	-0.00927	-0.13	0.0439	0.1936	1909503	Bionet1_002530	FC(F)(F)c1cccc(N/C=C/2\Oc3ccc4ccccc4c3C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K13	compound treatment	1.121	-0.045	-0.61	1.303	0.00273	0.04	-0.4032	-0.6625	1909504	Bionet1_002531	CN(NC(=O)c1ccc(Cl)cc1)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K14	compound treatment	1.212	0.046	0.62	1.324	0.0237	0.32	0.6674	0.954	1909505	Bionet1_002532	COC(=O)c1ccncc1C(=O)NN(C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K15	compound treatment	1.172	0.00597	0.08	1.32	0.0197	0.27	0.2472	0.8802	1909506	Bionet1_002533	FC(F)(F)c1nc2ccccc2nc1NNC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K16	compound treatment	1.213	0.047	0.63	1.328	0.0277	0.38	0.7155	0.9696	1909507	Bionet1_002534	CC1=C(CCC(=O)N1Cc2ccccc2)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K17	compound treatment	1.137	-0.029	-0.39	1.355	0.0547	0.75	0.2509	0.2976	1909508	Bionet1_002535	Cc1ccc(/C=N/Nc2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K18	compound treatment	1.196	0.03	0.4	1.322	0.0217	0.3	0.4955	0.9883	1412030	Bionet1_002536	COc1ccc(NC(=O)C2=C(C)N(Cc3ccccc3)C(=O)CC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K19	compound treatment	1.169	0.00297	0.04	1.326	0.0257	0.35	0.2765	0.7828	1909509	Bionet1_002537	FC(F)(F)c1cc(c2ccc(N/N=C/c3ccccc3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K20	compound treatment	1.182	0.016	0.22	1.347	0.0467	0.64	0.603	0.8963	1448704	Bionet1_002538	CCOC(=O)C1=C(C)N(CCN2C(=C(CCC2=O)C(=O)OCC)C)C(=O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K21	compound treatment	1.193	0.027	0.36	1.34	0.0397	0.54	0.6404	0.9812	1909510	Bionet1_002539	FC(F)(F)c1cc(c2ccc(N/N=C/c3ccco3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	K22	compound treatment	1.224	0.058	0.78	1.353	0.0527	0.72	1.0615	0.9991	1909511	Bionet1_002540	COc1ccc(cc1)C(=O)/C(=N/Nc2ccc(cc2)C(F)(F)F)/C=N/N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L03	compound treatment	1.162	-0.00403	-0.05	1.281	-0.0193	-0.26	-0.2242	-0.8357	1909512	Bionet1_002541	Cc1cc(C)c(CSC(C)(C)CNc2ncccc2[N+](=O)[O-])c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L04	compound treatment	1.148	-0.018	-0.24	1.313	0.0127	0.17	-0.0492	-0.1646	1909513	Bionet1_002542	Clc1ccc(SCc2cc(nc(n2)c3ccccn3)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L05	compound treatment	1.161	-0.00503	-0.07	1.264	-0.0363	-0.49	-0.3977	-0.7966	1456431	Bionet1_002543	COc1ccc(cc1)C(=O)NCC(C)(C)SCc2c(C)cc(C)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L06	compound treatment	1.171	0.00497	0.07	1.287	-0.0133	-0.18	-0.0805	-0.4172	1909514	Bionet1_002544	Clc1ccc(SCc2cc(nc(n2)c3ccccn3)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L07	compound treatment	1.164	-0.00203	-0.03	1.262	-0.0383	-0.52	-0.3883	-0.7432	1575550	Bionet1_002545	Cc1cc(C)c(CSC(C)(C)CN2C(=O)Cc3ccccc3C2=O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L08	compound treatment	1.132	-0.034	-0.46	1.258	-0.0423	-0.58	-0.7322	-0.9936	1503571	Bionet1_002546	O=S(=O)(Cc1cc(nc(n1)c2ccccc2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L09	compound treatment	1.2	0.034	0.46	1.29	-0.0103	-0.14	0.2251	0.4697	1909515	Bionet1_002547	FC(F)(F)c1cnc(N/N=C/c2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L10	compound treatment	1.208	0.042	0.57	1.263	-0.0373	-0.51	0.041	0.0539	1373707	Bionet1_002548	O=S(=O)(Cc1cc(nc(n1)c2ccccc2)N3CCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L11	compound treatment	1.14	-0.026	-0.35	1.319	0.0187	0.26	-0.0677	-0.1558	1909516	Bionet1_002549	FC(F)(F)c1cc(Cl)c2nnc(c3ccc(Cl)cc3Cl)n2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L12	compound treatment	1.115	-0.051	-0.69	1.288	-0.0123	-0.17	-0.6051	-0.8541	1909517	Bionet1_002550	Clc1ccc(SCc2cc(nc(n2)c3ccccc3)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L13	compound treatment	1.149	-0.017	-0.23	1.333	0.0327	0.45	0.1532	0.3052	1681168	Bionet1_002551	COc1ccc(cc1)S(=O)(=O)NCC(C)(C)SCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L14	compound treatment	1.197	0.031	0.42	1.264	-0.0363	-0.49	-0.0542	-0.0838	1909518	Bionet1_002552	Clc1ccc(SCc2cc(nc(n2)c3ccccc3)N4CCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L15	compound treatment	1.123	-0.043	-0.58	1.327	0.0267	0.36	-0.1527	-0.2227	1727227	Bionet1_002553	CC(C)(CNS(=O)(=O)c1ccc(F)cc1)SCc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L16	compound treatment	1.159	-0.00703	-0.09	1.274	-0.0263	-0.36	-0.3203	-0.8645	1909519	Bionet1_002554	FC(F)(F)c1ccc(Sc2ccc(Br)cc2)c(C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L17	compound treatment	1.19	0.024	0.32	1.281	-0.0193	-0.26	0.0429	0.103	1909520	Bionet1_002555	CC(C)(CNc1ccc(cn1)[N+](=O)[O-])SCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L18	compound treatment	1.111	-0.055	-0.74	1.252	-0.0483	-0.66	-0.9903	-0.9982	1213145	Bionet1_002556	O=S(=O)(Cc1cc(nc(n1)c2cccnc2)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L19	compound treatment	1.194	0.028	0.38	1.289	-0.0113	-0.15	0.1582	0.3883	1909521	Bionet1_002557	CC(C)(CNC(=O)Nc1ccccc1)SCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L20	compound treatment	1.166	-2.82E-5	0.0	1.237	-0.0633	-0.86	-0.6103	-0.7074	1230193	Bionet1_002558	O=S(=O)(Cc1cc(nc(n1)c2cccnc2)N3CCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L21	compound treatment	1.164	-0.00203	-0.03	1.283	-0.0173	-0.24	-0.1858	-0.784	1209182	Bionet1_002559	COc1ccc(cc1)S(=O)(=O)NCC(C)(C)SCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	L22	compound treatment	1.144	-0.022	-0.3	1.286	-0.0143	-0.19	-0.3477	-0.9789	1441862	Bionet1_002560	Clc1ccc(Oc2ccc(cn2)C(=O)NC3CCSC3=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M03	compound treatment	1.178	0.012	0.16	1.32	0.0197	0.27	0.3045	0.9702	1909522	Bionet1_002561	FC(F)(F)c1cc(c2ccc(N/N=C/c3cccs3)nc2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M04	compound treatment	1.159	-0.00703	-0.09	1.339	0.0387	0.53	0.3064	0.571	1909523	Bionet1_002562	Cc1ccc(cc1)C(=O)/C(=N/Nc2cc(Cl)cc(Cl)c2)/C=N/O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M05	compound treatment	1.154	-0.012	-0.16	1.321	0.0207	0.28	0.0852	0.2613	1909524	Bionet1_002563	FC(F)(F)c1cc(c2ccc3nnc(c4cccs4)n3c2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M06	compound treatment	1.2	0.034	0.46	1.294	-0.00627	-0.09	0.2636	0.5655	1909525	Bionet1_002564	Cc1cccc(N/N=C(\C=N\N)/C(=O)c2ccc(Br)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M07	compound treatment	1.16	-0.00603	-0.08	1.281	-0.0193	-0.26	-0.2433	-0.8846	1909526	Bionet1_002565	FC(F)(F)c1ccc(/C=N/Nc2nc3ccccc3nc2C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M08	compound treatment	1.194	0.028	0.38	1.329	0.0287	0.39	0.5439	0.9998	1909527	Bionet1_002566	N/N=C/C(=N/Nc1ccc(Cl)cc1)/C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M09	compound treatment	1.162	-0.00403	-0.05	1.298	-0.00227	-0.03	-0.0603	-0.9642	1909528	Bionet1_002567	Fc1cccc(Cl)c1/C=N/Nc2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M10	compound treatment	1.161	-0.00503	-0.07	1.315	0.0147	0.2	0.0941	0.4438	1909529	Bionet1_002568	CC(=O)/C(=C/Nc1ccc(I)cc1)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M11	compound treatment	1.166	-2.82E-5	0.0	1.301	7.34E-4	0.01	0.0068	0.6797	1909530	Bionet1_002569	FC(F)(F)c1cc(c2ccc3nnc(c4ccccc4)n3c2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M12	compound treatment	1.168	0.00197	0.03	1.319	0.0187	0.26	0.1994	0.7765	1909531	Bionet1_002570	CCSc1nnc(c2cccn(Cc3ccc(Cl)cc3Cl)c2=O)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M13	compound treatment	1.182	0.016	0.22	1.296	-0.00427	-0.06	0.1112	0.4983	1909532	Bionet1_002571	FC(F)(F)c1nc2ccccc2nc1N/N=C/c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M14	compound treatment	1.17	0.00397	0.05	1.326	0.0257	0.35	0.286	0.8057	1909533	Bionet1_002572	CC(=O)/C(=C\Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)/c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M15	compound treatment	1.218	0.052	0.7	1.267	-0.0333	-0.45	0.175	0.2096	1909534	Bionet1_002573	Cc1ccc(cc1)c2nnc3ccc4c(cc(nc4n23)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M16	compound treatment	1.098	-0.068	-0.92	1.287	-0.0133	-0.18	-0.7769	-0.8305	1909535	Bionet1_002574	COc1ccc(cc1OC)/C(=C\Nc2ccc(Cl)cc2Cl)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M17	compound treatment	1.135	-0.031	-0.42	1.303	0.00273	0.04	-0.2696	-0.6416	1909536	Bionet1_002575	FC(F)(F)c1nc2ccccc2nc1N/N=C/c3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M18	compound treatment	1.208	0.042	0.57	1.338	0.0377	0.51	0.7642	0.9989	1909537	Bionet1_002576	CCOC(=O)c1ccc(N/C=C(\C(=O)C)/c2ccc(OC)c(OC)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M19	compound treatment	1.175	0.00897	0.12	1.283	-0.0173	-0.24	-0.0809	-0.3056	1909538	Bionet1_002577	FC(F)(F)c1cc(c2ccc3nnc(n4cccc4)n3c2n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M20	compound treatment	1.213	0.047	0.63	1.336	0.0357	0.49	0.7926	0.9916	1909539	Bionet1_002578	COc1ccc(cc1OC)/C(=C/Nc2ccc(Oc3ccccc3)cc2)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M21	compound treatment	1.173	0.00697	0.09	1.333	0.0327	0.45	0.3821	0.8377	1909540	Bionet1_002579	Fc1cccc(Cl)c1c2nnc3c(cc4cccnc4n23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	M22	compound treatment	1.251	0.085	1.15	1.34	0.0397	0.54	1.1937	0.9415	1909541	Bionet1_002580	COc1ccc(cc1OC)/C(=C/Nc2ccc(cc2)C(F)(F)F)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N03	compound treatment	1.146	-0.02	-0.27	1.286	-0.0143	-0.19	-0.3286	-0.987	1738874	Bionet1_002581	CC(C)(CNS(=O)(=O)c1ccc(Cl)cc1)SCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N04	compound treatment	1.117	-0.049	-0.66	1.241	-0.0593	-0.81	-1.0392	-0.9951	1909542	Bionet1_002582	CSc1nnc(C)c(/C=C/Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N05	compound treatment	1.147	-0.019	-0.26	1.264	-0.0363	-0.49	-0.5312	-0.9534	1909543	Bionet1_002583	FC(F)(F)c1cnc(N/N=C/C(=O)c2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N06	compound treatment	1.127	-0.039	-0.53	1.295	-0.00527	-0.07	-0.4231	-0.7962	1909544	Bionet1_002584	Cc1nnc(SCC=C)nc1/C=C/Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N07	compound treatment	1.146	-0.02	-0.27	1.265	-0.0353	-0.48	-0.5311	-0.9628	1367731	Bionet1_002585	CC(C)(CNC(=O)c1c(Cl)cccc1Cl)SCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N08	compound treatment	1.105	-0.061	-0.82	1.282	-0.0183	-0.25	-0.7583	-0.8816	1909545	Bionet1_002586	Cc1nnc(SCC=C)nc1/C=C/NOCc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N09	compound treatment	1.146	-0.02	-0.27	1.37	0.0697	0.95	0.4813	0.4869	1909546	Bionet1_002587	CC(C)(CNC(=O)c1cccc(c1)[N+](=O)[O-])SCc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N10	compound treatment	1.09	-0.076	-1.03	1.309	0.00873	0.12	-0.641	-0.6208	1909547	Bionet1_002588	FC(F)(F)c1cccc(Oc2ccc(cn2)C(=O)NC3CCSC3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N11	compound treatment	1.092	-0.074	-1.0	1.338	0.0377	0.51	-0.3423	-0.3047	1909548	Bionet1_002589	Oc1nc(cc(c1C#N)c2ccc(Cl)cc2Cl)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N12	compound treatment	1.156	-0.01	-0.14	1.253	-0.0473	-0.64	-0.5514	-0.8373	1909549	Bionet1_002590	CCCSc1nnc(C)c(/C=C/Nc2cccc(c2)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N13	compound treatment	1.12	-0.046	-0.62	1.264	-0.0363	-0.49	-0.7888	-0.9936	1909550	Bionet1_002591	Cc1ccc(cc1)c2cc(c(C#N)c(O)n2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N14	compound treatment	1.128	-0.038	-0.51	1.286	-0.0143	-0.19	-0.5003	-0.9119	1909551	Bionet1_002592	COc1ccc(N/C=C/c2nc(SCc3ccccc3)nnc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N15	compound treatment	1.184	0.018	0.24	1.322	0.0217	0.3	0.381	0.995	1909552	Bionet1_002593	Cc1ccc(cc1)c2cc(nc(O)c2C#N)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N16	compound treatment	1.076	-0.09	-1.21	1.291	-0.00927	-0.13	-0.9482	-0.7765	1909553	Bionet1_002594	Cc1nnc(SCc2ccccc2)nc1/C=C/Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N17	compound treatment	1.218	0.052	0.7	1.299	-0.00127	-0.02	0.4836	0.6895	1909554	Bionet1_002595	CNC(=O)CSCC(=O)Nc1cc(OC(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N18	compound treatment	1.149	-0.017	-0.23	1.283	-0.0173	-0.24	-0.3289	-0.9999	1909555	Bionet1_002596	Cc1nnc(SCc2ccccc2)nc1/C=C/Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N19	compound treatment	1.123	-0.043	-0.58	1.284	-0.0163	-0.22	-0.5673	-0.9129	1909556	Bionet1_002597	CNC(=O)CS(=O)CC(=O)Nc1cc(OC(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N20	compound treatment	1.117	-0.049	-0.66	1.273	-0.0273	-0.37	-0.7306	-0.9629	1909557	Bionet1_002598	Cc1nnc(SCc2ccccc2)nc1/C=C/NOCc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N21	compound treatment	1.22	0.054	0.73	1.285	-0.0153	-0.21	0.3676	0.4855	1909558	Bionet1_002599	CNC(=O)CS(=O)(=O)CC(=O)Nc1cc(OC(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	N22	compound treatment	1.139	-0.027	-0.36	1.28	-0.0203	-0.28	-0.4532	-0.9907	1909559	Bionet1_002600	COc1ccc(N/C=C/c2nc(SCc3ccc(Cl)cc3)nnc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O03	compound treatment	1.172	0.00597	0.08	1.313	0.0127	0.17	0.1797	0.939	1909560	Bionet1_002601	FC(F)(F)c1nc2ccccc2n3c(nnc13)c4c(Cl)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O04	compound treatment	1.194	0.028	0.38	1.315	0.0147	0.2	0.4089	0.9565	1909561	Bionet1_002602	COc1ccc(cc1OC)/C(=C/Nc2cccc(Br)c2)/C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O05	compound treatment	1.196	0.03	0.4	1.268	-0.0323	-0.44	-0.0252	-0.0422	1909562	Bionet1_002603	COc1ccc(cc1)C(=O)NNc2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O06	compound treatment	1.161	-0.00503	-0.07	1.295	-0.00527	-0.07	-0.0987	-0.9996	1909563	Bionet1_002604	COc1ccc(N/C=C(\C(=O)C)/c2ccc(OC)c(OC)c2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O07	compound treatment	1.127	-0.039	-0.53	1.292	-0.00827	-0.11	-0.452	-0.8395	1909564	Bionet1_002605	[O-][N+](=O)c1cc(/C=N/Nc2nc3ccccc3nc2C(F)(F)F)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O08	compound treatment	1.185	0.019	0.26	1.298	-0.00227	-0.03	0.1591	0.6172	1909565	Bionet1_002606	CC1(C)NC(=NC(=C1)/C=C/c2c(Cl)cccc2Cl)SCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O09	compound treatment	1.248	0.082	1.11	1.404	0.104	1.41	1.7822	0.9926	1909566	Bionet1_002607	[O-][N+](=O)c1cc(ccc1Cl)c2nnc3c(nc4ccccc4n23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O10	compound treatment	1.141	-0.025	-0.34	1.317	0.0167	0.23	-0.0774	-0.1899	1909567	Bionet1_002608	CC1(C)NC(=NC(=C1)/C=C/c2ccc(Cl)cc2Cl)SCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O11	compound treatment	1.132	-0.034	-0.46	1.304	0.00373	0.05	-0.2886	-0.6249	1909568	Bionet1_002609	COc1ccc(cc1)C(=O)NN(C)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O12	compound treatment	1.172	0.00597	0.08	1.347	0.0467	0.64	0.5076	0.7902	1909569	Bionet1_002610	CC(C)SC1=NC(=CC(C)(C)N1)/C=C/c2c(Cl)cccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O13	compound treatment	1.196	0.03	0.4	1.297	-0.00327	-0.04	0.2544	0.6254	1909570	Bionet1_002611	CN(NC(=O)c1ccc(C)cc1)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O14	compound treatment	1.149	-0.017	-0.23	1.304	0.00373	0.05	-0.1264	-0.5374	1909571	Bionet1_002612	CC(C)SC1=NC(=CC(C)(C)N1)/C=C/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O15	compound treatment	1.256	0.09	1.21	1.306	0.00573	0.08	0.9136	0.7511	1909572	Bionet1_002613	COc1ccc(cc1)C2=CC(=O)N(Nc3ncc(cc3Cl)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O16	compound treatment	1.164	-0.00203	-0.03	1.316	0.0157	0.21	0.1324	0.612	1319319	Bionet1_002614	COc1cc(c(Cl)cc1Cl)n2c(S)nc3cc(Cl)ccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O17	compound treatment	1.235	0.069	0.93	1.285	-0.0153	-0.21	0.5107	0.5357	1909573	Bionet1_002615	COc1ccc(cc1)C2=CC(=O)N(Nc3ccc(Cl)cc3Cl)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O18	compound treatment	1.191	0.025	0.34	1.373	0.0727	0.99	0.9395	0.897	1510896	Bionet1_002616	COc1cc(c(Cl)cc1Cl)n2c(S)nc3ccc(C)cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O19	compound treatment	1.194	0.028	0.38	1.301	7.34E-4	0.01	0.2739	0.7256	1909574	Bionet1_002617	Clc1ccc(cc1)C2=CC(=O)N(Nc3ccc(Cl)cc3Cl)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O20	compound treatment	1.189	0.023	0.31	1.348	0.0477	0.65	0.6794	0.9424	1443260	Bionet1_002618	CC(C)Oc1cc(c(Cl)cc1Cl)n2c(S)nc3ccccc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O21	compound treatment	1.2	0.034	0.46	1.32	0.0197	0.27	0.5143	0.9678	1909575	Bionet1_002619	CN(NS(=O)(=O)c1ccccc1)c2nc3ccccc3nc2C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	O22	compound treatment	1.221	0.055	0.74	1.323	0.0227	0.31	0.7436	0.9251	1909576	Bionet1_002620	CCOC(=O)CSc1nnc(c2ccccc2SC)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P03	compound treatment	1.128	-0.038	-0.51	1.313	0.0127	0.17	-0.24	-0.4431	1909577	Bionet1_002621	CC(C)Oc1cc(NC(=O)CSCC(=O)N(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P04	compound treatment	1.156	-0.01	-0.14	1.248	-0.0523	-0.71	-0.5996	-0.8266	1909578	Bionet1_002622	Cc1ccc(N/C=C/c2nc(SCc3ccc(Cl)cc3)nnc2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P05	compound treatment	1.146	-0.02	-0.27	1.279	-0.0213	-0.29	-0.3961	-0.9994	1909579	Bionet1_002623	CC(C)Oc1cc(NC(=O)CS(=O)CC(=O)N(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P06	compound treatment	1.111	-0.055	-0.74	1.239	-0.0613	-0.84	-1.1157	-0.9983	1909580	Bionet1_002624	Cc1nnc(SCc2ccc(Cl)cc2)nc1/C=C/Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P07	compound treatment	1.13	-0.036	-0.49	1.298	-0.00227	-0.03	-0.3655	-0.7506	1909581	Bionet1_002625	CNC(=O)CSCC(=O)Nc1cc(OCCOC)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P08	compound treatment	1.153	-0.013	-0.18	1.241	-0.0593	-0.81	-0.6958	-0.8412	1909582	Bionet1_002626	CSc1nnc(C)c(/C=C/NOCc2ccc(Cl)cc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P09	compound treatment	1.046	-0.12	-1.62	1.211	-0.0893	-1.22	-2.0057	-0.9901	1909583	Bionet1_002627	CNC(=O)CS(=O)CC(=O)Nc1cc(OCCOC)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P10	compound treatment	0.304	-0.862	-11.63	0.361	-0.939	-12.81	-17.28	-0.9988	1228714	Bionet1_002628	Clc1ccc(CC(=O)NCCS(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P11	compound treatment	1.126	-0.04	-0.54	1.265	-0.0353	-0.48	-0.7219	-0.9983	1909584	Bionet1_002629	COCCOc1cc(NC(=O)CSCC(=O)N(C)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P12	compound treatment	1.126	-0.04	-0.54	1.191	-0.109	-1.49	-1.4354	-0.9057	1909585	Bionet1_002630	CSc1nnc(C)c(/C=C/NOCc2cccc(Cl)c2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P13	compound treatment	1.133	-0.033	-0.45	1.315	0.0147	0.2	-0.173	-0.3539	1909586	Bionet1_002631	CCN(CC)C(=O)CSCC(=O)Nc1cc(OC)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P14	compound treatment	1.125	-0.041	-0.55	1.27	-0.0303	-0.41	-0.6832	-0.9896	1909587	Bionet1_002632	Fc1ccc(/C=C/2\SC(=S)N(N3C(=O)c4ccccc4C3=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P15	compound treatment	1.162	-0.00403	-0.05	1.294	-0.00627	-0.09	-0.0989	-0.9761	1909588	Bionet1_002633	CCN(CC)C(=O)CS(=O)CC(=O)Nc1cc(OC)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P16	compound treatment	1.101	-0.065	-0.88	1.273	-0.0273	-0.37	-0.8832	-0.927	1724601	Bionet1_002634	COc1cccc(c1)c2nc(nc(N3CCN(C)CC3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P17	compound treatment	1.144	-0.022	-0.3	1.25	-0.0503	-0.69	-0.6948	-0.93	1909589	Bionet1_002635	COc1cc(NC(=S)NC(=O)c2csnn2)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P18	compound treatment	1.107	-0.059	-0.8	1.322	0.0217	0.3	-0.3535	-0.4161	1537313	Bionet1_002636	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccc(C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P19	compound treatment	1.18	0.014	0.19	1.268	-0.0323	-0.44	-0.1778	-0.3715	1909590	Bionet1_002637	Cn1nc(c(/C=N/O)c1Sc2ccc(cc2)C(C)(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P20	compound treatment	1.093	-0.073	-0.99	1.287	-0.0133	-0.18	-0.8246	-0.8232	1702113	Bionet1_002638	CN1CCN(CC1)c2nc(nc(c2C#N)c3ccc(F)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P21	compound treatment	1.159	-0.00703	-0.09	1.336	0.0357	0.49	0.2775	0.559	1909591	Bionet1_002639	Cn1nc(c(/C=N/O)c1Sc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.575	P22	compound treatment	1.209	0.043	0.58	1.253	-0.0473	-0.64	-0.0458	-0.0529	1548153	Bionet1_002640	COc1ccccc1c2nc(nc(N3CCN(C)CC3)c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A03	compound treatment	1.178	0.00366	0.05	1.281	-0.0293	-0.4	-0.2478	-0.6152	1333022	Bionet1_002641	CC(C)c1ccc(cc1)C2Nc3cc(C)c(C)cc3NC4=C2C(=O)CC(C)(C)C4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A04	compound treatment	1.205	0.0307	0.41	1.299	-0.0113	-0.15	0.1833	0.4153	1909592	Bionet1_002642	Cn1nc(c(C#N)c1Sc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A05	compound treatment	1.148	-0.0263	-0.36	1.321	0.0107	0.15	-0.1483	-0.3861	1144365	Bionet1_002643	Cc1cc2NC(C3=C(CC(C)(C)CC3=O)Nc2cc1C)c4cccc(O)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A06	compound treatment	1.194	0.0197	0.27	1.34	0.0297	0.4	0.4737	0.979	1909593	Bionet1_002644	Cn1nc(c(/C=N/O)c1Sc2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A07	compound treatment	1.158	-0.0163	-0.22	1.311	6.82E-4	0.01	-0.1493	-0.6767	1411009	Bionet1_002645	CCOC(=O)c1cc(nnc1Sc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A08	compound treatment	1.197	0.0227	0.31	1.369	0.0587	0.8	0.782	0.9129	1909594	Bionet1_002646	CNc1cc(CSC)nc(SCc2ccc(Cl)c(Cl)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A09	compound treatment	1.1	-0.0743	-1.0	1.261	-0.0493	-0.67	-1.1847	-0.9811	1909595	Bionet1_002647	CC(C)C(NC(=O)c1sc(C)nc1C(F)(F)F)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A10	compound treatment	1.235	0.0607	0.82	1.335	0.0247	0.34	0.8166	0.9229	1227541	Bionet1_002648	CSCc1cc(NCC=C)nc(SCc2ccc(Cl)c(Cl)c2)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A11	compound treatment	1.211	0.0367	0.49	1.297	-0.0133	-0.18	0.2213	0.42	1909596	Bionet1_002649	CC(C(=O)c1c[nH]c(c1)C(=O)NCC=C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A12	compound treatment	1.231	0.0567	0.76	1.322	0.0117	0.16	0.6531	0.8365	1909597	Bionet1_002650	CO/N=C/c1c(Sc2ccc(Cl)cc2)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A13	compound treatment	1.122	-0.0523	-0.71	1.329	0.0187	0.25	-0.3192	-0.4252	1909598	Bionet1_002651	FC(F)(F)c1cnc(CCC(=O)N2CCN(CC2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A14	compound treatment	1.219	0.0447	0.6	1.332	0.0217	0.3	0.6351	0.9463	1909599	Bionet1_002652	CNc1cc(CSC)nc(SCc2ccc(Cl)cc2Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A15	compound treatment	1.151	-0.0233	-0.31	1.339	0.0287	0.39	0.0539	0.1073	1909600	Bionet1_002653	CN(C)c1nc(N(C)C)n(n1)S(=O)(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A16	compound treatment	1.182	0.00766	0.1	1.395	0.0847	1.15	0.8896	0.7673	1909601	Bionet1_002654	CSCc1cc(nc(SCc2ccc(Cl)cc2Cl)n1)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A17	compound treatment	1.195	0.0207	0.28	1.334	0.0237	0.32	0.4254	0.9973	1909602	Bionet1_002655	[O-][N+](=O)c1ccc(cc1)N2CCc3c(C#N)c(sc3C2)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A18	compound treatment	1.242	0.0677	0.91	1.347	0.0367	0.5	0.9991	0.9599	1909603	Bionet1_002656	CO/N=C/c1c(Sc2ccccc2C(=O)OC)n(C)nc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A19	compound treatment	1.125	-0.0493	-0.67	1.282	-0.0283	-0.39	-0.7438	-0.9665	1909604	Bionet1_002657	CC1(OCCO1)c2ccc([N+](=O)[O-])c(CS(=O)(=O)c3ccccc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A20	compound treatment	1.218	0.0437	0.59	1.316	0.00568	0.08	0.4712	0.7933	1909605	Bionet1_002658	Cn1nc(c(C#N)c1Sc2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A21	compound treatment	1.199	0.0247	0.33	1.321	0.0107	0.15	0.3382	0.9314	1909606	Bionet1_002659	CN(C)/C=C/C(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccccc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	A22	compound treatment	1.187	0.0127	0.17	1.303	-0.00732	-0.1	0.0502	0.2537	1909607	Bionet1_002660	Oc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3cccc(Br)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B03	compound treatment	1.183	0.00866	0.12	1.303	-0.00732	-0.1	0.012	0.0782	1723442	Bionet1_002661	CC(C)Nc1nc(SCc2ccc(C)cc2)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B04	compound treatment	1.154	-0.0203	-0.27	1.369	0.0587	0.8	0.3718	0.4394	1909608	Bionet1_002662	Cn1nc(c(/C=N/OCc2ccc(Cl)cc2Cl)c1O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B05	compound treatment	1.217	0.0427	0.58	1.291	-0.0193	-0.26	0.2206	0.3486	1909609	Bionet1_002663	Cc1ccc(N/N=C/2\C(=O)N(CN3CCOCC3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B06	compound treatment	1.173	-0.00134	-0.02	1.348	0.0377	0.51	0.3505	0.6817	1909610	Bionet1_002664	Cn1nc(c(/C=N/OCc2ccc(Cl)cc2Cl)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B07	compound treatment	1.185	0.0107	0.14	1.329	0.0187	0.25	0.2818	0.9633	1909611	Bionet1_002665	Clc1ccc(N/N=C/2\C(=O)N(CN3CCOCC3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B08	compound treatment	1.191	0.0167	0.22	1.346	0.0357	0.49	0.5029	0.9384	1909612	Bionet1_002666	CCOc1ccc(Br)cc1/C=C/c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B09	compound treatment	1.165	-0.00934	-0.13	1.313	0.00268	0.04	-0.0633	-0.4821	1909613	Bionet1_002667	Clc1ccccc1N/N=C/2\C(=O)N(CN3CCOCC3)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B10	compound treatment	1.154	-0.0203	-0.27	1.302	-0.00832	-0.11	-0.2743	-0.9236	1909614	Bionet1_002668	Cn1nc(c(CCl)c1Sc2ccc(Br)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B11	compound treatment	1.189	0.0147	0.2	1.346	0.0357	0.49	0.4839	0.9213	1909615	Bionet1_002669	Fc1ccc(N/N=C/2\C(=O)N(CN3CCOCC3)c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B12	compound treatment	1.151	-0.0233	-0.31	1.313	0.00268	0.04	-0.1968	-0.6208	1909616	Bionet1_002670	Cc1ccc(cc1)c2cc3ccccc3nc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B13	compound treatment	1.201	0.0267	0.36	1.389	0.0787	1.07	1.013	0.8952	1909617	Bionet1_002671	CO/N=C(/CS(=O)(=O)c1ccc(Cl)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B14	compound treatment	1.183	0.00866	0.12	1.299	-0.0113	-0.15	-0.0266	-0.1373	1909618	Bionet1_002672	C/C(=N\Oc1cccc(O/N=C(\C)/c2ccc(F)cc2)n1)/c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B15	compound treatment	1.21	0.0357	0.48	1.276	-0.0343	-0.47	0.0092	0.0137	1909619	Bionet1_002673	CO/N=C(/CS(=O)Cc1ccc(Cl)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B16	compound treatment	1.158	-0.0163	-0.22	1.363	0.0527	0.72	0.3521	0.4685	1909620	Bionet1_002674	FC(F)(F)c1ccc(N/N=C(/N=Nc2ccc(cc2)C(F)(F)F)\C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B17	compound treatment	1.21	0.0357	0.48	1.324	0.0137	0.19	0.4721	0.915	1909621	Bionet1_002675	CO/N=C(/CS(=O)(=O)Cc1ccc(Cl)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B18	compound treatment	1.163	-0.0113	-0.15	1.28	-0.0303	-0.41	-0.4006	-0.9086	1527210	Bionet1_002676	COC(=O)Cc1c(sc(NC(=O)c2ccccc2)c1C(=O)OC)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B19	compound treatment	1.189	0.0147	0.2	1.37	0.0597	0.81	0.7153	0.854	1909622	Bionet1_002677	CO/N=C(/CS(=O)(=O)c1ccc(OC)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B20	compound treatment	1.17	-0.00434	-0.06	1.337	0.0267	0.36	0.2158	0.5856	1909623	Bionet1_002678	CN(C)/C=C/C(=C\C(=O)C(F)(F)F)/Nc1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B21	compound treatment	1.17	-0.00434	-0.06	1.351	0.0407	0.55	0.3508	0.6289	1909624	Bionet1_002679	CO/N=C(\CS(=O)Cc1ccc(OC)cc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	B22	compound treatment	1.16	-0.0143	-0.19	1.339	0.0287	0.39	0.1397	0.3202	1909625	Bionet1_002680	COc1ccc(/C=C\2/N(Cc3ccccc3)C(=O)CN(C(=O)C)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C03	compound treatment	1.156	-0.0183	-0.25	1.267	-0.0433	-0.59	-0.5927	-0.9254	1909626	Bionet1_002681	CC1(OCCO1)c2ccc([N+](=O)[O-])c(CS(=O)(=O)c3ccc(Cl)cc3)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C04	compound treatment	1.243	0.0687	0.93	1.327	0.0167	0.23	0.8158	0.8554	1909627	Bionet1_002682	Oc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C05	compound treatment	1.246	0.0717	0.97	1.318	0.00768	0.1	0.7576	0.7792	1909628	Bionet1_002683	CCOC(=O)/C(=C(\O)/C(=C/c1ccccc1)/NC(=O)c2ccccc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C06	compound treatment	1.193	0.0187	0.25	1.328	0.0177	0.24	0.3485	0.9998	1909629	Bionet1_002684	Oc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C07	compound treatment	1.13	-0.0443	-0.6	1.343	0.0327	0.45	-0.1079	-0.1446	1909630	Bionet1_002685	CC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C08	compound treatment	1.252	0.0777	1.05	1.371	0.0607	0.83	1.3259	0.9932	1909631	Bionet1_002686	Oc1nc(cc(c1C#N)c2ccc(Cl)cc2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C09	compound treatment	1.178	0.00366	0.05	1.325	0.0147	0.2	0.1764	0.8557	1909632	Bionet1_002687	Fc1ccc(cc1)S(=O)(=O)NCCNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C10	compound treatment	1.179	0.00466	0.06	1.355	0.0447	0.61	0.4753	0.7759	1909633	Bionet1_002688	Oc1nc(cc(c1C#N)c2ccccc2C(F)(F)F)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C11	compound treatment	1.168	-0.00634	-0.09	1.38	0.0697	0.95	0.6114	0.6408	1909634	Bionet1_002689	CCOC(=O)c1[nH]c2ccccc2c1NC(=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C12	compound treatment	1.208	0.0337	0.45	1.338	0.0277	0.38	0.588	0.9958	1909635	Bionet1_002690	COc1ccc(Sc2nc(SC)nc(c2C#N)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C13	compound treatment	1.243	0.0687	0.93	1.343	0.0327	0.45	0.9701	0.9438	1909636	Bionet1_002691	COC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C14	compound treatment	1.276	0.102	1.37	1.367	0.0567	0.77	1.5163	0.9632	1909637	Bionet1_002692	CSc1nc(Sc2ccc(Cl)cc2)c(C#N)c(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C15	compound treatment	1.117	-0.0573	-0.77	1.313	0.00268	0.04	-0.5212	-0.6729	1909638	Bionet1_002693	NNC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C16	compound treatment	1.203	0.0287	0.39	1.333	0.0227	0.31	0.4921	0.9939	1909639	Bionet1_002694	CSc1nc(Sc2cccc(Cl)c2)c(C#N)c(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C17	compound treatment	1.173	-0.00134	-0.02	1.39	0.0797	1.09	0.7555	0.6952	1909640	Bionet1_002695	COC(=O)c1ccc(c(CS(=O)(=O)c2ccc(Cl)cc2)c1)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C18	compound treatment	1.204	0.0297	0.4	1.377	0.0667	0.91	0.9259	0.932	1909641	Bionet1_002696	FC(F)(F)c1cccc(/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C19	compound treatment	1.17	-0.00434	-0.06	1.344	0.0337	0.46	0.2833	0.6119	1909642	Bionet1_002697	FC(F)(F)c1cnc(c(Cl)c1)n2cc3CCc4ccccc4-c3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C20	compound treatment	1.194	0.0197	0.27	1.306	-0.00432	-0.06	0.1459	0.537	1909643	Bionet1_002698	FC(F)(F)c1ccc(/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C21	compound treatment	1.228	0.0537	0.72	1.328	0.0177	0.24	0.6823	0.8943	1909644	Bionet1_002699	CCOC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	C22	compound treatment	1.223	0.0487	0.66	1.38	0.0697	0.95	1.136	0.9837	1909645	Bionet1_002700	FC(F)(F)c1ccccc1/N=C/2\C(=O)N(c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D03	compound treatment	1.143	-0.0313	-0.42	1.321	0.0107	0.15	-0.196	-0.4382	1909646	Bionet1_002701	CO/N=C(\CS(=O)(=O)Cc1ccc(OC)cc1)/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D04	compound treatment	1.188	0.0137	0.18	1.349	0.0387	0.53	0.5033	0.9007	1909647	Bionet1_002702	CCOC(OCC)c1ccc(/C=C/C(=O)c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D05	compound treatment	1.174	-3.45E-4	0.0	1.346	0.0357	0.49	0.3408	0.7003	1909648	Bionet1_002703	Cn1nc(c(/C=N/c2ccc(F)c(Cl)c2F)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D06	compound treatment	1.121	-0.0533	-0.72	1.288	-0.0223	-0.3	-0.7241	-0.9267	1909649	Bionet1_002704	COc1ccc(N=Nc2cnc(nc2c3ccc(OC)cc3)c4ccccn4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D07	compound treatment	1.216	0.0417	0.56	1.307	-0.00332	-0.05	0.3654	0.6481	1909650	Bionet1_002705	Cn1nc(c(/C=N/c2cccc(c2)C(F)(F)F)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D08	compound treatment	1.14	-0.0343	-0.46	1.289	-0.0213	-0.29	-0.5332	-0.9748	1909651	Bionet1_002706	Clc1ccccc1N=Nc2cnc(nc2c3ccccc3)c4ccncc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D09	compound treatment	1.16	-0.0143	-0.19	1.348	0.0377	0.51	0.2265	0.4125	1909652	Bionet1_002707	CN(NC(=O)c1cccc(c1)C(F)(F)F)c2c(C#N)c(nn2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D10	compound treatment	1.143	-0.0313	-0.42	1.258	-0.0523	-0.71	-0.8035	-0.9688	1909653	Bionet1_002708	Clc1ccc(N=Nc2cnc(nc2c3ccco3)c4cccnc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D11	compound treatment	1.137	-0.0373	-0.5	1.314	0.00368	0.05	-0.3207	-0.6335	1909654	Bionet1_002709	CN(NC(=O)c1ccc(Cl)cc1Cl)c2c(C#N)c(nn2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D12	compound treatment	1.158	-0.0163	-0.22	1.289	-0.0213	-0.29	-0.3615	-0.9907	1909655	Bionet1_002710	CC(=O)N1CC(=O)N(Cc2ccccc2)/C(=C/c3ccc(F)cc3)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D13	compound treatment	1.194	0.0197	0.27	1.298	-0.0123	-0.17	0.0687	0.219	1909656	Bionet1_002711	CN(NS(=O)(=O)c1ccccc1)c2c(C#N)c(nn2C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D14	compound treatment	1.191	0.0167	0.22	1.252	-0.0583	-0.8	-0.4034	-0.4882	1909657	Bionet1_002712	CN(C)c1ccc(/C=C\2/N(Cc3ccccc3)C(=O)CN(C(=O)C)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D15	compound treatment	1.127	-0.0473	-0.64	1.304	-0.00632	-0.09	-0.5126	-0.7953	1677095	Bionet1_002713	COc1ccc(cc1)N(Cc2ccccc2)C(=O)c3ccc(Cl)nc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D16	compound treatment	1.226	0.0517	0.7	1.32	0.00968	0.13	0.5861	0.8264	1909658	Bionet1_002714	COc1ccc(cc1)c2nc(ncc2N=Nc3ccc(F)cc3)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D17	compound treatment	1.225	0.0507	0.68	1.276	-0.0343	-0.47	0.1523	0.1839	1675002	Bionet1_002715	COc1ccc(cc1)N(Cc2ccccc2)C(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D18	compound treatment	1.191	0.0167	0.22	1.304	-0.00632	-0.09	0.098	0.4071	1719087	Bionet1_002716	Nc1nc(Cn2cncn2)nc(N)c1Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D19	compound treatment	1.192	0.0177	0.24	1.318	0.00768	0.1	0.2425	0.932	1909659	Bionet1_002717	CO/N=C(/CS(=O)c1ccccc1C(=O)OC)\c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D20	compound treatment	1.172	-0.00234	-0.03	1.32	0.00968	0.13	0.071	0.5229	1909660	Bionet1_002718	COc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccc(cc3)[N+](=O)[O-])/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D21	compound treatment	1.176	0.00166	0.02	1.295	-0.0153	-0.21	-0.1319	-0.6279	1909661	Bionet1_002719	CO/N=C(/CSc1ccc(Br)cc1)\c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	D22	compound treatment	1.131	-0.0433	-0.58	1.309	-0.00132	-0.02	-0.4262	-0.7285	1909662	Bionet1_002720	Clc1ccc(C2CC2C(=O)c3ccc(Br)cc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E03	compound treatment	1.133	-0.0413	-0.56	1.335	0.0247	0.34	-0.1564	-0.2401	1227893	Bionet1_002721	Nc1ccc(cc1CS(=O)(=O)c2ccc(Cl)cc2)C(=O)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E04	compound treatment	1.172	-0.00234	-0.03	1.349	0.0387	0.53	0.3506	0.6635	1909663	Bionet1_002722	O=C/1N(c2ccccc2\C1=N\c3ccc(Oc4ccccc4)cc3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E05	compound treatment	1.135	-0.0393	-0.53	1.309	-0.00132	-0.02	-0.388	-0.7306	1909664	Bionet1_002723	NC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E06	compound treatment	1.18	0.00566	0.08	1.321	0.0107	0.15	0.157	0.9545	1909665	Bionet1_002724	Clc1ccc(N/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E07	compound treatment	1.192	0.0177	0.24	1.369	0.0587	0.8	0.7343	0.8794	1909666	Bionet1_002725	Clc1ccc(cc1)S(=O)(=O)Cc2cc(C#N)ccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E08	compound treatment	1.197	0.0227	0.31	1.336	0.0257	0.35	0.4638	0.9977	1909667	Bionet1_002726	Clc1cc(Cl)cc(N/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E09	compound treatment	1.21	0.0357	0.48	1.311	6.82E-4	0.01	0.3467	0.7207	1909668	Bionet1_002727	Clc1ccc(cc1)S(=O)(=O)c2snnc2C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E10	compound treatment	1.219	0.0447	0.6	1.362	0.0517	0.7	0.9243	0.9969	1909669	Bionet1_002728	Clc1ccc(Cl)c(N/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E11	compound treatment	1.15	-0.0243	-0.33	1.289	-0.0213	-0.29	-0.4378	-0.9981	1909670	Bionet1_002729	Clc1ccc(cc1)S(=O)c2snnc2C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E12	compound treatment	1.168	-0.00634	-0.09	1.352	0.0417	0.57	0.3414	0.5939	1909671	Bionet1_002730	[O-][N+](=O)c1ccc(N/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E13	compound treatment	1.158	-0.0163	-0.22	1.283	-0.0273	-0.37	-0.4193	-0.9687	1315741	Bionet1_002731	Clc1ccc(cc1)S(=O)c2snnc2C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E14	compound treatment	1.157	-0.0173	-0.23	1.293	-0.0173	-0.24	-0.3324	-1.0	1909672	Bionet1_002732	CSc1nc(Sc2ccc(Cl)cc2)c(C#N)c(n1)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E15	compound treatment	1.237	0.0627	0.85	1.319	0.00868	0.12	0.6814	0.7984	1678768	Bionet1_002733	Clc1ccc(cc1)S(=O)c2snnc2C(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E16	compound treatment	1.185	0.0107	0.14	1.289	-0.0213	-0.29	-0.1039	-0.3204	1909673	Bionet1_002734	CSc1nc(Sc2cccc(C)c2)c(C#N)c(n1)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E17	compound treatment	1.128	-0.0463	-0.63	1.303	-0.00732	-0.1	-0.5127	-0.8097	1909674	Bionet1_002735	Clc1ccc(Sc2snnc2C(=O)OC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E18	compound treatment	1.175	6.55E-4	0.01	1.351	0.0407	0.55	0.3985	0.7183	1909675	Bionet1_002736	Oc1nc(SCc2ccccc2Cl)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E19	compound treatment	1.2	0.0257	0.35	1.34	0.0297	0.4	0.5309	0.997	1646308	Bionet1_002737	Clc1ccc(cc1)S(=O)(=O)c2snnc2C(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E20	compound treatment	1.231	0.0567	0.76	1.358	0.0477	0.65	1.0002	0.9968	1909676	Bionet1_002738	Oc1nc(SCc2cccc(c2)C(F)(F)F)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E21	compound treatment	1.209	0.0347	0.47	1.352	0.0417	0.57	0.7325	0.9953	1739634	Bionet1_002739	Clc1ccc(cc1)S(=O)(=O)c2snnc2C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	E22	compound treatment	1.223	0.0487	0.66	1.366	0.0557	0.76	1.0011	0.9974	1909677	Bionet1_002740	Cc1ccc(cc1)c2nc(SCc3ccccc3)nc(Cl)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F03	compound treatment	1.171	-0.00334	-0.05	1.305	-0.00532	-0.07	-0.0832	-0.9739	1909678	Bionet1_002741	CO/N=C(/CS(=O)c1ccc(Br)cc1)\c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F04	compound treatment	1.147	-0.0273	-0.37	1.259	-0.0513	-0.7	-0.7557	-0.9553	1909679	Bionet1_002742	O/N=C(/C1CC1c2ccc(Cl)cc2)\c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F05	compound treatment	1.2	0.0257	0.35	1.31	-3.18E-4	0.0	0.2417	0.6982	1909680	Bionet1_002743	FC(F)(F)c1cccc(CC(=O)Nc2ccc(Oc3ccccc3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F06	compound treatment	1.162	-0.0123	-0.17	1.255	-0.0553	-0.75	-0.6512	-0.8429	1909681	Bionet1_002744	Cc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccc(C)cc3)/c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F07	compound treatment	1.168	-0.00634	-0.09	1.303	-0.00732	-0.1	-0.1311	-0.9971	1909682	Bionet1_002745	Clc1ccc(CN/C(=N\c2ccccc2)/NC3CCCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F08	compound treatment	1.155	-0.0193	-0.26	1.329	0.0187	0.25	-0.0044	-0.012	1909683	Bionet1_002746	Cc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccc(F)cc3)/c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F09	compound treatment	1.129	-0.0453	-0.61	1.276	-0.0343	-0.47	-0.7635	-0.9913	1339515	Bionet1_002747	Fc1ccc(cc1)C(=O)N2CCN3C(=O)c4ccccc4C23c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F10	compound treatment	1.167	-0.00734	-0.1	1.229	-0.0813	-1.11	-0.8542	-0.7672	1909684	Bionet1_002748	Cc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccco3)/c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F11	compound treatment	1.196	0.0217	0.29	1.295	-0.0153	-0.21	0.0589	0.1639	1720705	Bionet1_002749	Cc1ccc(cc1)C(=O)N2CCN3C(=O)c4ccccc4C23c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F12	compound treatment	1.157	-0.0173	-0.23	1.26	-0.0503	-0.69	-0.6506	-0.8975	1909685	Bionet1_002750	COc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccc(C)cc3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F13	compound treatment	1.209	0.0347	0.47	1.329	0.0187	0.25	0.5107	0.9592	1909686	Bionet1_002751	Cn1nc(c(C(=O)Nc2ccc(cc2)C(F)(F)F)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F14	compound treatment	1.177	0.00266	0.04	1.261	-0.0493	-0.67	-0.4502	-0.6685	1909687	Bionet1_002752	COc1ccc(cc1)C2CC2/C(=N/OC(=O)c3cccs3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F15	compound treatment	1.156	-0.0183	-0.25	1.299	-0.0113	-0.15	-0.2841	-0.9742	1909688	Bionet1_002753	Cn1nc(c(C(=O)Nc2ccc(Cl)c(Cl)c2)c1Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F16	compound treatment	1.199	0.0247	0.33	1.292	-0.0183	-0.25	0.0586	0.1408	1909689	Bionet1_002754	COc1ccc(cc1)C2CC2/C(=N/OC(=O)c3ccc(C)cc3)/c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F17	compound treatment	1.199	0.0247	0.33	1.33	0.0197	0.27	0.425	0.9943	1909690	Bionet1_002755	CN(C)/C=N\C(=O)c1sc2cc(cnc2c1c3cccs3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F18	compound treatment	1.17	-0.00434	-0.06	1.257	-0.0533	-0.73	-0.5556	-0.7616	1909691	Bionet1_002756	Cc1onc(c1C(=O)Oc2cc(no2)c3ccccc3)c4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F19	compound treatment	1.151	-0.0233	-0.31	1.296	-0.0143	-0.2	-0.3608	-0.9736	1909692	Bionet1_002757	FC(F)(F)c1cnc2c(c3cccs3)c(sc2c1)c4nc[nH]n4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F20	compound treatment	1.191	0.0167	0.22	1.282	-0.0283	-0.39	-0.1142	-0.2556	1909693	Bionet1_002758	CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F21	compound treatment	1.168	-0.00634	-0.09	1.335	0.0247	0.34	0.1775	0.511	1909694	Bionet1_002759	Cc1ccc(C)n1c2ccc(C#Cc3ccc(cc3)n4c(C)ccc4C)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	F22	compound treatment	1.117	-0.0573	-0.77	1.294	-0.0163	-0.22	-0.7044	-0.875	1909695	Bionet1_002760	CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G03	compound treatment	1.149	-0.0253	-0.34	1.265	-0.0453	-0.62	-0.6787	-0.961	1909696	Bionet1_002761	Clc1ccc(cc1)S(=O)(=O)c2snnc2C(=O)OC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G04	compound treatment	1.165	-0.00934	-0.13	1.345	0.0347	0.47	0.2453	0.5011	1909697	Bionet1_002762	Clc1ccccc1CSc2nc(Cl)c(C#N)c(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G05	compound treatment	1.14	-0.0343	-0.46	1.286	-0.0243	-0.33	-0.5621	-0.9865	1909698	Bionet1_002763	CCOC(=O)C1C(N=C(N=C1O)c2ccccc2)c3ccc(cc3)C(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G06	compound treatment	1.221	0.0467	0.63	1.357	0.0467	0.64	0.8952	1.0	1909699	Bionet1_002764	Clc1ccc(CN2C(=O)/C(=N\Nc3ccccc3)/c4ccccc24)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G07	compound treatment	1.149	-0.0253	-0.34	1.331	0.0207	0.28	-0.0423	-0.0955	1909700	Bionet1_002765	CCOC(=O)C1C(N=C(N=C1O)c2ccccc2)c3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G08	compound treatment	1.172	-0.00234	-0.03	1.305	-0.00532	-0.07	-0.0736	-0.9309	1909701	Bionet1_002766	FC(F)(F)c1cccc(CN2C(=O)/C(=N/Nc3ccccc3)/c4ccccc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G09	compound treatment	1.155	-0.0193	-0.26	1.356	0.0457	0.62	0.256	0.379	1909702	Bionet1_002767	CCOC(=O)C1C(N=C(N=C1O)c2ccccc2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G10	compound treatment	1.192	0.0177	0.24	1.297	-0.0133	-0.18	0.04	0.1336	1909703	Bionet1_002768	Clc1ccc(N/N=C/2\C(=O)N(c3ccccc23)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G11	compound treatment	1.173	-0.00134	-0.02	1.332	0.0217	0.3	0.1962	0.6625	1449119	Bionet1_002769	OC(c1c[nH]cc1c2c(Cl)cccc2Cl)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G12	compound treatment	1.208	0.0337	0.45	1.331	0.0207	0.28	0.5205	0.9738	1909704	Bionet1_002770	Oc1nc(SCc2c(Cl)cccc2Cl)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G13	compound treatment	1.175	6.55E-4	0.01	1.335	0.0247	0.34	0.2442	0.7254	1909705	Bionet1_002771	COCc1cc(nc(n1)c2ccccc2)N3CCN(CC3)c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G14	compound treatment	1.218	0.0437	0.59	1.322	0.0117	0.16	0.5291	0.8672	1909706	Bionet1_002772	Cc1ccccc1CN2C(=O)N(Cc3cccc(c3)C(F)(F)F)C(=O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G15	compound treatment	1.196	0.0217	0.29	1.29	-0.0203	-0.28	0.0107	0.0265	1909707	Bionet1_002773	COCc1cc(Sc2cccc(Cl)c2Cl)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G16	compound treatment	1.206	0.0317	0.43	1.319	0.00868	0.12	0.3857	0.8703	1909708	Bionet1_002774	COc1ccc(CN2C(=O)N(Cc3ccccc3C)C(=O)C2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G17	compound treatment	1.181	0.00666	0.09	1.328	0.0177	0.24	0.234	0.9094	1909709	Bionet1_002775	COCc1cc(Sc2c(Cl)cccc2Cl)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G18	compound treatment	1.158	-0.0163	-0.22	1.328	0.0177	0.24	0.0146	0.0446	1909710	Bionet1_002776	Fc1ccc(CN2C(=O)N(Cc3ccc(Cl)cc3Cl)C(=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G19	compound treatment	1.251	0.0767	1.03	1.345	0.0347	0.47	1.0657	0.9371	1909711	Bionet1_002777	COCc1cc(Sc2ccc(Cl)cc2Cl)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G20	compound treatment	1.213	0.0387	0.52	1.317	0.00668	0.09	0.4332	0.8183	1909712	Bionet1_002778	Cc1ccc(CN2C(=O)N(Cc3ccc(Cl)cc3Cl)C(=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G21	compound treatment	1.214	0.0397	0.53	1.417	0.107	1.45	1.407	0.9077	1909713	Bionet1_002779	COCc1cc(Sc2ccc(Br)cc2)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	G22	compound treatment	1.193	0.0187	0.25	1.388	0.0777	1.06	0.927	0.8514	1909714	Bionet1_002780	COc1ccccc1CN2C(=O)N(Cc3c(F)cccc3Cl)C(=O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H03	compound treatment	1.138	-0.0363	-0.49	1.322	0.0117	0.16	-0.2341	-0.454	1909715	Bionet1_002781	FC(F)(F)c1cnc2c(c3cccs3)c(sc2c1)C(=O)NCC#C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H04	compound treatment	1.086	-0.0883	-1.19	1.27	-0.0403	-0.55	-1.2315	-0.9383	1909716	Bionet1_002782	CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c3ccsc3C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H05	compound treatment	1.192	0.0177	0.24	1.363	0.0527	0.72	0.6764	0.8937	1909717	Bionet1_002783	Cn1c(S)nnc1c2sc3cc(cnc3c2c4cccs4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H06	compound treatment	1.126	-0.0483	-0.65	1.26	-0.0503	-0.69	-0.9464	-0.9997	1909718	Bionet1_002784	Clc1ccc(c(Cl)c1)S(=O)(=O)Oc2cc(no2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H07	compound treatment	1.197	0.0227	0.31	1.291	-0.0193	-0.26	0.0298	0.074	1909719	Bionet1_002785	FC(F)(F)c1cnc(c2cc(on2)C(=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H08	compound treatment	1.169	-0.00534	-0.07	1.294	-0.0163	-0.22	-0.2083	-0.8906	1909720	Bionet1_002786	CCOC(=O)C1=NOC(C1)C(=O)NN(C)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H09	compound treatment	1.17	-0.00434	-0.06	1.312	0.00168	0.02	-0.0252	-0.4007	1909721	Bionet1_002787	Cn1c(S)nnc1c2sc3cc(cnc3c2c4ccccc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H10	compound treatment	1.162	-0.0123	-0.17	1.297	-0.0133	-0.18	-0.2462	-0.9991	1909722	Bionet1_002788	CCOC(=O)C1C(C1C(=O)Nc2cccc(c2)C(F)(F)F)C(=O)NN
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H11	compound treatment	1.167	-0.00734	-0.1	1.332	0.0217	0.3	0.139	0.4458	1909723	Bionet1_002789	Cn1c(S)nnc1c2sc3cc(cnc3c2c4cccnc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H12	compound treatment	1.158	-0.0163	-0.22	1.286	-0.0243	-0.33	-0.3904	-0.9803	1909724	Bionet1_002790	CCOC(=O)C1C2C1C(=O)N(N(C)c3ncc(cc3Cl)C(F)(F)F)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H13	compound treatment	1.149	-0.0253	-0.34	1.327	0.0167	0.23	-0.0809	-0.197	1909725	Bionet1_002791	Cn1c(S)nnc1c2sc3cc(cnc3c2c4ccccn4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H14	compound treatment	1.154	-0.0203	-0.27	1.331	0.0207	0.28	0.0054	0.0136	1909726	Bionet1_002792	CCOC(=O)C1C(C1C(=O)N2CCCC2)C(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H15	compound treatment	1.198	0.0237	0.32	1.293	-0.0173	-0.24	0.0587	0.1478	1909727	Bionet1_002793	CSc1nnc([nH]1)c2sc3cc(cnc3c2c4cccs4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H16	compound treatment	1.129	-0.0453	-0.61	1.282	-0.0283	-0.39	-0.7056	-0.9754	1909728	Bionet1_002794	CCOC(=O)C1C(C1C(=O)OCC)C(=O)Nc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H17	compound treatment	1.156	-0.0183	-0.25	1.308	-0.00232	-0.03	-0.1973	-0.791	1909729	Bionet1_002795	FC(F)(F)c1cnc2c(c(sc2c1)C(=O)N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H18	compound treatment	1.155	-0.0193	-0.26	1.29	-0.0203	-0.28	-0.3804	-0.9996	1909730	Bionet1_002796	CCOC(=O)C1C(C1C(=O)Nc2cccc(c2)C(F)(F)F)C(=O)NC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H19	compound treatment	1.19	0.0157	0.21	1.12	-0.19	-2.6	-1.6858	-0.6474	1909731	Bionet1_002797	CN(C)/C=N/C(=O)c1sc2cc(cnc2c1c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H20	compound treatment	1.153	-0.0213	-0.29	1.288	-0.0223	-0.3	-0.4188	-0.9996	1909732	Bionet1_002798	[O-][N+](=O)c1ccc(cc1)N2CCN(CCOC(=O)Nc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H21	compound treatment	1.208	0.0337	0.45	1.336	0.0257	0.35	0.5687	0.9918	1909733	Bionet1_002799	FC(F)(F)c1cccc(c1)C(=O)n2sc(NC(=O)c3ccccc3)nc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	H22	compound treatment	1.136	-0.0383	-0.52	1.332	0.0217	0.3	-0.1567	-0.263	1909734	Bionet1_002800	[O-][N+](=O)c1ccc(cc1)N2CCN(CCOC(=O)c3ccc(F)cc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I03	compound treatment	1.172	-0.00234	-0.03	1.345	0.0347	0.47	0.3121	0.6583	1909735	Bionet1_002801	COCc1cc(SCc2ccc(Cl)cc2Cl)nc(n1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I04	compound treatment	1.176	0.00166	0.02	1.306	-0.00432	-0.06	-0.0258	-0.4104	1909736	Bionet1_002802	[O-][N+](=O)c1ccc(CN2C(=O)N(Cc3ccccc3Cl)C(=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I05	compound treatment	1.16	-0.0143	-0.19	1.286	-0.0243	-0.33	-0.3713	-0.9671	1909737	Bionet1_002803	[O-][N+](=O)c1ccc(cc1)C(=O)OCc2ccc(Oc3ccccc3)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I06	compound treatment	1.192	0.0177	0.24	1.373	0.0627	0.85	0.7728	0.871	1909738	Bionet1_002804	Clc1cccc(CN2C(=O)N(Cc3c(Cl)cccc3Cl)C(=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I07	compound treatment	1.152	-0.0223	-0.3	1.335	0.0247	0.34	0.0248	0.055	1909739	Bionet1_002805	[O-][N+](=O)c1cc(COC(=O)Nc2ccc(Cl)cc2)ccc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I08	compound treatment	1.175	6.55E-4	0.01	1.313	0.00268	0.04	0.0321	0.8534	1909740	Bionet1_002806	Clc1cccc(CN2C(=O)N(Cc3cccc(Cl)c3)C(=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I09	compound treatment	1.187	0.0127	0.17	1.332	0.0217	0.3	0.3298	0.9659	1909741	Bionet1_002807	Cc1ccc(Oc2ccc(COC(=O)c3ccc(Cl)cc3)cc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I10	compound treatment	1.188	0.0137	0.18	1.372	0.0617	0.84	0.725	0.842	1909742	Bionet1_002808	Clc1cccc(CN2C(=O)N(CCOc3ccccc3)C(=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I11	compound treatment	1.188	0.0137	0.18	1.301	-0.00932	-0.13	0.0404	0.1806	1909743	Bionet1_002809	[O-][N+](=O)c1cc(COC(=O)c2ccc(Cl)cc2)ccc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I12	compound treatment	1.158	-0.0163	-0.22	1.319	0.00868	0.12	-0.0722	-0.2885	1909744	Bionet1_002810	COc1ccccc1CN2C(=O)N(CC(=O)c3ccc(F)cc3)C(=O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I13	compound treatment	1.219	0.0447	0.6	1.263	-0.0473	-0.65	-0.0303	-0.0343	1909745	Bionet1_002811	[O-][N+](=O)c1cc(COC(=O)Nc2cccc(Cl)c2)ccc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I14	compound treatment	1.193	0.0187	0.25	1.357	0.0467	0.64	0.6281	0.9176	1909746	Bionet1_002812	Clc1ccccc1C(=O)CN2C(=O)N(Cc3ccccc3)C(=O)C2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I15	compound treatment	1.118	-0.0563	-0.76	1.327	0.0167	0.23	-0.3766	-0.4747	1909747	Bionet1_002813	Fc1ccc(NC(=O)c2nnsc2Sc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I16	compound treatment	1.179	0.00466	0.06	1.322	0.0117	0.16	0.1571	0.9172	1909748	Bionet1_002814	O=C(CN1C(=O)N(Cc2ccccc2)C(=O)C1=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I17	compound treatment	1.155	-0.0193	-0.26	1.3	-0.0103	-0.14	-0.284	-0.958	1909749	Bionet1_002815	Fc1ccc(NC(=O)c2nnsc2Sc3ccc(Cl)cc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I18	compound treatment	1.195	0.0207	0.28	1.248	-0.0623	-0.85	-0.4039	-0.4516	1909750	Bionet1_002816	Cc1cc(C)c(CN2C(=O)N(Cc3ccccc3F)C(=O)C2=O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I19	compound treatment	1.134	-0.0403	-0.54	1.343	0.0327	0.45	-0.0697	-0.0991	1909751	Bionet1_002817	Fc1ccc(NC(=O)c2nnsc2S(=O)(=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I20	compound treatment	1.207	0.0327	0.44	1.358	0.0477	0.65	0.7713	0.982	1909752	Bionet1_002818	CCOC(=O)CN1C(=O)N(Cc2ccc(Cl)cc2Cl)C(=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I21	compound treatment	1.2	0.0257	0.35	1.412	0.102	1.39	1.2252	0.8573	1909753	Bionet1_002819	Clc1ccccc1/C=C/NC(=O)OCc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	I22	compound treatment	1.198	0.0237	0.32	1.359	0.0487	0.66	0.6951	0.9437	1909754	Bionet1_002820	CCOC(=O)CN1C(=O)N(Cc2ccc(cc2)C(F)(F)F)C(=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J03	compound treatment	1.194	0.0197	0.27	1.372	0.0617	0.84	0.7823	0.887	1497526	Bionet1_002821	Cc1ccc(cc1)C(=O)Nc2nc(=O)n(s2)C(=O)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J04	compound treatment	1.17	-0.00434	-0.06	1.289	-0.0213	-0.29	-0.247	-0.8329	1909755	Bionet1_002822	[O-][N+](=O)c1ccc(cc1)N2CCN(CCOC(=O)c3cccc(Cl)c3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J05	compound treatment	1.161	-0.0133	-0.18	1.329	0.0187	0.25	0.0528	0.1694	1283584	Bionet1_002823	Cc1ccc(cc1)C(=O)Nc2nc(=O)n(s2)C(=O)c3ccccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J06	compound treatment	1.143	-0.0313	-0.42	1.234	-0.0763	-1.04	-1.0349	-0.9213	1909756	Bionet1_002824	CN(NS(=O)(=O)c1ccc(F)cc1)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J07	compound treatment	1.185	0.0107	0.14	1.307	-0.00332	-0.05	0.0697	0.4622	1909757	Bionet1_002825	CC(C)(C)/C(=N\OC(=O)NC1CCCCC1)/COc2ccccc2[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J08	compound treatment	1.161	-0.0133	-0.18	1.307	-0.00332	-0.05	-0.1593	-0.8581	1909758	Bionet1_002826	FC(F)(F)c1cccc(c1)N2C(=O)CC(C2=O)c3c[nH]c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J09	compound treatment	1.208	0.0337	0.45	1.312	0.00168	0.02	0.3373	0.7419	1909759	Bionet1_002827	Cc1ccc(OC/C(=N/OC(=O)NC2CCCCC2)/C(C)(C)C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J10	compound treatment	1.143	-0.0313	-0.42	1.246	-0.0643	-0.88	-0.9192	-0.944	1632313	Bionet1_002828	CC(=O)Nc1ccc(Sc2ccccc2C(=O)Nc3ccc(F)cc3)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J11	compound treatment	1.188	0.0137	0.18	1.305	-0.00532	-0.07	0.079	0.399	1556791	Bionet1_002829	Clc1ccc(cc1)c2cc(COc3cc(Cl)cc(Cl)c3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J12	compound treatment	1.154	-0.0203	-0.27	1.238	-0.0723	-0.99	-0.8914	-0.8708	1909760	Bionet1_002830	COc1ccc2[nH]cc(C3CC(=O)N(C3=O)c4cccc(c4)C(F)(F)F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J13	compound treatment	1.174	-3.45E-4	0.0	1.3	-0.0103	-0.14	-0.1028	-0.7301	1705222	Bionet1_002831	Clc1ccccc1c2cc(COc3cc(Cl)c(Cl)cc3Cl)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J14	compound treatment	1.209	0.0347	0.47	1.259	-0.0513	-0.7	-0.1642	-0.1952	1508650	Bionet1_002832	Clc1ccc(N2C(=O)CC(C2=O)c3c[nH]c4ccccc34)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J15	compound treatment	1.162	-0.0123	-0.17	1.316	0.00568	0.08	-0.063	-0.3428	1239805	Bionet1_002833	Clc1cc(Cl)c(OCc2cc(no2)c3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J16	compound treatment	1.152	-0.0223	-0.3	1.265	-0.0453	-0.62	-0.6501	-0.9455	1399121	Bionet1_002834	O=c1ccn(nc1c2ccn(n2)C3CCS(=O)(=O)C3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J17	compound treatment	1.203	0.0287	0.39	1.341	0.0307	0.42	0.5692	0.9992	1384706	Bionet1_002835	COc1ccc(cc1)c2cc(COc3cc(Cl)c(Cl)cc3Cl)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J18	compound treatment	1.123	-0.0513	-0.69	1.292	-0.0183	-0.25	-0.6664	-0.905	1492859	Bionet1_002836	Cc1ccc(cc1)C(=O)n2ccc(n2)c3nn(ccc3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J19	compound treatment	1.232	0.0577	0.78	1.338	0.0277	0.38	0.8169	0.9449	1281653	Bionet1_002837	Clc1ccc(cc1)c2cc(COc3cc(Cl)c(Cl)cc3Cl)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J20	compound treatment	1.158	-0.0163	-0.22	1.268	-0.0423	-0.58	-0.564	-0.9129	1693854	Bionet1_002838	Fc1ccc(cc1)C(=O)n2ccc(n2)c3nn(ccc3=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J21	compound treatment	1.185	0.0107	0.14	1.374	0.0637	0.87	0.7157	0.8131	1119437	Bionet1_002839	COc1ccc(cc1)c2cc(COc3ccc(Cl)c(Cl)c3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	J22	compound treatment	1.144	-0.0303	-0.41	1.3	-0.0103	-0.14	-0.389	-0.8985	1909761	Bionet1_002840	FC(F)(F)c1cccc(c1)n2ccc(=O)c(n2)c3ccn(n3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K03	compound treatment	1.17	-0.00434	-0.06	1.303	-0.00732	-0.1	-0.112	-0.9678	1576316	Bionet1_002841	Cc1ccc(Sc2ncccc2COC(=O)Nc3c(C)cccc3C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K04	compound treatment	1.158	-0.0163	-0.22	1.308	-0.00232	-0.03	-0.1783	-0.8003	1909762	Bionet1_002842	Cc1cccc(CN2C(=O)N(OCc3cccc(Cl)c3)C(=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K05	compound treatment	1.15	-0.0243	-0.33	1.291	-0.0193	-0.26	-0.4185	-0.994	1506044	Bionet1_002843	Cc1ccccc1NC(=O)OCc2cccnc2Oc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K06	compound treatment	1.178	0.00366	0.05	1.312	0.00168	0.02	0.0511	0.9394	1909763	Bionet1_002844	CCOC(=O)CN1C(=O)N(Cc2ccc(Cl)c(Cl)c2)C(=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K07	compound treatment	1.078	-0.0963	-1.3	1.274	-0.0363	-0.5	-1.2693	-0.9125	1367652	Bionet1_002845	Clc1ccc(Sc2ncccc2COC(=O)Nc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K08	compound treatment	1.195	0.0207	0.28	1.282	-0.0283	-0.39	-0.076	-0.1596	1909764	Bionet1_002846	CCOC(=O)CN1C(=O)N(Cc2c(Cl)cccc2Cl)C(=O)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K09	compound treatment	1.186	0.0117	0.16	1.286	-0.0243	-0.33	-0.1233	-0.336	1328691	Bionet1_002847	Clc1ccc(Sc2ncccc2COC(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K10	compound treatment	1.163	-0.0113	-0.15	1.331	0.0207	0.28	0.0912	0.2842	1909765	Bionet1_002848	COc1ccc(CN2C(=O)N(Cc3ccc(Cl)cc3)C(=O)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K11	compound treatment	1.176	0.00166	0.02	1.3	-0.0103	-0.14	-0.0837	-0.5875	1909766	Bionet1_002849	COc1ccc(COC(=O)N/C=C/c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K12	compound treatment	1.217	0.0427	0.58	1.304	-0.00632	-0.09	0.346	0.5946	1909767	Bionet1_002850	COc1ccc(CN2C(=O)N(Cc3ccc(Cl)cc3)C(=O)C2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K13	compound treatment	1.146	-0.0283	-0.38	1.284	-0.0263	-0.36	-0.5242	-0.9995	1909768	Bionet1_002851	Clc1ccc(CNC(=O)N/C=C/c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K14	compound treatment	1.21	0.0357	0.48	1.349	0.0387	0.53	0.7131	0.9989	1909769	Bionet1_002852	FC(F)(F)c1cccc(CN2C(=O)N(Cc3ccc(Cl)cc3)C(=O)C2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K15	compound treatment	1.189	0.0147	0.2	1.335	0.0247	0.34	0.3778	0.9678	1909770	Bionet1_002853	Clc1cccc(CNC(=O)N/C=C/c2ccc(Cl)c(Cl)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K16	compound treatment	1.174	-3.45E-4	0.0	1.328	0.0177	0.24	0.1672	0.6933	1909771	Bionet1_002854	CCOC(=O)c1sc2nccc(N(C)C)c2c1N/C=N/OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K17	compound treatment	1.211	0.0367	0.49	1.344	0.0337	0.46	0.6744	0.9993	1422768	Bionet1_002855	Cc1ccccc1NC(=O)OCc2cccnc2Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K18	compound treatment	1.201	0.0267	0.36	1.327	0.0167	0.23	0.4151	0.9756	1909772	Bionet1_002856	CN(C)c1ccnc(c1C#N)n2cccc2/C=N/OCc3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K19	compound treatment	1.189	0.0147	0.2	1.349	0.0387	0.53	0.5128	0.9103	1665165	Bionet1_002857	COc1ccccc1CNc2cc(CSc3ccc(Cl)cc3)nc(C)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K20	compound treatment	1.201	0.0267	0.36	1.337	0.0267	0.36	0.5116	1.0	1909773	Bionet1_002858	CN(C)c1ccnc(c1C#N)n2cccc2/C=N/OCc3cccc(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K21	compound treatment	1.211	0.0367	0.49	1.323	0.0127	0.17	0.472	0.9009	1909774	Bionet1_002859	Cc1nc(CSc2ccccc2)cc(OCc3ccc(Cl)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	K22	compound treatment	1.221	0.0467	0.63	1.356	0.0457	0.62	0.8855	1.0	1909775	Bionet1_002860	COc1ccccc1CO/N=C/c2cccn2c3nccc(N(C)C)c3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L03	compound treatment	1.183	0.00866	0.12	1.28	-0.0303	-0.41	-0.2098	-0.4883	1909776	Bionet1_002861	Clc1ccc(NC(=O)OCCNS(=O)(=O)c2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L04	compound treatment	1.151	-0.0233	-0.31	1.299	-0.0113	-0.15	-0.3318	-0.9461	1239273	Bionet1_002862	Clc1ccc(cc1)n2ccc(=O)c(n2)c3ccn(n3)C(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L05	compound treatment	1.185	0.0107	0.14	1.277	-0.0333	-0.45	-0.2196	-0.4609	1189276	Bionet1_002863	Cc1ccc(cc1)n2ncc(Cl)c(Oc3ccc4ccccc4c3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L06	compound treatment	1.175	6.55E-4	0.01	1.264	-0.0463	-0.63	-0.4404	-0.6971	1349583	Bionet1_002864	Clc1ccc(cc1)n2ccc(=O)c(n2)c3ccn(n3)C(=O)Nc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L07	compound treatment	1.185	0.0107	0.14	1.275	-0.0353	-0.48	-0.2389	-0.4753	1909777	Bionet1_002865	COc1ccc(/C=C(\C#N)/c2nc(cs2)c3ccc(Cl)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L08	compound treatment	1.128	-0.0463	-0.63	1.249	-0.0613	-0.84	-1.0333	-0.9897	1909778	Bionet1_002866	Fc1ccccc1n2ccc(n2)c3nn(ccc3=O)c4cccc(c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L09	compound treatment	1.215	0.0407	0.55	1.318	0.00768	0.1	0.4619	0.8272	1909779	Bionet1_002867	COc1ccc(cc1)c2csc(n2)/C(=C/c3ccc(OC)c(OC)c3)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L10	compound treatment	1.196	0.0217	0.29	1.276	-0.0343	-0.47	-0.1243	-0.2254	1344113	Bionet1_002868	CN(N)c1nc(cc(C)c1S(=O)(=O)c2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L11	compound treatment	1.171	-0.00334	-0.05	1.287	-0.0233	-0.32	-0.2567	-0.7994	1909780	Bionet1_002869	COc1ccc(/C=C(\C#N)/c2nc(cs2)c3ccc(F)cc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L12	compound treatment	1.141	-0.0333	-0.45	1.304	-0.00632	-0.09	-0.379	-0.8275	1909781	Bionet1_002870	COc1cccc(c1)C(=O)NN(C)c2nc(C)cc(C)c2S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L13	compound treatment	1.133	-0.0413	-0.56	1.351	0.0407	0.55	-0.0021	-0.0027	1909782	Bionet1_002871	C/C(=N\OCc1cccc(c1)C(F)(F)F)/c2sc3ncnn3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L14	compound treatment	1.191	0.0167	0.22	1.256	-0.0543	-0.74	-0.3649	-0.4714	1909783	Bionet1_002872	CN(NC(=O)c1c(F)cccc1F)c2nc(C)cc(C)c2S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L15	compound treatment	1.129	-0.0453	-0.61	1.291	-0.0193	-0.26	-0.6188	-0.9291	1909784	Bionet1_002873	Cc1c(sc2ncnn12)C(=O)CSCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L16	compound treatment	1.167	-0.00734	-0.1	1.297	-0.0133	-0.18	-0.1985	-0.9594	1909785	Bionet1_002874	Cc1ccc(Sc2[nH]c(nc2/C=N/Nc3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L17	compound treatment	1.214	0.0397	0.53	1.305	-0.00532	-0.07	0.327	0.6057	1909786	Bionet1_002875	CN(N1C(=O)C2C3CC(C=C3)C2C1=O)c4ncc(cc4Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L18	compound treatment	1.139	-0.0353	-0.48	1.278	-0.0323	-0.44	-0.6488	-0.9992	1909787	Bionet1_002876	Cc1ccc(Sc2[nH]c(nc2/C=N/c3ccc(C)c(C)c3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L19	compound treatment	1.202	0.0277	0.37	1.282	-0.0283	-0.39	-0.0092	-0.0172	1463955	Bionet1_002877	COc1ccc(NC(=O)c2ccccc2Sc3ccc(NC(=O)C)nc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L20	compound treatment	1.151	-0.0233	-0.31	1.239	-0.0713	-0.97	-0.9104	-0.8906	1909788	Bionet1_002878	CN(NC(=O)C(C)(C)C)c1nc(cc(C)c1S(=O)(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L21	compound treatment	1.157	-0.0173	-0.23	1.284	-0.0263	-0.36	-0.4192	-0.9785	1621763	Bionet1_002879	COc1ccc(cc1)C2CC(Cn3cc(C#N)c(=O)n(C)c3=O)ON2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	L22	compound treatment	1.151	-0.0233	-0.31	1.29	-0.0203	-0.28	-0.4186	-0.998	1909789	Bionet1_002880	CN(NC(=O)C1CC1)c2nc(cc(C)c2S(=O)(=O)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M03	compound treatment	1.168	-0.00634	-0.09	1.29	-0.0203	-0.28	-0.2564	-0.8843	1909790	Bionet1_002881	Cc1nc(CSc2ccccc2)cc(OCc3ccc(Cl)cc3Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M04	compound treatment	1.171	-0.00334	-0.05	1.323	0.0127	0.17	0.0904	0.5057	1909791	Bionet1_002882	CN(C)c1ccnc(c1C#N)n2cccc2/C=N/OCc3ccc(F)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M05	compound treatment	1.177	0.00266	0.04	1.325	0.0147	0.2	0.1669	0.8206	1233696	Bionet1_002883	Cc1nc(CSc2ccc(Cl)cc2)cc(NCc3ccc(Cl)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M06	compound treatment	1.231	0.0567	0.76	1.274	-0.0363	-0.5	0.1903	0.2089	1909792	Bionet1_002884	CN(C)C(=C(C#N)C#N)C/C=N/Nc1ncc(cc1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M07	compound treatment	1.155	-0.0193	-0.26	1.247	-0.0633	-0.86	-0.7951	-0.8814	1660394	Bionet1_002885	Cc1nc(CS(=O)c2ccc(Cl)cc2)cc(n1)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M08	compound treatment	1.201	0.0267	0.36	1.308	-0.00232	-0.03	0.2319	0.6425	1909793	Bionet1_002886	CN(C)C(=C(C#N)C#N)/C=C/Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M09	compound treatment	1.121	-0.0533	-0.72	1.268	-0.0423	-0.58	-0.9169	-0.994	1909794	Bionet1_002887	COc1ccc(SCc2c(Cl)n(C)nc2CSc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M10	compound treatment	1.181	0.00666	0.09	1.297	-0.0133	-0.18	-0.0649	-0.3205	1909795	Bionet1_002888	CN(C)C(=C(C#N)C#N)/C=C/Nc1ccc(I)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M11	compound treatment	1.187	0.0127	0.17	1.308	-0.00232	-0.03	0.0984	0.5666	1724480	Bionet1_002889	COc1ccc(Oc2cc(CS(=O)c3ccc(Cl)cc3)nc(C)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M12	compound treatment	1.176	0.00166	0.02	1.335	0.0247	0.34	0.2538	0.7524	1909796	Bionet1_002890	CN(C)c1ccnc(Nc2ccc(I)cc2)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M13	compound treatment	1.194	0.0197	0.27	1.336	0.0257	0.35	0.4351	0.9906	1258850	Bionet1_002891	Cc1nc(CSc2ccc(Cl)cc2)cc(NCc3ccccc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M14	compound treatment	1.191	0.0167	0.22	1.305	-0.00532	-0.07	0.1076	0.4558	1909797	Bionet1_002892	CN(C)C(=C(C#N)C#N)C/C=N/OCC(=O)N1CCN(CC1)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M15	compound treatment	1.244	0.0697	0.94	1.309	-0.00132	-0.02	0.6518	0.6935	1269012	Bionet1_002893	Cc1nc(CSc2ccc(Cl)cc2)cc(NCc3ccccc3Cl)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M16	compound treatment	1.104	-0.0703	-0.95	1.286	-0.0243	-0.33	-0.9055	-0.9008	1909798	Bionet1_002894	CN(C)C(=C(C#N)C#N)C/C=N/OCCOc1cccc(c1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M17	compound treatment	1.123	-0.0513	-0.69	1.324	0.0137	0.19	-0.3579	-0.4989	1909799	Bionet1_002895	COc1cccc(c1)n2nc(c3ccnn3c4ccccc4)c(=O)n(C)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M18	compound treatment	1.223	0.0487	0.66	1.344	0.0337	0.46	0.7889	0.9848	1909800	Bionet1_002896	Cc1ccc(CN2C(=O)/C(=N/Nc3ccc(Cl)cc3)/c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M19	compound treatment	1.197	0.0227	0.31	1.295	-0.0153	-0.21	0.0684	0.1848	1909801	Bionet1_002897	COc1cccc(c1)n2nc(c3ccnn3c4ccc(C)cc4)c(=O)n(C)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M20	compound treatment	1.215	0.0407	0.55	1.339	0.0287	0.39	0.6644	0.9863	1909802	Bionet1_002898	Cc1ccc(CN2C(=O)/C(=N/Nc3cccc(F)c3)/c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M21	compound treatment	1.212	0.0377	0.51	1.343	0.0327	0.45	0.6743	0.9979	1909803	Bionet1_002899	COc1cccc(c1)n2nc(c3ccnn3c4ccc(F)cc4)c(=O)n(C)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	M22	compound treatment	1.234	0.0597	0.8	1.356	0.0457	0.62	1.0096	0.992	1909804	Bionet1_002900	CSc1nc(/C=C/c2ccc(C)cc2)cc(\C=C/c3ccc(C)cc3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N03	compound treatment	1.148	-0.0263	-0.36	1.281	-0.0293	-0.4	-0.534	-0.9983	1909805	Bionet1_002901	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc(I)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N04	compound treatment	1.128	-0.0463	-0.63	1.233	-0.0773	-1.05	-1.1876	-0.9689	1402942	Bionet1_002902	COc1ccc(cc1)S(=O)(=O)NCc2cc(no2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N05	compound treatment	1.172	-0.00234	-0.03	1.257	-0.0533	-0.73	-0.5365	-0.7372	1909806	Bionet1_002903	CCOC(=O)NC(=O)/C(=C/Nc1ccc(I)cn1)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N06	compound treatment	1.148	-0.0263	-0.36	1.271	-0.0393	-0.54	-0.6304	-0.9801	1909807	Bionet1_002904	Clc1ccc(cc1)S(=O)(=O)NCc2cc(no2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N07	compound treatment	1.146	-0.0283	-0.38	1.278	-0.0323	-0.44	-0.582	-0.9975	1408542	Bionet1_002905	COc1ccc(NC(=O)Nc2ccc(I)cn2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N08	compound treatment	1.103	-0.0713	-0.96	1.24	-0.0703	-0.96	-1.3586	-1.0	1540478	Bionet1_002906	COc1ccc(cc1)c2cc(CNS(=O)(=O)c3ccc(F)cc3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N09	compound treatment	1.149	-0.0253	-0.34	1.297	-0.0133	-0.18	-0.3702	-0.9562	1909808	Bionet1_002907	Ic1ccc(NC(=S)NC(=O)c2ccccc2)nc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N10	compound treatment	1.098	-0.0763	-1.03	1.281	-0.0293	-0.4	-1.011	-0.9151	1732565	Bionet1_002908	Cc1cc(nc(Cl)c1S(=O)(=O)c2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N11	compound treatment	1.108	-0.0663	-0.9	1.318	0.00768	0.1	-0.5588	-0.6201	1737757	Bionet1_002909	Clc1ccc(cc1)c2cnc3ccc(I)cn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N12	compound treatment	1.17	-0.00434	-0.06	1.268	-0.0423	-0.58	-0.4495	-0.7749	1357422	Bionet1_002910	Cc1cccc(Cl)c1S(=O)(=O)NCc2cc(no2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N13	compound treatment	1.124	-0.0503	-0.68	1.274	-0.0363	-0.5	-0.8304	-0.988	1909809	Bionet1_002911	Fc1ccc(cc1)c2csc(Nc3ccc(I)cn3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N14	compound treatment	1.143	-0.0313	-0.42	1.296	-0.0143	-0.2	-0.4371	-0.9384	1909810	Bionet1_002912	Clc1ccc(cc1)c2cc(CNS(=O)(=O)c3ccc(Cl)cc3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N15	compound treatment	1.187	0.0127	0.17	1.294	-0.0163	-0.22	-0.0366	-0.1306	1731679	Bionet1_002913	CC(=O)Nc1ccc(Sc2ccccc2C(=O)NCCc3ccccc3)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N16	compound treatment	1.069	-0.105	-1.42	1.268	-0.0423	-0.58	-1.413	-0.9212	1260919	Bionet1_002914	COc1ccc(CS(=O)c2nc(C)cc(C)c2S(=O)(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N17	compound treatment	1.226	0.0517	0.7	1.313	0.00268	0.04	0.5186	0.7432	1909811	Bionet1_002915	COCCCNC(=O)c1ccccc1Sc2ccc(NC(=O)C)nc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N18	compound treatment	1.175	6.55E-4	0.01	1.294	-0.0163	-0.22	-0.1511	-0.6785	1185968	Bionet1_002916	COc1ccc(CS(=O)(=O)c2nc(C)cc(C)c2S(=O)(=O)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N19	compound treatment	1.133	-0.0413	-0.56	1.297	-0.0133	-0.18	-0.5228	-0.8913	1120589	Bionet1_002917	CC(=O)Nc1ccc(Sc2ncccc2C(=O)Nc3ccc(F)cc3)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N20	compound treatment	1.134	-0.0403	-0.54	1.287	-0.0233	-0.32	-0.6097	-0.9672	1909812	Bionet1_002918	Clc1cccc(c1Cl)S(=O)(=O)NCc2cc(no2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N21	compound treatment	1.239	0.0647	0.87	1.298	-0.0123	-0.17	0.498	0.5606	1608181	Bionet1_002919	COc1ccc(NC(=O)c2cccnc2Sc3ccc(NC(=O)C)nc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	N22	compound treatment	1.123	-0.0513	-0.69	1.281	-0.0293	-0.4	-0.7725	-0.9659	1131498	Bionet1_002920	COc1ccc(OC)c(c1)S(=O)(=O)NCc2cc(no2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O03	compound treatment	1.162	-0.0123	-0.17	1.301	-0.00932	-0.13	-0.2076	-0.9911	1909813	Bionet1_002921	CN(C)c1ccc(/C=N/NC(=O)c2[nH]c3ccccc3c2c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O04	compound treatment	1.209	0.0347	0.47	1.342	0.0317	0.43	0.6361	0.9992	1622811	Bionet1_002922	CC(C)Nc1nc(SCc2ccccc2)nc(c1C#N)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O05	compound treatment	1.176	0.00166	0.02	1.315	0.00468	0.06	0.0609	0.9009	1909814	Bionet1_002923	N/C(=C(/C#N)\C(=S)Nc1ccccc1)/N2CCN(CC2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O06	compound treatment	1.157	-0.0173	-0.23	1.329	0.0187	0.25	0.0147	0.0425	1679707	Bionet1_002924	Cc1ccc(cc1)c2nc(SCc3ccccc3)nc(NCC=C)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O07	compound treatment	1.171	-0.00334	-0.05	1.259	-0.0513	-0.7	-0.5267	-0.7511	1909815	Bionet1_002925	FC(F)(F)c1c(c2ccccc2)c3cc(Cl)ccc3n1Cc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O08	compound treatment	1.19	0.0157	0.21	1.289	-0.0213	-0.29	-0.0562	-0.1564	1635316	Bionet1_002926	CCN(CC)c1nc(SCc2ccccc2)nc(c1C#N)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O09	compound treatment	1.252	0.0777	1.05	1.375	0.0647	0.88	1.3645	0.9963	1909816	Bionet1_002927	[O-][N+](=O)c1ccc(Cn2c(C#N)c(c3ccccc3)c4cc(Cl)ccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O10	compound treatment	1.133	-0.0413	-0.56	1.313	0.00268	0.04	-0.3685	-0.6593	1909817	Bionet1_002928	CNc1nc(SCc2ccccc2Cl)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O11	compound treatment	1.167	-0.00734	-0.1	1.307	-0.00332	-0.05	-0.1021	-0.9369	1909818	Bionet1_002929	[O-][N+](=O)CCc1ccccc1C(=O)NNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O12	compound treatment	1.194	0.0197	0.27	1.346	0.0357	0.49	0.5316	0.9593	1909819	Bionet1_002930	Clc1ccccc1CSc2nc(NCC=C)c(C#N)c(n2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O13	compound treatment	1.166	-0.00834	-0.11	1.266	-0.0443	-0.6	-0.5069	-0.8246	1909820	Bionet1_002931	FC(F)(F)c1cnc(Cc2ccc(s2)C(=O)CCl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O14	compound treatment	1.163	-0.0113	-0.15	1.337	0.0267	0.36	0.1491	0.3776	1909821	Bionet1_002932	CCCNc1nc(SCc2ccccc2Cl)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O15	compound treatment	1.186	0.0117	0.16	1.298	-0.0123	-0.17	-0.0076	-0.033	1909822	Bionet1_002933	Clc1ccc(CO/N=C/CC(=O)c2cnc(s2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O16	compound treatment	1.171	-0.00334	-0.05	1.316	0.00568	0.08	0.0229	0.2552	1909823	Bionet1_002934	CC(C)Nc1nc(SCc2ccccc2Cl)nc(c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O17	compound treatment	1.204	0.0297	0.4	1.322	0.0117	0.16	0.3955	0.9185	1909824	Bionet1_002935	Cc1ccc(CO/N=C/CC(=O)c2cnc(s2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O18	compound treatment	1.201	0.0267	0.36	1.381	0.0707	0.96	0.9358	0.9097	1909825	Bionet1_002936	Cc1ccc(CN2C(=O)/C(=N/Nc3ccc(cc3)[N+](=O)[O-])/c4ccccc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O19	compound treatment	1.188	0.0137	0.18	1.266	-0.0443	-0.6	-0.2971	-0.4702	1909826	Bionet1_002937	Fc1ccc(CO/N=C/CC(=O)c2cnc(s2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O20	compound treatment	1.186	0.0117	0.16	1.345	0.0347	0.47	0.4456	0.8941	1909827	Bionet1_002938	CN1C(=O)/C(=N/Nc2c(Cl)cc(cc2Cl)C(F)(F)F)/c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O21	compound treatment	1.185	0.0107	0.14	1.336	0.0257	0.35	0.3493	0.9226	1909828	Bionet1_002939	FC(F)(F)c1cccc(N/C=C/C(=O)c2cnc(s2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	O22	compound treatment	1.248	0.0737	0.99	1.331	0.0207	0.28	0.902	0.8733	1269128	Bionet1_002940	Cc1ccc(CSc2nc(NCC=C)c(C#N)c(n2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P03	compound treatment	1.131	-0.0433	-0.58	1.289	-0.0213	-0.29	-0.619	-0.948	1483630	Bionet1_002941	CC(=O)Nc1ccc(Sc2ncccc2C(=O)Nc3cc(C)cc(C)c3)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P04	compound treatment	1.148	-0.0263	-0.36	1.239	-0.0713	-0.97	-0.939	-0.9069	1909829	Bionet1_002942	Cc1cc(C)c(c(n1)S(=O)(=O)c2ccc(Cl)cc2)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P05	compound treatment	1.16	-0.0143	-0.19	1.272	-0.0383	-0.52	-0.5063	-0.9087	1584531	Bionet1_002943	CC(=O)Nc1ccc(Sc2ccccc2C(=O)N3CCOCC3)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P06	compound treatment	1.113	-0.0613	-0.83	1.235	-0.0753	-1.03	-1.3114	-0.9943	1909830	Bionet1_002944	Cc1cc(C)c(c(Sc2ccc(Cl)cc2)n1)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P07	compound treatment	1.134	-0.0403	-0.54	1.27	-0.0403	-0.55	-0.7736	-1.0	1909831	Bionet1_002945	FC(F)(F)c1cnc(NCC(CC#N)OC(=O)c2ccco2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P08	compound treatment	1.157	-0.0173	-0.23	1.244	-0.0663	-0.9	-0.8049	-0.8617	1909832	Bionet1_002946	Cc1cc(nc(Sc2ccc(Cl)cc2)c1S(=O)(=O)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P09	compound treatment	1.044	-0.13	-1.76	1.217	-0.0933	-1.27	-2.1432	-0.9874	1909833	Bionet1_002947	COc1ccc(cc1)C2CC(Cn3cc(C(=O)C)c(=O)[nH]c3=O)ON2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P10	compound treatment	0.241	-0.933	-12.59	0.422	-0.888	-12.11	-17.469	-0.9998	1613633	Bionet1_002948	Cc1ccc(cc1)S(=O)(=O)c2c(C)cc(nc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P11	compound treatment	1.127	-0.0473	-0.64	1.27	-0.0403	-0.55	-0.8404	-0.9972	1909834	Bionet1_002949	C/C(=C/C(=O)Nc1ccc(I)cn1)/N2CCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P12	compound treatment	1.121	-0.0533	-0.72	1.197	-0.113	-1.55	-1.6015	-0.9395	1909835	Bionet1_002950	Cc1cc(nc(O)c1S(=O)(=O)Cc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P13	compound treatment	1.146	-0.0283	-0.38	1.292	-0.0183	-0.25	-0.447	-0.9787	1909836	Bionet1_002951	CC(=O)c1noc(C)c1C(=O)Nc2ccc(I)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P14	compound treatment	1.116	-0.0583	-0.79	1.262	-0.0483	-0.66	-1.0225	-0.9961	1909837	Bionet1_002952	Cc1cc(nc(Cl)c1S(=O)(=O)Cc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P15	compound treatment	1.173	-0.00134	-0.02	1.308	-0.00232	-0.03	-0.0352	-0.9653	1909838	Bionet1_002953	CO/N=C(\C)/c1noc(C)c1C(=O)Nc2ccc(I)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P16	compound treatment	1.118	-0.0563	-0.76	1.283	-0.0273	-0.37	-0.8009	-0.9461	1909839	Bionet1_002954	Cc1ccc(Sc2nc(C)cc(C)c2S(=O)(=O)c3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P17	compound treatment	1.155	-0.0193	-0.26	1.249	-0.0613	-0.84	-0.7758	-0.8857	1909840	Bionet1_002955	FC(F)(F)c1cnc(NCCN2C(=O)C3C4CC(C=C4)C3C2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P18	compound treatment	1.09	-0.0843	-1.14	1.266	-0.0443	-0.6	-1.2319	-0.9562	1233216	Bionet1_002956	Cc1ccc(cc1)S(=O)c2nc(C)cc(C)c2S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P19	compound treatment	1.185	0.0107	0.14	1.287	-0.0233	-0.32	-0.1232	-0.353	1909841	Bionet1_002957	Cc1cc(nc(SCc2ccc(Cl)c(Cl)c2)c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P20	compound treatment	1.131	-0.0433	-0.58	1.305	-0.00532	-0.07	-0.4648	-0.7888	1124505	Bionet1_002958	Sc1nnc(Cc2sc(nc2c3ccccc3)c4ccccc4)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P21	compound treatment	1.184	0.00966	0.13	1.334	0.0237	0.32	0.3205	0.9203	1909842	Bionet1_002959	FC(F)(F)c1cccc(/N=C/c2nc([nH]c2Cl)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.576	P22	compound treatment	1.231	0.0567	0.76	1.311	6.82E-4	0.01	0.547	0.7157	1227960	Bionet1_002960	CSc1nnc(Cc2sc(nc2c3ccccc3)c4ccccc4)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A03	compound treatment	1.198	0.00386	0.05	1.305	-0.0137	-0.19	-0.0956	-0.4917	1909843	Bionet1_002961	CC(OC(=O)c1cccc(c1)C(F)(F)F)c2sc3ncnn3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A04	compound treatment	1.224	0.0299	0.4	1.323	0.00427	0.06	0.326	0.8009	1909844	Bionet1_002962	Fc1ccc(NC(=O)c2ccc(=O)n(Cc3cccc(Cl)c3)c2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A05	compound treatment	1.209	0.0149	0.2	1.341	0.0223	0.3	0.3565	0.9797	1909845	Bionet1_002963	COC(=O)c1nn(c(Sc2ccc(OC)cc2)c1/C=N/O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A06	compound treatment	1.21	0.0159	0.21	1.354	0.0353	0.48	0.4914	0.9335	1909846	Bionet1_002964	FC(F)(F)c1ccc(NC(=O)c2ccc(=O)n(Cc3ccccc3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A07	compound treatment	1.163	-0.0311	-0.42	1.276	-0.0427	-0.58	-0.7091	-0.9871	1909847	Bionet1_002965	COC(=O)c1nn(c(Sc2ccc(Cl)cc2)c1/C=N/O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A08	compound treatment	1.182	-0.0121	-0.16	1.374	0.0553	0.75	0.4171	0.5408	1177140	Bionet1_002966	CN(C(=O)c1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A09	compound treatment	1.158	-0.0361	-0.49	1.264	-0.0547	-0.75	-0.8725	-0.9787	1909848	Bionet1_002967	COC(=O)c1nn(c(Sc2ccc(C)cc2)c1/C=N/O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A10	compound treatment	1.236	0.0419	0.56	1.324	0.00527	0.07	0.4501	0.7907	1408555	Bionet1_002968	Fc1cccc(Cl)c1Cn2cccc(C(=O)Nc3ccccc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A11	compound treatment	1.145	-0.0491	-0.66	1.284	-0.0347	-0.47	-0.8037	-0.9864	1909849	Bionet1_002969	COC(=O)c1nn(c(Sc2ccccc2)c1/C=N/O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A12	compound treatment	1.251	0.0569	0.77	1.325	0.00627	0.09	0.6028	0.781	1557351	Bionet1_002970	Fc1ccc(cc1)c2nn(c3ccc(Cl)cc3)c(=O)c4cc(F)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A13	compound treatment	1.171	-0.0231	-0.31	1.33	0.0113	0.15	-0.1121	-0.3222	1909850	Bionet1_002971	COC(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A14	compound treatment	1.207	0.0129	0.17	1.35	0.0313	0.43	0.4242	0.9215	1909851	Bionet1_002972	COC(=O)C(C)NC(=O)CNS(=O)(=O)c1ccc(Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A15	compound treatment	1.152	-0.0421	-0.57	1.342	0.0233	0.32	-0.1776	-0.2728	1909852	Bionet1_002973	COC(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A16	compound treatment	1.182	-0.0121	-0.16	1.371	0.0523	0.71	0.3882	0.5308	1611406	Bionet1_002974	Cc1cc(c2ccccc2)n(CC#C)c(=O)c1S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A17	compound treatment	1.187	-0.00714	-0.1	1.385	0.0663	0.9	0.5709	0.6282	1909853	Bionet1_002975	COC(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A18	compound treatment	1.248	0.0539	0.73	1.363	0.0443	0.6	0.9406	0.9958	1728286	Bionet1_002976	CCn1c(cc(C)c(c1=O)S(=O)(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A19	compound treatment	1.207	0.0129	0.17	1.256	-0.0627	-0.86	-0.4822	-0.5524	1909854	Bionet1_002977	COC(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A20	compound treatment	1.218	0.0239	0.32	1.323	0.00427	0.06	0.2688	0.8216	1909855	Bionet1_002978	Fc1ccc(C(=O)Nc2ccc(CS(=O)c3ccccc3)cc2)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A21	compound treatment	1.216	0.0219	0.29	1.347	0.0283	0.39	0.4811	0.9913	1909856	Bionet1_002979	Clc1ccccc1c2csc(NC(=O)CN3CCSCC3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	A22	compound treatment	1.209	0.0149	0.2	1.312	-0.00673	-0.09	0.0768	0.3485	1909857	Bionet1_002980	Clc1ccc(cc1)S(=O)Cc2ccc(NC(=O)c3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B03	compound treatment	1.23	0.0359	0.48	1.322	0.00327	0.04	0.3736	0.769	1909858	Bionet1_002981	COc1ccc(cc1)C(=O)n2ccc(n2)c3ccc(Oc4ncccn4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B04	compound treatment	1.171	-0.0231	-0.31	1.341	0.0223	0.3	-0.006	-0.0138	1909859	Bionet1_002982	Cc1ccc(Oc2cc(Oc3ccc(C)cc3)nc(n2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B05	compound treatment	1.26	0.0659	0.89	1.286	-0.0327	-0.45	0.3126	0.3144	1690382	Bionet1_002983	Cc1cccc(c1)C(=O)n2ccc(n2)c3ccc(Oc4ncccn4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B06	compound treatment	1.187	-0.00714	-0.1	1.33	0.0113	0.15	0.0405	0.2236	1909860	Bionet1_002984	Cc1ccc(Sc2cc(nc(n2)c3ccccc3)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B07	compound treatment	1.202	0.00786	0.11	1.325	0.00627	0.09	0.1354	0.9943	1909861	Bionet1_002985	Nc1c(cnc2nc(SCCC(=C(F)F)F)nn12)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B08	compound treatment	1.201	0.00686	0.09	1.32	0.00127	0.02	0.0777	0.8248	1909862	Bionet1_002986	Cc1ccc(Oc2cc(Sc3ccc(C)cc3)nc(n2)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B09	compound treatment	1.164	-0.0301	-0.41	1.323	0.00427	0.06	-0.2464	-0.5998	1909863	Bionet1_002987	[O-][N+](=O)c1ccc(CC(C#N)(C#N)c2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B10	compound treatment	1.192	-0.00214	-0.03	1.317	-0.00173	-0.02	-0.0371	-0.9951	1605807	Bionet1_002988	Clc1ccc(SC2CCS(=O)(=O)c3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B11	compound treatment	1.188	-0.00614	-0.08	1.345	0.0263	0.36	0.1947	0.5297	1909864	Bionet1_002989	Nc1c(cnc2nc(SCCC(=C(F)F)F)nn12)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B12	compound treatment	1.177	-0.0171	-0.23	1.297	-0.0217	-0.3	-0.373	-0.9925	1130924	Bionet1_002990	Brc1ccc(SC2CCS(=O)(=O)c3sccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B13	compound treatment	1.189	-0.00514	-0.07	1.358	0.0393	0.54	0.3296	0.6105	1909865	Bionet1_002991	Oc1ccccc1c2occc2C(=O)N/N=C/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B14	compound treatment	1.191	-0.00314	-0.04	1.299	-0.0197	-0.27	-0.2202	-0.8084	1634902	Bionet1_002992	Clc1ccc(Cl)c(SC2CCS(=O)(=O)c3sccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B15	compound treatment	1.226	0.0319	0.43	1.311	-0.00773	-0.11	0.2294	0.5183	1909866	Bionet1_002993	FC(=C(F)CCSc1ccccc1C(=O)Nc2ccc(Cl)cc2)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B16	compound treatment	1.198	0.00386	0.05	1.364	0.0453	0.62	0.4733	0.7641	1909867	Bionet1_002994	COc1cccc(Sc2cc(nc(n2)c3ccccc3)N4CCOCC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B17	compound treatment	1.195	8.62E-4	0.01	1.32	0.00127	0.02	0.0204	0.9815	1909868	Bionet1_002995	Nc1nc(Nc2ccc(Cl)cc2)sc1C(=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B18	compound treatment	1.184	-0.0101	-0.14	1.281	-0.0377	-0.51	-0.4606	-0.865	1909869	Bionet1_002996	Clc1ccc(Sc2cc(nc(n2)c3ccccc3)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B19	compound treatment	1.18	-0.0141	-0.19	1.37	0.0513	0.7	0.3595	0.4961	1732093	Bionet1_002997	Nc1nc(Nc2ccc(Cl)cc2)sc1C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B20	compound treatment	1.179	-0.0151	-0.2	1.323	0.00427	0.06	-0.1033	-0.4863	1909870	Bionet1_002998	Cc1nc2sccn2c1c3nnc(SCc4cccc(c4)C(F)(F)F)o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B21	compound treatment	1.16	-0.0341	-0.46	1.372	0.0533	0.73	0.188	0.2185	1641010	Bionet1_002999	Nc1nc(Nc2ccc(Cl)cc2)sc1C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	B22	compound treatment	1.172	-0.0221	-0.3	1.346	0.0273	0.37	0.0517	0.1085	1464512	Bionet1_003000	COc1ccc(Sc2nccc(c2C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C03	compound treatment	1.167	-0.0271	-0.37	1.306	-0.0127	-0.17	-0.3817	-0.9419	1909871	Bionet1_003001	COC(=O)c1cc(c2ccc(Cl)c(Cl)c2)n(n1)c3cccc(C)c3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C04	compound treatment	1.237	0.0429	0.58	1.328	0.00927	0.13	0.4982	0.8418	1909872	Bionet1_003002	Cc1c(Cl)cccc1NC(=O)c2ccc(c(c2)[N+](=O)[O-])n3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C05	compound treatment	1.146	-0.0481	-0.65	1.33	0.0113	0.15	-0.3506	-0.5253	1909873	Bionet1_003003	COC(=O)c1cc(c2ccc(Cl)c(Cl)c2)n(n1)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C06	compound treatment	1.221	0.0269	0.36	1.328	0.00927	0.13	0.3456	0.9005	1526532	Bionet1_003004	CNC(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C07	compound treatment	1.215	0.0209	0.28	1.365	0.0463	0.63	0.6451	0.9338	1909874	Bionet1_003005	COC(=O)c1cc(c2ccc(Cl)c(Cl)c2)n(n1)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C08	compound treatment	1.219	0.0249	0.34	1.365	0.0463	0.63	0.6833	0.9563	1909875	Bionet1_003006	COc1cccc2C=C(COc12)C(=O)Nc3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C09	compound treatment	1.228	0.0339	0.46	1.341	0.0223	0.3	0.5377	0.9803	1909876	Bionet1_003007	COC(=O)c1cc(c2ccc(Cl)c(Cl)c2)n(n1)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C10	compound treatment	1.18	-0.0141	-0.19	1.355	0.0363	0.49	0.2148	0.4053	1345448	Bionet1_003008	COc1ccc(cc1)C2C(CN3CCCCC3)C(=O)N2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C11	compound treatment	1.179	-0.0151	-0.2	1.367	0.0483	0.66	0.321	0.4658	1909877	Bionet1_003009	CN(CC(=O)Nc1nc(cs1)c2ccc(Cl)cc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C12	compound treatment	1.234	0.0399	0.54	1.348	0.0293	0.4	0.6625	0.9892	1909878	Bionet1_003010	CO/N=C(/CN1CCN(CC1)c2ccccc2F)\c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C13	compound treatment	1.236	0.0419	0.56	1.337	0.0183	0.25	0.5755	0.9323	1909879	Bionet1_003011	COC(=O)c1cc(c2ccccc2Cl)n(n1)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C14	compound treatment	1.246	0.0519	0.7	1.376	0.0573	0.78	1.0469	0.9985	1909880	Bionet1_003012	CN(C)C(=O)c1cc(c2ccc(Cl)cc2)n(n1)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C15	compound treatment	1.178	-0.0161	-0.22	1.277	-0.0417	-0.57	-0.5564	-0.9131	1909881	Bionet1_003013	COC(=O)c1cc(NC(=O)c2cccc(Cl)c2)c(=O)oc1/C=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C16	compound treatment	1.207	0.0129	0.17	1.346	0.0273	0.37	0.3856	0.9398	1909882	Bionet1_003014	Clc1ccc(cc1)C(=O)Nc2ccc(/C=C/c3nc4ccccc4s3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C17	compound treatment	1.162	-0.0321	-0.43	1.384	0.0653	0.89	0.3228	0.326	1909883	Bionet1_003015	CCOC(=O)c1cc(on1)c2oc(=O)c(NC(=O)c3ccccc3)cc2C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C18	compound treatment	1.265	0.0709	0.96	1.38	0.0613	0.84	1.2667	0.9977	1909884	Bionet1_003016	CCOC(=O)COn1c(nc2ccc(cc12)[N+](=O)[O-])c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C19	compound treatment	1.202	0.00786	0.11	1.325	0.00627	0.09	0.1354	0.9943	1909885	Bionet1_003017	COC(=O)c1cc(NC(=O)c2ccccc2)c(=O)oc1/C=C/Nc3nccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C20	compound treatment	1.184	-0.0101	-0.14	1.302	-0.0167	-0.23	-0.2581	-0.97	1909886	Bionet1_003018	Cc1ccc(cc1)S(=O)c2snnc2c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C21	compound treatment	1.229	0.0349	0.47	1.351	0.0323	0.44	0.6437	0.9994	1306022	Bionet1_003019	O=C(Nc1cc2c(=O)n(ccc2oc1=O)c3nccs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	C22	compound treatment	1.235	0.0409	0.55	1.371	0.0523	0.71	0.8938	0.9919	1909887	Bionet1_003020	Clc1ccc(NC(=O)C2=Cc3cc(Cl)ccc3OC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D03	compound treatment	1.189	-0.00514	-0.07	1.337	0.0183	0.25	0.1271	0.4917	1231570	Bionet1_003021	CC(C)(C)Nc1nc(N)c(s1)C(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D04	compound treatment	1.23	0.0359	0.48	1.321	0.00227	0.03	0.364	0.7507	1909888	Bionet1_003022	FC(F)(F)c1cccc(Sc2nccc(c2C#N)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D05	compound treatment	1.207	0.0129	0.17	1.37	0.0513	0.7	0.617	0.8566	1909889	Bionet1_003023	Nc1nc(Nc2ccc(Cl)cc2)sc1C(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D06	compound treatment	1.152	-0.0421	-0.57	1.291	-0.0277	-0.38	-0.6694	-0.9804	1384292	Bionet1_003024	Clc1ccc(cc1)c2ccnc(Oc3ccc(Cl)c(Cl)c3)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D07	compound treatment	1.215	0.0209	0.28	1.31	-0.00873	-0.12	0.1148	0.3756	1434967	Bionet1_003025	COc1ccc(OCc2cnc(OCc3ccc(Cl)c(Cl)c3)s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D08	compound treatment	1.161	-0.0331	-0.45	1.294	-0.0247	-0.34	-0.5546	-0.9903	1909890	Bionet1_003026	FC(F)(F)c1cccc(Oc2nccc(c2C#N)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D09	compound treatment	1.196	0.00186	0.03	1.364	0.0453	0.62	0.4542	0.7353	1508756	Bionet1_003027	Clc1ncc(COc2ccc(cc2)S(=O)(=O)N3CCOCC3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D10	compound treatment	1.185	-0.00914	-0.12	1.298	-0.0207	-0.28	-0.2871	-0.9308	1909891	Bionet1_003028	COc1ccc(CSc2nccc(c2C#N)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D11	compound treatment	1.184	-0.0101	-0.14	1.311	-0.00773	-0.11	-0.1713	-0.9917	1909892	Bionet1_003029	FC(=C(F)CCSc1ncccc1C(=O)Nc2ccc(F)cc2)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D12	compound treatment	1.201	0.00686	0.09	1.298	-0.0207	-0.28	-0.1345	-0.452	1909893	Bionet1_003030	Cc1ccc(cc1)S(=O)(=O)c2cc(nc(n2)c3ccccc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D13	compound treatment	1.288	0.0939	1.27	1.313	-0.00573	-0.08	0.8401	0.6622	1909894	Bionet1_003031	CCNC(=O)NNC(=O)COc1ccc2c(C(=O)OCC)c3ccccn3c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D14	compound treatment	1.223	0.0289	0.39	1.278	-0.0407	-0.56	-0.1174	-0.1731	1287949	Bionet1_003032	COc1ccc(cc1)c2c(Oc3ccc(F)cc3)c4ccc(OC)cc4s2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D15	compound treatment	1.165	-0.0291	-0.39	1.319	2.66E-4	0.0	-0.2754	-0.7005	1909895	Bionet1_003033	Clc1cc(Cl)c(N/N=C/2\CCS(=O)(=O)c3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D16	compound treatment	1.201	0.00686	0.09	1.298	-0.0207	-0.28	-0.1345	-0.452	1734112	Bionet1_003034	COc1ccc(Oc2nc(C)cc(C)c2S(=O)(=O)c3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D17	compound treatment	1.229	0.0349	0.47	1.314	-0.00473	-0.06	0.2869	0.6044	1909896	Bionet1_003035	Clc1ccc(Cl)c(N/N=C/2\CCS(=O)(=O)c3sccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D18	compound treatment	1.218	0.0239	0.32	1.346	0.0273	0.37	0.4905	0.9974	1577130	Bionet1_003036	COc1ccccc1Oc2nc(cc(C)c2S(=O)(=O)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D19	compound treatment	1.222	0.0279	0.38	1.375	0.0563	0.77	0.8083	0.9461	1909897	Bionet1_003037	Clc1ccc(N/N=C/2\CCS(=O)(=O)c3sccc23)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D20	compound treatment	1.19	-0.00414	-0.06	1.299	-0.0197	-0.27	-0.2298	-0.836	1168505	Bionet1_003038	Cc1cc(nc(Oc2ccc(cc2)C(C)(C)C)c1S(=O)(=O)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D21	compound treatment	1.196	0.00186	0.03	1.301	-0.0177	-0.24	-0.1532	-0.6303	1307758	Bionet1_003039	Cc1ccc(CSc2nc(N3CCOCC3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	D22	compound treatment	1.145	-0.0491	-0.66	1.329	0.0103	0.14	-0.3697	-0.5457	1909898	Bionet1_003040	Fc1ccc(cc1)c2ccnc(Sc3ccc(Br)cc3)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E03	compound treatment	1.169	-0.0251	-0.34	1.329	0.0103	0.14	-0.1408	-0.3838	1909899	Bionet1_003041	O=C1C2C(/C=C/c3ccccc3)N4CSCC4C2C(=O)N1c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E04	compound treatment	1.18	-0.0141	-0.19	1.33	0.0113	0.15	-0.0262	-0.1071	1164709	Bionet1_003042	Fc1ccc(cc1)c2nn(c3ccc(F)cc3)c(=O)c4cc(F)ccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E05	compound treatment	1.163	-0.0311	-0.42	1.329	0.0103	0.14	-0.198	-0.4473	1605788	Bionet1_003043	Clc1cccc(c1)C2C3C(C4CSCN24)C(=O)N(C3=O)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E06	compound treatment	1.185	-0.00914	-0.12	1.299	-0.0197	-0.27	-0.2774	-0.9374	1909900	Bionet1_003044	FC(F)(F)COC(=O)c1ccc(nc1)N2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E07	compound treatment	1.172	-0.0221	-0.3	1.232	-0.0867	-1.18	-1.0475	-0.8587	1909901	Bionet1_003045	CNc1nnc(s1)C2=NOC(CNc3ncc(cc3Cl)C(F)(F)F)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E08	compound treatment	1.217	0.0229	0.31	1.354	0.0353	0.48	0.5581	0.9769	1909902	Bionet1_003046	FC(F)(F)COC(=O)c1ccc(nc1)N2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E09	compound treatment	1.211	0.0169	0.23	1.319	2.66E-4	0.0	0.1634	0.7183	1909903	Bionet1_003047	Fc1cccc(F)c1C(=O)NCCONC(=O)c2c(F)cccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E10	compound treatment	1.215	0.0209	0.28	1.347	0.0283	0.39	0.4716	0.9881	1909904	Bionet1_003048	FC(F)(F)c1nn(c(c1OCc2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E11	compound treatment	1.188	-0.00614	-0.08	1.364	0.0453	0.62	0.3779	0.6068	1909905	Bionet1_003049	Clc1ccc(cc1)C(=O)NCCONC(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E12	compound treatment	1.16	-0.0341	-0.46	1.354	0.0353	0.48	0.0144	0.0216	1587334	Bionet1_003050	CCOC(=O)c1nn(c2ccccc2)c(=O)cc1SC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E13	compound treatment	1.166	-0.0281	-0.38	1.29	-0.0287	-0.39	-0.5455	-0.9999	1909906	Bionet1_003051	COc1ccc(cc1)N2CCN(CC2)c3ccc4nnc(n4n3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E14	compound treatment	1.201	0.00686	0.09	1.34	0.0213	0.29	0.2705	0.8887	1404442	Bionet1_003052	Cc1ccc(Sc2ccc(NC(=O)c3cccnc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E15	compound treatment	1.202	0.00786	0.11	1.332	0.0133	0.18	0.2029	0.9676	1909907	Bionet1_003053	CC(C)(C)NC(=O)C1Cc2ccccc2CN1c3ncccc3[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E16	compound treatment	1.211	0.0169	0.23	1.297	-0.0217	-0.3	-0.0487	-0.1304	1645118	Bionet1_003054	COc1ccc(COc2ccsc2C(=O)Nc3ccc(F)cc3F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E17	compound treatment	1.162	-0.0321	-0.43	1.317	-0.00173	-0.02	-0.3233	-0.7446	1655032	Bionet1_003055	COc1ccc(NC(=O)N2Cc3ccccc3CC2C(=O)NC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E18	compound treatment	1.205	0.0109	0.15	1.382	0.0633	0.86	0.7137	0.8155	1144993	Bionet1_003056	Cc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E19	compound treatment	1.213	0.0189	0.25	1.348	0.0293	0.4	0.4621	0.9764	1259874	Bionet1_003057	CC(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc3ccccc3)C1=O)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E20	compound treatment	1.251	0.0569	0.77	1.381	0.0623	0.85	1.1428	0.9987	1909908	Bionet1_003058	Cc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)C(Cl)Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E21	compound treatment	1.221	0.0269	0.36	1.357	0.0383	0.52	0.6252	0.9841	1681730	Bionet1_003059	COc1ccc(cc1)C(=O)N2Cc3ccccc3CC2C(=O)NC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	E22	compound treatment	1.231	0.0369	0.5	1.333	0.0143	0.19	0.4892	0.9161	1909909	Bionet1_003060	ClCC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F03	compound treatment	1.187	-0.00714	-0.1	1.301	-0.0177	-0.24	-0.2391	-0.9185	1467003	Bionet1_003061	Cc1ccc(CSc2nc(N3CCCCC3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F04	compound treatment	1.174	-0.0201	-0.27	1.282	-0.0367	-0.5	-0.5463	-0.9587	1909910	Bionet1_003062	Fc1ccc(cc1)c2ccnc(Sc3c(Cl)cccc3Cl)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F05	compound treatment	1.206	0.0119	0.16	1.322	0.00327	0.04	0.1447	0.8708	1909911	Bionet1_003063	Clc1ccc(cc1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F06	compound treatment	1.201	0.00686	0.09	1.279	-0.0397	-0.54	-0.3177	-0.5779	1168816	Bionet1_003064	COC(=O)c1ccccc1Sc2nccc(c2C#N)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F07	compound treatment	1.164	-0.0301	-0.41	1.295	-0.0237	-0.32	-0.5163	-0.9936	1909912	Bionet1_003065	Clc1ccc(cc1Cl)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F08	compound treatment	1.207	0.0129	0.17	1.361	0.0423	0.58	0.5302	0.8809	1909913	Bionet1_003066	Cc1ccc(C/N=C/c2ccc(O)c(Cc3c(F)cccc3Cl)c2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F09	compound treatment	1.177	-0.0171	-0.23	1.329	0.0103	0.14	-0.0645	-0.2386	1909914	Bionet1_003067	COc1cccc(c1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F10	compound treatment	1.176	-0.0181	-0.24	1.306	-0.0127	-0.17	-0.2958	-0.9859	1909915	Bionet1_003068	COc1cccc(C/N=C/c2ccc(O)c(Cc3c(F)cccc3Cl)c2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F11	compound treatment	1.224	0.0299	0.4	1.306	-0.0127	-0.17	0.1621	0.3695	1909916	Bionet1_003069	Clc1cccc(c1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F12	compound treatment	1.181	-0.0131	-0.18	1.285	-0.0337	-0.46	-0.4506	-0.9141	1909917	Bionet1_003070	Oc1ccc(/C=N/Cc2ccco2)c(O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F13	compound treatment	1.221	0.0269	0.36	1.308	-0.0107	-0.15	0.1527	0.3908	1909918	Bionet1_003071	Clc1ccc(C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F14	compound treatment	1.181	-0.0131	-0.18	1.268	-0.0507	-0.69	-0.6145	-0.8605	1909919	Bionet1_003072	COC(=O)c1ccc(N2CCN(CC(=O)c3ccc(C)cc3)CC2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F15	compound treatment	1.211	0.0169	0.23	1.357	0.0383	0.52	0.5298	0.9308	1326935	Bionet1_003073	CN1CCN(CC1)c2nc(SCc3ccc(C)cc3)nc4CCCCc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F16	compound treatment	1.202	0.00786	0.11	1.286	-0.0327	-0.45	-0.2406	-0.5245	1909920	Bionet1_003074	COC(=O)c1ccc(N2CCN(CC2)c3ccc(F)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F17	compound treatment	1.238	0.0439	0.59	1.336	0.0173	0.24	0.5849	0.9184	1909921	Bionet1_003075	FC(F)(F)c1ccccc1C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F18	compound treatment	1.191	-0.00314	-0.04	1.256	-0.0627	-0.86	-0.6348	-0.7412	1909922	Bionet1_003076	COC(=O)c1ccc(N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F19	compound treatment	1.188	-0.00614	-0.08	1.286	-0.0327	-0.45	-0.3742	-0.8242	1484324	Bionet1_003077	CC1CN(CC(C)O1)c2nc(SCc3ccc(C)cc3)nc4CCCCc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F20	compound treatment	1.222	0.0279	0.38	1.323	0.00427	0.06	0.3069	0.8069	1909923	Bionet1_003078	COC(=O)c1ccc(N2CCN(CC2)C(=O)c3ccc(OC)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F21	compound treatment	1.176	-0.0181	-0.24	1.305	-0.0137	-0.19	-0.3054	-0.9913	1502191	Bionet1_003079	Cc1ccc(CSc2nc(Oc3ccc(C)cc3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	F22	compound treatment	1.135	-0.0591	-0.8	1.314	-0.00473	-0.06	-0.6098	-0.7618	1909924	Bionet1_003080	COC(=O)c1ccc(N2CCN(CC2)c3ccc(Cl)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G03	compound treatment	1.191	-0.00314	-0.04	1.264	-0.0547	-0.75	-0.5577	-0.746	1301514	Bionet1_003081	CC(C)(C)NC(=O)C1Cc2ccccc2CN1C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G04	compound treatment	1.248	0.0539	0.73	1.347	0.0283	0.39	0.7864	0.956	1179644	Bionet1_003082	COC(=O)c1ccccc1SCC(=O)c2cc(Cl)sc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G05	compound treatment	1.185	-0.00914	-0.12	1.292	-0.0267	-0.36	-0.3449	-0.8964	1909925	Bionet1_003083	O=C(NC(COC(=O)c1cccs1)c2ccccc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G06	compound treatment	1.243	0.0489	0.66	1.325	0.00627	0.09	0.5265	0.7921	1909926	Bionet1_003084	Clc1cc(C(=O)/C=C/Nc2ccc(Br)cc2)c(Cl)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G07	compound treatment	1.145	-0.0491	-0.66	1.331	0.0123	0.17	-0.3505	-0.5126	1122031	Bionet1_003085	CNC(=O)C(NS(=O)(=O)c1ccc(Br)cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G08	compound treatment	1.167	-0.0271	-0.37	1.292	-0.0267	-0.36	-0.5167	-1.0	1909927	Bionet1_003086	FC(F)(F)Oc1ccc(N/C=C/C(=O)c2cc(Cl)sc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G09	compound treatment	1.187	-0.00714	-0.1	1.342	0.0233	0.32	0.1563	0.4713	1909928	Bionet1_003087	O=C(NC(COC(=O)Nc1ccccc1)c2ccccc2)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G10	compound treatment	1.214	0.0199	0.27	1.355	0.0363	0.49	0.5392	0.9586	1909929	Bionet1_003088	COc1ccc(N/C=C/C(=O)c2cc(Cl)sc2Cl)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G11	compound treatment	1.179	-0.0151	-0.2	1.324	0.00527	0.07	-0.0936	-0.4325	1495650	Bionet1_003089	CNC(=O)C(NC(=O)c1c(C)onc1c2c(F)cccc2Cl)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G12	compound treatment	1.235	0.0409	0.55	1.339	0.0203	0.28	0.5852	0.949	1909930	Bionet1_003090	CC(=O)Oc1ccc(cc1)C(C#N)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G13	compound treatment	1.213	0.0189	0.25	1.269	-0.0497	-0.68	-0.2996	-0.4136	1909931	Bionet1_003091	[O-][N+](=O)c1ccc(/C=N/NC(=O)C(CC2CCCCC2)n3cccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G14	compound treatment	1.214	0.0199	0.27	1.329	0.0103	0.14	0.2885	0.9542	1909932	Bionet1_003092	CS(=O)(=O)Oc1ccc(cc1)C(C#N)c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G15	compound treatment	1.238	0.0439	0.59	1.3	-0.0187	-0.26	0.2378	0.3689	1909933	Bionet1_003093	CNC(=O)C(Nc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G16	compound treatment	1.227	0.0329	0.44	1.312	-0.00673	-0.09	0.2486	0.549	1909934	Bionet1_003094	CS(=O)(=O)Oc1ccc(Cc2ncc(cc2Cl)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G17	compound treatment	1.194	-1.38E-4	0.0	1.324	0.00527	0.07	0.0495	0.6886	1279440	Bionet1_003095	Cc1ccc(NC(=O)N2Cc3ccccc3CC2C(=O)NC(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G18	compound treatment	1.227	0.0329	0.44	1.32	0.00127	0.02	0.3257	0.7341	1909935	Bionet1_003096	Clc1cc(c(Cl)s1)c2ccnc(SCc3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G19	compound treatment	1.148	-0.0461	-0.62	1.328	0.00927	0.13	-0.3508	-0.5523	1734718	Bionet1_003097	CC(C)(C)NC(=O)C1Cc2ccccc2CN1C(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G20	compound treatment	1.198	0.00386	0.05	1.331	0.0123	0.17	0.1551	0.8854	1909936	Bionet1_003098	FC(F)(F)c1cnc(Cc2ccc(Oc3ccc(Cl)nn3)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G21	compound treatment	1.22	0.0259	0.35	1.393	0.0743	1.01	0.9628	0.8989	1176928	Bionet1_003099	CC(C)(C)NC(=O)C1Cc2ccccc2CN1C(=O)Nc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	G22	compound treatment	1.219	0.0249	0.34	1.389	0.0703	0.96	0.9147	0.901	1909937	Bionet1_003100	Clc1ccc(cc1)C(=O)/C=C/c2ccc(o2)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H03	compound treatment	1.178	-0.0161	-0.22	1.304	-0.0147	-0.2	-0.296	-0.9992	1418682	Bionet1_003101	Cc1ccc(CSc2nc(Oc3ccc(Cl)cc3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H04	compound treatment	1.121	-0.0731	-0.99	1.287	-0.0317	-0.43	-1.0037	-0.9316	1909938	Bionet1_003102	COC(=O)c1ccc(N2CCN(CC2)c3ncccc3[N+](=O)[O-])c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H05	compound treatment	1.224	0.0299	0.4	1.331	0.0123	0.17	0.4031	0.9242	1363624	Bionet1_003103	Cc1ccc(CSc2nc(Oc3cccc(Cl)c3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H06	compound treatment	1.168	-0.0261	-0.35	1.301	-0.0177	-0.24	-0.4203	-0.9831	1909939	Bionet1_003104	COC(=O)c1ccc(N2CCN(CC2)c3c(C)cccc3C)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H07	compound treatment	1.209	0.0149	0.2	1.322	0.00327	0.04	0.1733	0.8436	1467517	Bionet1_003105	Cc1cccc(C)c1OC(=O)CN(c2ccccc2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H08	compound treatment	1.195	8.62E-4	0.01	1.279	-0.0397	-0.54	-0.3749	-0.6918	1909940	Bionet1_003106	COC(=O)c1ccc(N2CCN(CC2)C(=O)c3cccs3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H09	compound treatment	1.203	0.00886	0.12	1.309	-0.00973	-0.13	-0.0093	-0.0522	1909941	Bionet1_003107	Cc1ccc(CSc2nc(Sc3ccccc3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H10	compound treatment	1.204	0.00986	0.13	1.302	-0.0167	-0.23	-0.0673	-0.2547	1212804	Bionet1_003108	COc1ccc(S(=O)N2CCN(Cc3ccccc3)CC2)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H11	compound treatment	1.175	-0.0191	-0.26	1.346	0.0273	0.37	0.0804	0.1775	1909942	Bionet1_003109	Cc1ccc(CSc2nc(Sc3cccc(C)c3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H12	compound treatment	1.191	-0.00314	-0.04	1.299	-0.0197	-0.27	-0.2202	-0.8084	1238261	Bionet1_003110	COc1ccc(S(=O)N2CCN(CC2)c3ccccc3F)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H13	compound treatment	1.178	-0.0161	-0.22	1.363	0.0443	0.6	0.2729	0.4253	1909943	Bionet1_003111	COC(=O)CSc1nc(SCc2ccc(C)cc2)nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H14	compound treatment	1.194	-1.38E-4	0.0	1.352	0.0333	0.45	0.3195	0.7042	1403051	Bionet1_003112	COc1ccc(S(=O)N2CCN(CC2)c3ccccn3)c(OC)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H15	compound treatment	1.182	-0.0121	-0.16	1.358	0.0393	0.54	0.2628	0.4694	1909944	Bionet1_003113	CSc1nc(Sc2ccc(Br)cc2)c3sccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H16	compound treatment	1.153	-0.0411	-0.55	1.307	-0.0117	-0.16	-0.5056	-0.8753	1177814	Bionet1_003114	Brc1ccc(COc2ccc3c(C#N)c4ccccn4c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H17	compound treatment	1.17	-0.0241	-0.33	1.349	0.0303	0.41	0.0616	0.1171	1909945	Bionet1_003115	Cc1ccc(CSc2nc(Sc3ccccc3N)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H18	compound treatment	1.186	-0.00814	-0.11	1.299	-0.0197	-0.27	-0.2679	-0.9218	1585493	Bionet1_003116	CSc1nc(Oc2ccc(F)cc2)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H19	compound treatment	1.21	0.0159	0.21	1.299	-0.0197	-0.27	-0.039	-0.1133	1728605	Bionet1_003117	CCOC(=O)c1cnc(SC)nc1Nc2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H20	compound treatment	1.178	-0.0161	-0.22	1.267	-0.0517	-0.71	-0.6528	-0.8842	1909946	Bionet1_003118	FC(F)(F)c1cccc(c1)C(=O)OC2CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H21	compound treatment	1.227	0.0329	0.44	1.347	0.0283	0.39	0.586	0.9976	1909947	Bionet1_003119	CCOC(=O)c1cnc(SC)nc1Nc2ccc(cc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	H22	compound treatment	1.17	-0.0241	-0.33	1.357	0.0383	0.52	0.1387	0.2255	1483542	Bionet1_003120	Clc1ccc(C(=O)OC2CCS(=O)(=O)c3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I03	compound treatment	1.18	-0.0141	-0.19	1.351	0.0323	0.44	0.1763	0.3675	1342233	Bionet1_003121	COC(=O)C(NS(=O)(=O)c1ccc(Br)cc1)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I04	compound treatment	1.162	-0.0321	-0.43	1.317	-0.00173	-0.02	-0.3233	-0.7446	1909948	Bionet1_003122	[O-][N+](=O)c1ccc(cc1)/C(=N/Nc2ccccc2)/C=C/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I05	compound treatment	1.189	-0.00514	-0.07	1.315	-0.00373	-0.05	-0.085	-0.9885	1909949	Bionet1_003123	FC(F)(F)c1cccc(CC(=O)OCC(=O)Nc2sccc2C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I06	compound treatment	1.219	0.0249	0.34	1.292	-0.0267	-0.36	-0.0206	-0.0416	1909950	Bionet1_003124	Cc1ccccc1CSc2nccc(n2)c3cc(Cl)sc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I07	compound treatment	1.14	-0.0541	-0.73	1.298	-0.0207	-0.28	-0.7164	-0.9147	1909951	Bionet1_003125	FC(F)(F)c1cnc(SCC(=O)Nc2sccc2C#N)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I08	compound treatment	1.216	0.0219	0.29	1.34	0.0213	0.29	0.4136	1.0	1909952	Bionet1_003126	Cc1ccc(CSc2nccc(n2)c3cc(Cl)sc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I09	compound treatment	1.184	-0.0101	-0.14	1.318	-7.34E-4	-0.01	-0.1038	-0.7568	1711260	Bionet1_003127	COC(=O)c1ccsc1n2cc(C#N)c(=O)n(Cc3ccc(OC)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I10	compound treatment	1.206	0.0119	0.16	1.361	0.0423	0.58	0.5207	0.8705	1909953	Bionet1_003128	[O-][N+](=O)c1cccnc1n2ncn(c3ccc(Br)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I11	compound treatment	1.243	0.0489	0.66	1.317	-0.00173	-0.02	0.4494	0.6813	1909954	Bionet1_003129	Cc1ccc(c2ccc(cc2)S(=O)(=O)C)n1c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I12	compound treatment	1.159	-0.0351	-0.47	1.339	0.0203	0.28	-0.1398	-0.2547	1909955	Bionet1_003130	Cc1cc(C)c(Cn2ncn(c3ccc(Br)cc3)c2=O)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I13	compound treatment	1.225	0.0309	0.42	1.303	-0.0157	-0.21	0.1427	0.3047	1909956	Bionet1_003131	COc1ccc(Oc2nc(cc(c2C#N)C(F)(F)F)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I14	compound treatment	1.214	0.0199	0.27	1.315	-0.00373	-0.05	0.1535	0.5627	1595238	Bionet1_003132	COc1cccc(Cn2ncn(c3ccc(Br)cc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I15	compound treatment	1.171	-0.0231	-0.31	1.38	0.0613	0.84	0.37	0.4149	1909957	Bionet1_003133	FC(F)(F)c1cc(nc(Sc2ccc(Cl)cc2)c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I16	compound treatment	1.224	0.0299	0.4	1.343	0.0243	0.33	0.5189	0.9952	1909958	Bionet1_003134	[O-][N+](=O)c1cc(cc([N+](=O)[O-])c1n2ncn(c3ccccn3)c2=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I17	compound treatment	1.167	-0.0271	-0.37	1.334	0.0153	0.21	-0.1117	-0.2652	1909959	Bionet1_003135	FC(F)(F)c1cc(nc(Oc2ccc(Cl)cc2)c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I18	compound treatment	1.238	0.0439	0.59	1.267	-0.0517	-0.71	-0.0804	-0.0873	1909960	Bionet1_003136	Fc1ccc(N/N=C(\C=C\c2c(F)cccc2Cl)/c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I19	compound treatment	1.18	-0.0141	-0.19	1.375	0.0563	0.77	0.4077	0.5156	1909961	Bionet1_003137	FC(F)(F)c1cc(nc(Oc2ccc3ccccc3c2)c1C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I20	compound treatment	1.232	0.0379	0.51	1.372	0.0533	0.73	0.8748	0.9852	1448486	Bionet1_003138	COC(=O)Cc1c(sc(c1C(=O)OC)n2c(C)ccc2C)C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I21	compound treatment	1.203	0.00886	0.12	1.412	0.0933	1.27	0.9839	0.7702	1909962	Bionet1_003139	FC(F)(F)c1cc(nc(Sc2ccccc2)c1C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	I22	compound treatment	1.223	0.0289	0.39	1.351	0.0323	0.44	0.5865	0.9981	1909963	Bionet1_003140	Fc1ccc(cc1)N2N=C(CC2c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J03	compound treatment	1.205	0.0109	0.15	1.347	0.0283	0.39	0.3762	0.9122	1909964	Bionet1_003141	CCOC(=O)c1cnc(SC)nc1Nc2cc(ccc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J04	compound treatment	1.197	0.00286	0.04	1.296	-0.0227	-0.31	-0.1919	-0.6143	1909965	Bionet1_003142	CO/N=C(/CNC(=O)c1ccc(Cl)cc1Cl)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J05	compound treatment	1.187	-0.00714	-0.1	1.326	0.00727	0.1	0.002	0.0143	1614077	Bionet1_003143	CCOC(=O)c1cnc(SC)nc1N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J06	compound treatment	1.189	-0.00514	-0.07	1.273	-0.0457	-0.62	-0.49	-0.7809	1620999	Bionet1_003144	Fc1ccccc1N2CCN(Cc3cc(on3)c4ccc(Cl)cc4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J07	compound treatment	1.201	0.00686	0.09	1.285	-0.0337	-0.46	-0.2598	-0.5537	1909966	Bionet1_003145	Cn1nc(c2cc(sc12)c3nnc(S)n3c4ccccc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J08	compound treatment	1.185	-0.00914	-0.12	1.276	-0.0427	-0.58	-0.4992	-0.8381	1909967	Bionet1_003146	Clc1ccc(Cl)c(OCc2cc(on2)c3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J09	compound treatment	1.19	-0.00414	-0.06	1.31	-0.00873	-0.12	-0.1237	-0.9404	1909968	Bionet1_003147	CSc1nnc(c2cc3c(nn(C)c3s2)C(F)(F)F)n1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J10	compound treatment	1.185	-0.00914	-0.12	1.281	-0.0377	-0.51	-0.451	-0.8524	1725628	Bionet1_003148	Fc1ccccc1N2CCN(Cc3cc(on3)c4ccccc4Cl)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J11	compound treatment	1.221	0.0269	0.36	1.321	0.00227	0.03	0.2781	0.7646	1909969	Bionet1_003149	Cc1ccc(cc1)c2nnc(o2)c3cc4c(nn(C)c4s3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J12	compound treatment	1.189	-0.00514	-0.07	1.275	-0.0437	-0.6	-0.4707	-0.784	1909970	Bionet1_003150	[O-][N+](=O)c1cc(/C=N\OC(=O)c2c(F)cccc2F)ccc1N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J13	compound treatment	1.226	0.0319	0.43	1.35	0.0313	0.43	0.6054	1.0	1909971	Bionet1_003151	COc1cccc(c1)c2nnc(o2)c3cc4c(nn(C)c4s3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J14	compound treatment	1.229	0.0349	0.47	1.285	-0.0337	-0.46	0.0073	0.0111	1909972	Bionet1_003152	Cc1ccc(cc1)C(=O)O/N=C\c2ccc(N3CCCCC3)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J15	compound treatment	1.19	-0.00414	-0.06	1.308	-0.0107	-0.15	-0.143	-0.9127	1909973	Bionet1_003153	Cn1nc(c2cc(sc12)c3nnc(SCC=C)n3C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J16	compound treatment	1.19	-0.00414	-0.06	1.272	-0.0467	-0.64	-0.4901	-0.7661	1909974	Bionet1_003154	[O-][N+](=O)c1cc(/C=N\OC(=O)c2cccc(Cl)c2)ccc1N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J17	compound treatment	1.207	0.0129	0.17	1.332	0.0133	0.18	0.2506	0.9998	1909975	Bionet1_003155	Cn1nc(c2cc(sc12)c3nnc(SCC#C)n3C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J18	compound treatment	1.137	-0.0571	-0.77	1.293	-0.0257	-0.35	-0.7932	-0.9365	1909976	Bionet1_003156	[O-][N+](=O)c1cc(/C=N/OC(=O)c2cccs2)ccc1N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J19	compound treatment	1.226	0.0319	0.43	1.308	-0.0107	-0.15	0.2004	0.4414	1909977	Bionet1_003157	CCCCSc1nnc(c2cc3c(nn(C)c3s2)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J20	compound treatment	1.175	-0.0191	-0.26	1.278	-0.0407	-0.56	-0.5753	-0.9393	1909978	Bionet1_003158	FC(F)(F)c1cccc(OCc2cc(on2)c3ccc(Cl)c(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J21	compound treatment	1.219	0.0249	0.34	1.391	0.0723	0.99	0.934	0.8972	1742697	Bionet1_003159	Clc1ccc(cc1)C(=O)Nc2ccc(oc2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	J22	compound treatment	1.185	-0.00914	-0.12	1.281	-0.0377	-0.51	-0.451	-0.8524	1644727	Bionet1_003160	COC(=O)c1sccc1OCc2cc(on2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K03	compound treatment	1.179	-0.0151	-0.2	1.307	-0.0117	-0.16	-0.2575	-0.9927	1565675	Bionet1_003161	COC(=O)c1cc(C#N)c(NCc2cc(no2)c3ccc(Cl)cc3)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K04	compound treatment	1.188	-0.00614	-0.08	1.319	2.66E-4	0.0	-0.056	-0.6754	1909979	Bionet1_003162	COc1cccc(c1)C2=NN(C(C2)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K05	compound treatment	1.142	-0.0521	-0.7	1.301	-0.0177	-0.24	-0.6684	-0.8986	1909980	Bionet1_003163	COc1ccc(cc1)c2cc(CNc3nc(C)c(cc3C#N)C(=O)C)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K06	compound treatment	1.197	0.00286	0.04	1.361	0.0423	0.58	0.4349	0.7528	1909981	Bionet1_003164	Clc1ccc(cc1)N2N=C(CC2c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K07	compound treatment	1.151	-0.0431	-0.58	1.31	-0.00873	-0.12	-0.4957	-0.8345	1535204	Bionet1_003165	Cc1ccc(c2ccc(cc2)S(=O)(=O)C)n1c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K08	compound treatment	1.233	0.0389	0.52	1.341	0.0223	0.3	0.5854	0.9663	1408999	Bionet1_003166	COc1ccc(cc1)n2ccc(=O)c(Cc3c(Cl)cccc3Cl)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K09	compound treatment	1.219	0.0249	0.34	1.278	-0.0407	-0.56	-0.1556	-0.2398	1909982	Bionet1_003167	Fc1ccc(cc1)C(=O)Nc2ccc(/C=C/c3nc4ccccc4o3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K10	compound treatment	1.216	0.0219	0.29	1.336	0.0173	0.24	0.375	0.9938	1909983	Bionet1_003168	[O-][N+](=O)c1cccc(c1)N2N=C(CC2c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K11	compound treatment	1.2	0.00586	0.08	1.36	0.0413	0.56	0.4538	0.7986	1909984	Bionet1_003169	FC(F)(F)c1cc(nc(N2CCOCC2)c1C#N)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K12	compound treatment	1.235	0.0409	0.55	1.3	-0.0187	-0.26	0.2092	0.3443	1211145	Bionet1_003170	Clc1ccc(cc1)C2CN(CC2C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K13	compound treatment	1.168	-0.0261	-0.35	1.317	-0.00173	-0.02	-0.2661	-0.7528	1909985	Bionet1_003171	CCN(CC)c1nc(cc(c1C#N)C(F)(F)F)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K14	compound treatment	1.256	0.0619	0.83	1.348	0.0293	0.4	0.8723	0.943	1712611	Bionet1_003172	Fc1ccccc1C2CN(CC2C(=O)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K15	compound treatment	1.189	-0.00514	-0.07	1.313	-0.00573	-0.08	-0.1043	-0.9982	1909986	Bionet1_003173	COc1ccc(cc1)c2cc(CNC(=O)CN(C)Cc3ccccc3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K16	compound treatment	1.221	0.0269	0.36	1.35	0.0313	0.43	0.5577	0.9967	1617843	Bionet1_003174	COc1cccc(c1)C(=O)C2CN(CC2c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K17	compound treatment	1.211	0.0169	0.23	1.325	0.00627	0.09	0.2213	0.9106	1909987	Bionet1_003175	FC(F)(F)c1cc(nc(Sc2ccccc2)c1C#N)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K18	compound treatment	1.22	0.0259	0.35	1.316	-0.00273	-0.04	0.2203	0.628	1223140	Bionet1_003176	COc1cc(NC(=S)NCc2cccc(Cl)c2)c(C#N)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K19	compound treatment	1.177	-0.0171	-0.23	1.347	0.0283	0.39	0.1091	0.2427	1909988	Bionet1_003177	Cc1ccc(Sc2nc(nnc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K20	compound treatment	1.236	0.0419	0.56	1.365	0.0463	0.63	0.8455	0.9985	1521688	Bionet1_003178	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1c3ccc(cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K21	compound treatment	1.188	-0.00614	-0.08	1.346	0.0273	0.37	0.2044	0.5365	1909989	Bionet1_003179	Clc1ccc(Oc2nc(nnc2c3ccccc3)c4ccccc4)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	K22	compound treatment	1.221	0.0269	0.36	1.374	0.0553	0.75	0.7891	0.9437	1130619	Bionet1_003180	CN(C)c1ccc(cc1)n2ccc(=O)c(Cc3c(Cl)cccc3Cl)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L03	compound treatment	1.219	0.0249	0.34	1.296	-0.0227	-0.31	0.018	0.0393	1389763	Bionet1_003181	COCc1cc(nc(SCc2ccc(Cl)cc2)n1)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L04	compound treatment	1.192	-0.00214	-0.03	1.315	-0.00373	-0.05	-0.0564	-0.9638	1909990	Bionet1_003182	[O-][N+](=O)c1cc(/C=N\OC(=O)c2ccc(F)cc2)ccc1N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L05	compound treatment	1.206	0.0119	0.16	1.297	-0.0217	-0.3	-0.0964	-0.2862	1909991	Bionet1_003183	Cc1ccc(cc1)c2nnc(o2)c3c(Cl)n(C)nc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L06	compound treatment	1.198	0.00386	0.05	1.289	-0.0297	-0.41	-0.2499	-0.6112	1909992	Bionet1_003184	Cc1ccc(cc1)C(=O)O/N=C\c2ccc(N3CCOCC3)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L07	compound treatment	1.19	-0.00414	-0.06	1.279	-0.0397	-0.54	-0.4226	-0.7759	1909993	Bionet1_003185	Cn1nc(c(c1Cl)c2nnc(o2)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L08	compound treatment	1.163	-0.0311	-0.42	1.283	-0.0357	-0.49	-0.6416	-0.9973	1909994	Bionet1_003186	[O-][N+](=O)c1cc(/C=N\OC(=O)c2ccccc2Cl)ccc1N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L09	compound treatment	1.222	0.0279	0.38	1.318	-7.34E-4	-0.01	0.2587	0.688	1909995	Bionet1_003187	COc1ccc(cc1)C(=O)OCc2cc(on2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L10	compound treatment	1.207	0.0129	0.17	1.253	-0.0657	-0.9	-0.5111	-0.5598	1909996	Bionet1_003188	Clc1ccc(cc1)c2ccnc(Sc3cc(Cl)ccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L11	compound treatment	1.181	-0.0131	-0.18	1.337	0.0183	0.25	0.0508	0.1662	1172634	Bionet1_003189	Clc1ccc(cc1)c2cc(COC(=O)c3ccc(Cl)cc3Cl)no2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L12	compound treatment	1.154	-0.0401	-0.54	1.316	-0.00273	-0.04	-0.4092	-0.754	1909997	Bionet1_003190	Clc1ccc(cc1)c2ccnc(Oc3cc(Cl)cc(Cl)c3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L13	compound treatment	1.161	-0.0331	-0.45	1.359	0.0403	0.55	0.0722	0.1019	1909998	Bionet1_003191	FC(F)(F)c1cccc(c1)C(=O)OCc2cc(on2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L14	compound treatment	1.215	0.0209	0.28	1.277	-0.0417	-0.57	-0.2034	-0.3204	1909999	Bionet1_003192	Clc1ccc(cc1)c2ccnc(Oc3cc(Cl)ccc3Cl)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L15	compound treatment	1.136	-0.0581	-0.78	1.314	-0.00473	-0.06	-0.6002	-0.7627	1910000	Bionet1_003193	Fc1cccc(F)c1C(=O)OCc2cc(on2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L16	compound treatment	1.188	-0.00614	-0.08	1.286	-0.0327	-0.45	-0.3742	-0.8242	1910001	Bionet1_003194	COc1cccc(Sc2nc(ncc2S(=O)(=O)C)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L17	compound treatment	1.228	0.0339	0.46	1.297	-0.0217	-0.3	0.1135	0.2084	1910002	Bionet1_003195	Clc1ccc(cc1Cl)c2cc(COC(=O)c3cccs3)no2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L18	compound treatment	1.134	-0.0601	-0.81	1.282	-0.0367	-0.5	-0.9279	-0.9731	1910003	Bionet1_003196	CS(=O)(=O)c1cnc(nc1Oc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L19	compound treatment	1.212	0.0179	0.24	1.284	-0.0347	-0.47	-0.1645	-0.3096	1552964	Bionet1_003197	CS(=O)(=O)N(CC(=O)N1CCCCC1)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L20	compound treatment	1.18	-0.0141	-0.19	1.264	-0.0547	-0.75	-0.6626	-0.8602	1910004	Bionet1_003198	CS(=O)(=O)c1cnc(nc1Sc2ccc(F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L21	compound treatment	1.175	-0.0191	-0.26	1.334	0.0153	0.21	-0.0354	-0.1066	1661730	Bionet1_003199	COc1cc(N(CC(=O)N2CCOCC2)S(=O)(=O)C)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	L22	compound treatment	1.183	-0.0111	-0.15	1.3	-0.0187	-0.26	-0.2869	-0.968	1910005	Bionet1_003200	Cc1ccc(Sc2nc(ncc2S(=O)(=O)C)c3ccccc3)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M03	compound treatment	1.212	0.0179	0.24	1.323	0.00427	0.06	0.2115	0.8533	1910006	Bionet1_003201	Fc1ccc(Sc2nc(nnc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M04	compound treatment	1.243	0.0489	0.66	1.356	0.0373	0.51	0.8254	0.9917	1421809	Bionet1_003202	COc1ccc(Cn2ccc(=O)c(Cc3c(Cl)cccc3Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M05	compound treatment	1.196	0.00186	0.03	1.315	-0.00373	-0.05	-0.0182	-0.3212	1910007	Bionet1_003203	N#Cc1ccc(Oc2nc(nnc2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M06	compound treatment	1.227	0.0329	0.44	1.283	-0.0357	-0.49	-0.0311	-0.0472	1269073	Bionet1_003204	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1Cc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M07	compound treatment	1.132	-0.0621	-0.84	1.269	-0.0497	-0.68	-1.0723	-0.9945	1910008	Bionet1_003205	FC(F)(F)c1cccc(Oc2nc(nnc2c3ccccc3)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M08	compound treatment	1.266	0.0719	0.97	1.319	2.66E-4	0.0	0.6881	0.7098	1910009	Bionet1_003206	CCOC(=O)c1c2ccc(OCc3ccc(cc3)[N+](=O)[O-])cc2n4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M09	compound treatment	1.15	-0.0441	-0.6	1.294	-0.0247	-0.34	-0.6595	-0.9638	1910010	Bionet1_003207	[O-][N+](=O)c1ccc(CSc2ccsc2C(=O)Nc3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M10	compound treatment	1.2	0.00586	0.08	1.311	-0.00773	-0.11	-0.0186	-0.1415	1308969	Bionet1_003208	CCOC(=O)c1c2ccc(OCc3ccc(F)cc3)cc2n4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M11	compound treatment	1.169	-0.0251	-0.34	1.302	-0.0167	-0.23	-0.4012	-0.9814	1910011	Bionet1_003209	Cc1nn(c(N)c1c2cccc(c2)C(F)(F)F)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M12	compound treatment	1.223	0.0289	0.39	1.345	0.0263	0.36	0.5286	0.9991	1375905	Bionet1_003210	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1Cc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M13	compound treatment	1.172	-0.0221	-0.3	1.326	0.00727	0.1	-0.1411	-0.4485	1910012	Bionet1_003211	Clc1ccc(Cn2cccc(c3nnc(SCC=C)o3)c2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M14	compound treatment	1.223	0.0289	0.39	1.353	0.0343	0.47	0.6057	0.9959	1401614	Bionet1_003212	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1Cc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M15	compound treatment	1.259	0.0649	0.88	1.3	-0.0187	-0.26	0.4381	0.4806	1175142	Bionet1_003213	OC(CN1CCN(CC1)c2ccccc2F)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M16	compound treatment	1.162	-0.0321	-0.43	1.298	-0.0207	-0.28	-0.5065	-0.9785	1736523	Bionet1_003214	Cc1ccc(Cn2ccc(=O)c(Cc3c(Cl)cccc3Cl)c2C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M17	compound treatment	1.168	-0.0261	-0.35	1.314	-0.00473	-0.06	-0.295	-0.8229	1910013	Bionet1_003215	OC(CN1CCN(CC1)c2cccc(Cl)c2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M18	compound treatment	1.282	0.0879	1.19	1.339	0.0203	0.28	1.0336	0.8492	1631313	Bionet1_003216	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1CCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M19	compound treatment	1.21	0.0159	0.21	1.292	-0.0267	-0.36	-0.1065	-0.2519	1910014	Bionet1_003217	Cc1nn(C)c(Oc2cccc(Cl)c2)c1C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M20	compound treatment	1.229	0.0349	0.47	1.352	0.0333	0.45	0.6533	0.9998	1219302	Bionet1_003218	Cc1c(Cc2c(Cl)cccc2Cl)c(=O)ccn1Cc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M21	compound treatment	1.218	0.0239	0.32	1.373	0.0543	0.74	0.7509	0.9305	1910015	Bionet1_003219	Fc1ccc(cc1)N2CCN(CC3CN4C(=N3)c5ccccc5NC4=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	M22	compound treatment	1.246	0.0519	0.7	1.403	0.0843	1.15	1.3073	0.9717	1660617	Bionet1_003220	CC(c1ccccc1)n2ccc(=O)c(Cc3c(Cl)cccc3Cl)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N03	compound treatment	1.16	-0.0341	-0.46	1.281	-0.0377	-0.51	-0.6895	-0.9985	1910016	Bionet1_003221	Cc1nc(nc2CCCc21)S(=O)(=O)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N04	compound treatment	1.144	-0.0501	-0.68	1.241	-0.0777	-1.06	-1.2278	-0.9765	1910017	Bionet1_003222	CSc1nc(Oc2ccc3ccccc3c2)c4cnn(c5ccccc5)c4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N05	compound treatment	1.197	0.00286	0.04	1.3	-0.0187	-0.26	-0.1533	-0.5935	1910018	Bionet1_003223	Clc1ccc(C(=O)OCc2cc(on2)c3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N06	compound treatment	1.17	-0.0241	-0.33	1.285	-0.0337	-0.46	-0.5555	-0.9857	1910019	Bionet1_003224	COc1ccc(CSc2ncc3CSc4ccc(C)cc4-c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N07	compound treatment	1.202	0.00786	0.11	1.285	-0.0337	-0.46	-0.2503	-0.5302	1910020	Bionet1_003225	FC(F)(F)c1cccc(c1)C(=O)OCc2cc(on2)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N08	compound treatment	1.151	-0.0431	-0.58	1.268	-0.0507	-0.69	-0.9007	-0.9963	1910021	Bionet1_003226	Cc1ccc2SCc3cnc(SCc4cccc(c4)[N+](=O)[O-])nc3-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N09	compound treatment	1.193	-0.00114	-0.02	1.342	0.0233	0.32	0.2135	0.6721	1910022	Bionet1_003227	Clc1ccc(NC(=O)OCc2cc(on2)c3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N10	compound treatment	1.139	-0.0551	-0.74	1.298	-0.0207	-0.28	-0.7259	-0.9122	1910023	Bionet1_003228	Cc1ccc2SCc3cnc(SCc4ccc(cc4)C(C)(C)C)nc3-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N11	compound treatment	1.162	-0.0321	-0.43	1.319	2.66E-4	0.0	-0.304	-0.7012	1910024	Bionet1_003229	Clc1ccc(NC(=O)OCc2cc(on2)c3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N12	compound treatment	1.19	-0.00414	-0.06	1.255	-0.0637	-0.87	-0.654	-0.751	1910025	Bionet1_003230	Cc1cccc(CSc2ncc3CSc4ccc(C)cc4-c3n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N13	compound treatment	1.132	-0.0621	-0.84	1.288	-0.0307	-0.42	-0.8891	-0.9487	1910026	Bionet1_003231	Fc1ccc(cc1)C(=O)OCc2cc(on2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N14	compound treatment	1.188	-0.00614	-0.08	1.303	-0.0157	-0.21	-0.2103	-0.9143	1910027	Bionet1_003232	Cc1ccc2SCc3cnc(SCc4ccc(Cl)cc4)nc3-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N15	compound treatment	1.219	0.0249	0.34	1.322	0.00327	0.04	0.2687	0.794	1910028	Bionet1_003233	Cc1ccc(NC(=O)OCc2cc(on2)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N16	compound treatment	1.125	-0.0691	-0.93	1.292	-0.0267	-0.36	-0.9173	-0.916	1910029	Bionet1_003234	CSc1nc(Sc2ccc(C)cc2)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N17	compound treatment	1.247	0.0529	0.71	1.31	-0.00873	-0.12	0.4201	0.581	1910030	Bionet1_003235	Clc1ccc(NC(=O)OCc2cc(on2)c3ccc(Cl)c(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N18	compound treatment	1.177	-0.0171	-0.23	1.299	-0.0197	-0.27	-0.3538	-0.9971	1910031	Bionet1_003236	CSc1nc(Sc2ccc(F)cc2)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N19	compound treatment	1.17	-0.0241	-0.33	1.326	0.00727	0.1	-0.1602	-0.4706	1910032	Bionet1_003237	Clc1ccc(NC(=O)OCc2cc(on2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N20	compound treatment	1.138	-0.0561	-0.76	1.286	-0.0327	-0.45	-0.8511	-0.9682	1910033	Bionet1_003238	CSc1nc(Sc2ccccc2)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N21	compound treatment	1.24	0.0459	0.62	1.317	-0.00173	-0.02	0.4208	0.6796	1238924	Bionet1_003239	Cc1cccc(C)c1OC(=O)CN(c2ccc(Cl)cc2)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	N22	compound treatment	1.142	-0.0521	-0.7	1.277	-0.0417	-0.57	-0.8998	-0.9945	1910034	Bionet1_003240	CSc1nc(Sc2cccc(Cl)c2)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O03	compound treatment	1.189	-0.00514	-0.07	1.296	-0.0227	-0.31	-0.2682	-0.8444	1910035	Bionet1_003241	Fc1ccccc1N2CCN(CC3CN4C(=N3)c5ccccc5NC4=O)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O04	compound treatment	1.201	0.00686	0.09	1.37	0.0513	0.7	0.5598	0.7938	1910036	Bionet1_003242	Clc1ccc(CNS(=O)(=O)/C=C/c2ccc(Br)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O05	compound treatment	1.195	8.62E-4	0.01	1.275	-0.0437	-0.6	-0.4135	-0.6932	1910037	Bionet1_003243	O=C1Nc2ccccc2C3=NC(CN4CCN(Cc5ccccc5)CC4)CN31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O06	compound treatment	1.189	-0.00514	-0.07	1.321	0.00227	0.03	-0.0272	-0.3579	1910038	Bionet1_003244	[O-][N+](=O)c1ccc(/C=C/S(=O)(=O)NCc2ccc(Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O07	compound treatment	1.123	-0.0711	-0.96	1.354	0.0353	0.48	-0.3386	-0.3154	1218222	Bionet1_003245	Brc1ccc(CN2c3ccccc3Sc4cccnc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O08	compound treatment	1.192	-0.00214	-0.03	1.323	0.00427	0.06	0.0207	0.3195	1910039	Bionet1_003246	Ic1ccc(cc1)S(=O)(=O)NCc2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O09	compound treatment	1.263	0.0689	0.93	1.422	0.103	1.41	1.6526	0.9796	1910040	Bionet1_003247	CNc1nc(nc(c1C#N)c2cccc(c2)C(F)(F)F)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O10	compound treatment	1.16	-0.0341	-0.46	1.321	0.00227	0.03	-0.3038	-0.6582	1910041	Bionet1_003248	Clc1ccc(CNS(=O)(=O)/C=C/c2ccc3OCOc3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O11	compound treatment	1.183	-0.0111	-0.15	1.302	-0.0167	-0.23	-0.2676	-0.9795	1910042	Bionet1_003249	Cn1nc(c(/C=N/OC(=O)CCl)c1Sc2ccccc2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O12	compound treatment	1.218	0.0239	0.32	1.353	0.0343	0.47	0.558	0.9835	1574751	Bionet1_003250	Ic1ccc(cc1)S(=O)(=O)NCc2cccnc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O13	compound treatment	1.186	-0.00814	-0.11	1.276	-0.0427	-0.58	-0.4897	-0.8258	1732198	Bionet1_003251	CC1CN(CC(C)O1)C(=O)c2cccn(Cc3c(Cl)cccc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O14	compound treatment	1.207	0.0129	0.17	1.313	-0.00573	-0.08	0.0674	0.3542	1910043	Bionet1_003252	Clc1ccc(cc1)c2ccc(/C=C/S(=O)(=O)NCc3cccs3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O15	compound treatment	1.205	0.0109	0.15	1.305	-0.0137	-0.19	-0.0288	-0.1211	1727413	Bionet1_003253	Clc1ccc(cc1)c2nn(c3ccc(Cl)cc3)c(=O)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O16	compound treatment	1.199	0.00486	0.07	1.328	0.00927	0.13	0.1357	0.9534	1611664	Bionet1_003254	Ic1ccc(cc1)C(=O)NC2CCCCCCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O17	compound treatment	1.226	0.0319	0.43	1.302	-0.0167	-0.23	0.1426	0.293	1910044	Bionet1_003255	Fc1ccc(cc1)c2nn(c3ccc(OC(F)(F)F)cc3)c(=O)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O18	compound treatment	1.207	0.0129	0.17	1.382	0.0633	0.86	0.7327	0.8327	1910045	Bionet1_003256	CN(N(S(=O)(=O)C)S(=O)(=O)C)c1c(C#N)c(nn1C)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O19	compound treatment	1.193	-0.00114	-0.02	1.337	0.0183	0.25	0.1653	0.6623	1910046	Bionet1_003257	Fc1ccc(cc1)c2nn(c3ccc(cc3)C(F)(F)F)c(=O)c4ccccc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O20	compound treatment	1.207	0.0129	0.17	1.34	0.0213	0.29	0.3278	0.9698	1910047	Bionet1_003258	CN(N1C(=O)c2ccncc2C1=O)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O21	compound treatment	1.2	0.00586	0.08	1.365	0.0463	0.63	0.502	0.7896	1910048	Bionet1_003259	Cc1nn(c2c(Cl)cc(cc2Cl)C(F)(F)F)c(=O)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	O22	compound treatment	1.239	0.0449	0.61	1.34	0.0213	0.29	0.633	0.9432	1910049	Bionet1_003260	FC(F)(F)c1cccc(N/C=C/C(=O)c2ccc(Oc3ncccn3)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P03	compound treatment	1.155	-0.0391	-0.53	1.346	0.0273	0.37	-0.1104	-0.171	1259992	Bionet1_003261	CS(=O)(=O)N(CC(=O)Oc1ccc2ccccc2c1)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P04	compound treatment	1.186	-0.00814	-0.11	1.241	-0.0777	-1.06	-0.8272	-0.7762	1910050	Bionet1_003262	CSc1nc(Sc2ccccc2Cl)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P05	compound treatment	1.188	-0.00614	-0.08	1.29	-0.0287	-0.39	-0.3356	-0.838	1910051	Bionet1_003263	CCOC(=O)c1cnc(SC)nc1Sc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P06	compound treatment	1.129	-0.0651	-0.88	1.244	-0.0747	-1.02	-1.342	-0.9973	1910052	Bionet1_003264	Oc1nc(SCc2ccccc2)ncc1S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P07	compound treatment	1.17	-0.0241	-0.33	1.277	-0.0417	-0.57	-0.6327	-0.9649	1910053	Bionet1_003265	CCOC(=O)c1cnc(SC)nc1Sc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P08	compound treatment	1.171	-0.0231	-0.31	1.24	-0.0787	-1.07	-0.9799	-0.8764	1910054	Bionet1_003266	Clc1ccc(cc1)C2=NC(N=C(S2)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P09	compound treatment	1.077	-0.117	-1.58	1.228	-0.0907	-1.24	-1.9923	-0.9927	1910055	Bionet1_003267	CCOC(=O)c1cnc(SC)nc1Sc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P10	compound treatment	0.245	-0.949	-12.8	0.392	-0.927	-12.64	-17.9901	-1.0	1254221	Bionet1_003268	Cc1ccc(cc1)c2nn(c3nc(nc(N)c23)c4ccc(C)cc4)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P11	compound treatment	1.146	-0.0481	-0.65	1.273	-0.0457	-0.62	-0.9002	-0.9998	1910056	Bionet1_003269	CCOC(=O)c1cnc(SC)nc1Sc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P12	compound treatment	1.155	-0.0391	-0.53	1.243	-0.0757	-1.03	-1.1036	-0.9515	1556945	Bionet1_003270	Cc1ccc(cc1)C(=O)Nc2ncnc3n(nc(c4ccc(C)cc4)c23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P13	compound treatment	1.169	-0.0251	-0.34	1.313	-0.00573	-0.08	-0.2951	-0.8479	1532052	Bionet1_003271	COc1ccc(CN2CCn3ncc(C(=O)Nc4ccccc4)c3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P14	compound treatment	1.126	-0.0681	-0.92	1.248	-0.0707	-0.96	-1.332	-0.9997	1371341	Bionet1_003272	CC(=O)N(C(=O)C)c1ncnc2n(nc(c3ccc(Cl)cc3)c12)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P15	compound treatment	1.19	-0.00414	-0.06	1.304	-0.0147	-0.2	-0.1815	-0.8706	1170723	Bionet1_003273	COc1ccc(CN2CCn3ncc(C(=O)Nc4cccc(C)c4)c3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P16	compound treatment	1.127	-0.0671	-0.91	1.281	-0.0377	-0.51	-1.0043	-0.9641	1713837	Bionet1_003274	CCS(=O)(=O)c1ccc(C(=O)Nc2nccs2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P17	compound treatment	1.154	-0.0401	-0.54	1.27	-0.0487	-0.66	-0.8528	-0.9948	1910057	Bionet1_003275	COC(=O)c1nn(c(Cl)c1/C=N/OCc2ccc(F)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P18	compound treatment	1.135	-0.0591	-0.8	1.314	-0.00473	-0.06	-0.6098	-0.7618	1910058	Bionet1_003276	CCOC(=O)/C=C\1/C(=O)N(Cc2ccc(Cl)c(Cl)c2)c3ccccc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P19	compound treatment	1.226	0.0319	0.43	1.297	-0.0217	-0.3	0.0944	0.1808	1910059	Bionet1_003277	Cc1cccc2c(cc(Sc3ccc(Cl)cc3)nc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P20	compound treatment	1.126	-0.0681	-0.92	1.298	-0.0207	-0.28	-0.8499	-0.8837	1910060	Bionet1_003278	Cn1nc(c2cc(sc12)C(=O)Nc3ccc(F)cc3F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P21	compound treatment	1.13	-0.0641	-0.87	1.364	0.0453	0.62	-0.1754	-0.165	1910061	Bionet1_003279	Cc1cccc2c(cc(Oc3cccc(c3)C(F)(F)F)nc12)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.577	P22	compound treatment	1.237	0.0429	0.58	1.267	-0.0517	-0.71	-0.09	-0.0986	1910062	Bionet1_003280	COc1ccc(NC(=O)c2cc3c(nn(C)c3s2)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A03	compound treatment	1.209	0.0146	0.2	1.321	-0.00373	-0.05	0.1036	0.5082	1143038	Bionet1_003281	Clc1ccc(CN2COc3c(C2)cc(Cl)c4cccnc34)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A04	compound treatment	1.238	0.0436	0.59	1.322	-0.00273	-0.04	0.3899	0.661	1910063	Bionet1_003282	Clc1ccc(CN2C(=O)CCSc3ccc(Cl)cc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A05	compound treatment	1.194	-3.64E-4	0.0	1.324	-7.34E-4	-0.01	-0.0105	-0.9462	1268704	Bionet1_003283	Clc1ccc(cc1)c2nc3ccccc3cc2Oc4ccccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A06	compound treatment	1.208	0.0136	0.18	1.348	0.0233	0.32	0.3544	0.9664	1910064	Bionet1_003284	CN1c2ccsc2/C(=N/NC(=O)c3ccc(F)cc3)/CS1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A07	compound treatment	1.176	-0.0184	-0.25	1.273	-0.0517	-0.71	-0.674	-0.9015	1312774	Bionet1_003285	Cc1ccc(Oc2nc(SCc3ccc(Cl)cc3)nc4CCCCc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A08	compound treatment	1.223	0.0286	0.39	1.377	0.0523	0.71	0.7771	0.9586	1910065	Bionet1_003286	Clc1ccc2SCCC(=O)N(Cc3c(Cl)cccc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A09	compound treatment	1.157	-0.0374	-0.5	1.288	-0.0367	-0.5	-0.7106	-1.0	1910066	Bionet1_003287	CC(C)(C)Sc1nc(SCc2ccc(Cl)cc2)nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A10	compound treatment	1.228	0.0336	0.45	1.332	0.00727	0.1	0.3909	0.8417	1910067	Bionet1_003288	Fc1cccc(Cl)c1CN2C(=O)CCSc3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A11	compound treatment	1.146	-0.0484	-0.65	1.316	-0.00873	-0.12	-0.5456	-0.8226	1910068	Bionet1_003289	COC(=O)CSc1nc(SCc2ccccc2Cl)nc3CCCCc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A12	compound treatment	1.234	0.0396	0.53	1.337	0.0123	0.17	0.4964	0.886	1332871	Bionet1_003290	COc1ccc(cc1)C(=O)CN2C(=O)CCSc3ccc(Cl)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A13	compound treatment	1.195	6.36E-4	0.01	1.257	-0.0677	-0.92	-0.647	-0.7005	1277880	Bionet1_003291	CN(C)c1ncc(c(n1)N2CCCC2)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A14	compound treatment	1.221	0.0266	0.36	1.401	0.0763	1.04	0.9895	0.8993	1143218	Bionet1_003292	CN1c2ccsc2C(=C(C(=O)Nc3ccc(Cl)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A15	compound treatment	1.158	-0.0364	-0.49	1.36	0.0353	0.48	-0.0068	-0.0099	1564557	Bionet1_003293	O=S(=O)(c1ccccc1)c2cnc(nc2N3CCCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A16	compound treatment	1.232	0.0376	0.51	1.399	0.0743	1.01	1.0751	0.949	1185545	Bionet1_003294	CN1c2ccsc2C(=C(C(=O)Nc3ccc(C)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A17	compound treatment	1.183	-0.0114	-0.15	1.363	0.0383	0.52	0.2606	0.4791	1584305	Bionet1_003295	CCN(CC)c1nc(ncc1S(=O)(=O)c2ccc(Cl)cc2)N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A18	compound treatment	1.25	0.0556	0.75	1.376	0.0513	0.7	1.0251	0.9994	1683941	Bionet1_003296	CN1c2ccsc2C(=C(C(=O)Nc3c(C)cccc3C)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A19	compound treatment	1.24	0.0456	0.62	1.295	-0.0297	-0.41	0.1486	0.2016	1910069	Bionet1_003297	Clc1ncc(CO/N=C/CC(=O)c2ccc(Br)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A20	compound treatment	1.236	0.0416	0.56	1.319	-0.00573	-0.08	0.3419	0.6029	1456773	Bionet1_003298	CN1c2ccsc2C(=C(C(=O)Nc3ccc(F)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A21	compound treatment	1.223	0.0286	0.39	1.314	-0.0107	-0.15	0.1697	0.4107	1910070	Bionet1_003299	Clc1ncc(COC(=O)c2ccc(I)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	A22	compound treatment	1.238	0.0436	0.59	1.346	0.0213	0.29	0.6213	0.9468	1418197	Bionet1_003300	CN1c2ccsc2C(=C(C(=S)Nc3ccccc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B03	compound treatment	1.2	0.00564	0.08	1.339	0.0143	0.19	0.1913	0.916	1239411	Bionet1_003301	Cn1nc(c(CN2CCN(CC2)c3ncccn3)c1Cl)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B04	compound treatment	1.171	-0.0234	-0.32	1.366	0.0413	0.56	0.175	0.2714	1910071	Bionet1_003302	[O-][N+](=O)c1cc(COc2ccc(F)cc2)ccc1Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B05	compound treatment	1.231	0.0366	0.49	1.293	-0.0317	-0.43	0.0435	0.0662	1192236	Bionet1_003303	COc1ccc(Oc2c(cnn(c3ccc(C)cc3)c2=O)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B06	compound treatment	1.194	-3.64E-4	0.0	1.349	0.0243	0.33	0.2305	0.6965	1910072	Bionet1_003304	Cc1ccc(OCc2ccc(Sc3ccc(Cl)cc3)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B07	compound treatment	1.199	0.00464	0.06	1.349	0.0243	0.33	0.2782	0.8261	1910073	Bionet1_003305	Clc1ccc(NC(=O)OCCNC(=O)c2cccc(Br)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B08	compound treatment	1.206	0.0116	0.16	1.329	0.00427	0.06	0.1521	0.9088	1910074	Bionet1_003306	Cc1cccc(OCc2ccc(Sc3ccc(Cl)cc3)c(c2)[N+](=O)[O-])c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B09	compound treatment	1.176	-0.0184	-0.25	1.332	0.00727	0.1	-0.1051	-0.3939	1910075	Bionet1_003307	O/N=C(/NC(=O)c1cccs1)\c2ccc(OCc3cnc(Cl)s3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B10	compound treatment	1.171	-0.0234	-0.32	1.316	-0.00873	-0.12	-0.3071	-0.9114	1910076	Bionet1_003308	Cc1ccc(Sc2ccc(COc3cccc(Cl)c3)cc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B11	compound treatment	1.189	-0.00536	-0.07	1.336	0.0113	0.15	0.0575	0.3384	1910077	Bionet1_003309	Cc1ccc(/C=N/NC(=O)c2c(O)c3cccc4CCCn(c2=O)c43)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B12	compound treatment	1.165	-0.0294	-0.4	1.319	-0.00573	-0.08	-0.3354	-0.8306	1910078	Bionet1_003310	Cc1ccc(OCc2ccc(Sc3ccc(C)cc3)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B13	compound treatment	1.206	0.0116	0.16	1.359	0.0343	0.47	0.4414	0.8955	1711158	Bionet1_003311	CCOC(CCn1ccc(O)c(Cc2ccc(Cl)cc2)c1=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B14	compound treatment	1.2	0.00564	0.08	1.283	-0.0417	-0.57	-0.3486	-0.6072	1910079	Bionet1_003312	Cc1ccc(Sc2ccc(COc3ccc(F)cc3)cc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B15	compound treatment	1.211	0.0166	0.22	1.306	-0.0187	-0.26	-0.0219	-0.0645	1910080	Bionet1_003313	Oc1c(C(=O)N/N=C/c2cccc(Cl)c2)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B16	compound treatment	1.196	0.00164	0.02	1.386	0.0613	0.84	0.6064	0.7255	1587315	Bionet1_003314	Brc1ccc(cc1)n2c(cc3C(=O)CCCc32)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B17	compound treatment	1.222	0.0276	0.37	1.325	2.66E-4	0.0	0.2662	0.714	1563407	Bionet1_003315	CC(C)(C)c1ccccc1NC(=O)c2c(O)c3cccc4CCn(c2=O)c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B18	compound treatment	1.187	-0.00736	-0.1	1.291	-0.0337	-0.46	-0.3955	-0.8404	1910081	Bionet1_003316	ClC1=C(CCc2ccccc12)/C=N/OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B19	compound treatment	1.185	-0.00936	-0.13	1.335	0.0103	0.14	0.0097	0.0513	1910082	Bionet1_003317	CCCCCCOc1ccc(/C=C/C(=O)Oc2ccc(CC(C)CC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B20	compound treatment	1.19	-0.00436	-0.06	1.328	0.00327	0.04	-0.0101	-0.1372	1221786	Bionet1_003318	COC(=O)c1sccc1NC(=O)COc2ccc(Cl)c3ccccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B21	compound treatment	1.172	-0.0224	-0.3	1.366	0.0413	0.56	0.1846	0.2891	1910083	Bionet1_003319	CCOC(=O)C1CCN(CC1)c2ncc(/C=N/NC(=O)c3ccncc3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	B22	compound treatment	1.185	-0.00936	-0.13	1.352	0.0273	0.37	0.1736	0.4421	1910084	Bionet1_003320	COC(=O)c1sccc1NC(=O)COc2ccc(cc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C03	compound treatment	1.152	-0.0424	-0.57	1.317	-0.00773	-0.11	-0.4787	-0.8237	1910085	Bionet1_003321	FC(F)(F)c1cnc(c(Cl)c1)n2cc(cc(Cl)c2=O)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C04	compound treatment	1.24	0.0456	0.62	1.311	-0.0137	-0.19	0.3029	0.4707	1910086	Bionet1_003322	CC(C)(C)NC(=O)c1ccc(Sc2ccc(Cl)cc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C05	compound treatment	1.203	0.00864	0.12	1.328	0.00327	0.04	0.1139	0.913	1910087	Bionet1_003323	Clc1ccc(CO/N=C/Nc2ncnc3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C06	compound treatment	1.226	0.0316	0.43	1.339	0.0143	0.19	0.4394	0.9367	1910088	Bionet1_003324	[O-][N+](=O)c1cc(ccc1Sc2ccc(Cl)cc2)C(=O)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C07	compound treatment	1.209	0.0146	0.2	1.366	0.0413	0.56	0.5375	0.9013	1713117	Bionet1_003325	O=c1cc(c2ccccc2)n(o1)S(=O)(=O)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C08	compound treatment	1.23	0.0356	0.48	1.367	0.0423	0.58	0.7475	0.9959	1910089	Bionet1_003326	[O-][N+](=O)c1cc(ccc1Sc2ccc(Cl)cc2)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C09	compound treatment	1.195	6.36E-4	0.01	1.321	-0.00373	-0.05	-0.0299	-0.5797	1306768	Bionet1_003327	COc1ccc(cc1OC)S(=O)(=O)n2oc(=O)cc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C10	compound treatment	1.186	-0.00836	-0.11	1.354	0.0293	0.4	0.2024	0.4881	1910090	Bionet1_003328	Cc1ccc(Sc2ccc(cc2[N+](=O)[O-])C(=O)N3CCOCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C11	compound treatment	1.184	-0.0104	-0.14	1.376	0.0513	0.7	0.3955	0.5547	1910091	Bionet1_003329	Cc1ccc(/C=N/NC(=O)c2ccc(OCc3c(F)cccc3Cl)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C12	compound treatment	1.249	0.0546	0.74	1.37	0.0453	0.62	0.9577	0.9961	1910092	Bionet1_003330	Cc1ccc(Sc2ccc(cc2[N+](=O)[O-])C(=O)NC3CCCCC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C13	compound treatment	1.247	0.0526	0.71	1.338	0.0133	0.18	0.63	0.8598	1910093	Bionet1_003331	Clc1ccc(COc2ccc(cc2)C(=O)N/N=C/c3ccccc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C14	compound treatment	1.233	0.0386	0.52	1.38	0.0553	0.75	0.9015	0.9838	1910094	Bionet1_003332	COc1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C15	compound treatment	1.154	-0.0404	-0.54	1.296	-0.0287	-0.39	-0.6621	-0.987	1569085	Bionet1_003333	Nc1c(C#N)c(Nc2ccccc2)sc1C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C16	compound treatment	1.241	0.0466	0.63	1.332	0.00727	0.1	0.5149	0.8085	1910095	Bionet1_003334	Cc1ccc(Sc2ccc(cc2[N+](=O)[O-])C(=O)Nc3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C17	compound treatment	1.171	-0.0234	-0.32	1.384	0.0593	0.81	0.3486	0.4019	1910096	Bionet1_003335	CN(C)/C=C/C(=C\C(=O)C(F)(F)F)/Nc1ccc(cc1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C18	compound treatment	1.175	-0.0194	-0.26	1.393	0.0683	0.93	0.4735	0.4898	1910097	Bionet1_003336	Cc1ccccc1NC(=O)c2ccc(Sc3ccc(Cl)cc3)c(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C19	compound treatment	1.196	0.00164	0.02	1.366	0.0413	0.56	0.4135	0.7343	1602860	Bionet1_003337	CN(C)S(=O)(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)N(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C20	compound treatment	1.19	-0.00436	-0.06	1.33	0.00527	0.07	0.0092	0.0986	1910098	Bionet1_003338	[O-][N+](=O)c1cc(ccc1Sc2ccc(Cl)cc2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C21	compound treatment	1.208	0.0136	0.18	1.338	0.0133	0.18	0.258	1.0	1733864	Bionet1_003339	Clc1cc(Cl)c(OCc2ccccc2)c(Cl)c1OCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	C22	compound treatment	1.229	0.0346	0.47	1.366	0.0413	0.56	0.7283	0.9957	1910099	Bionet1_003340	[O-][N+](=O)c1cc(ccc1Sc2ccccc2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D03	compound treatment	1.173	-0.0214	-0.29	1.336	0.0113	0.15	-0.0952	-0.2914	1910100	Bionet1_003341	CC1CN(CC(C)O1)c2ncc(/C=N/NC(=O)c3ccccc3O)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D04	compound treatment	1.22	0.0256	0.35	1.339	0.0143	0.19	0.3821	0.963	1639700	Bionet1_003342	Cc1nn(C)c(Oc2ccccc2)c1CCNC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D05	compound treatment	1.188	-0.00636	-0.09	1.39	0.0653	0.89	0.5686	0.6359	1910101	Bionet1_003343	C1CN(CCO1)c2ncc(/C=N/Nc3ccccc3Oc4ccccc4)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D06	compound treatment	1.15	-0.0444	-0.6	1.321	-0.00373	-0.05	-0.4592	-0.7645	1534636	Bionet1_003344	Cc1nn(C)c(Oc2ccccc2)c1CCNS(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D07	compound treatment	1.221	0.0266	0.36	1.298	-0.0267	-0.36	-0.0037	-0.0072	1910102	Bionet1_003345	O=C(N/N=C/c1cnc(s1)N2CCN(CC2)c3ccccc3)c4cccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D08	compound treatment	1.143	-0.0514	-0.69	1.306	-0.0187	-0.26	-0.6706	-0.908	1581523	Bionet1_003346	Cc1nn(C)c(Oc2ccccc2)c1CCNC(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D09	compound treatment	1.188	-0.00636	-0.09	1.348	0.0233	0.32	0.1636	0.4979	1910103	Bionet1_003347	Oc1c(C(=O)N/N=C/c2c[nH]c3ccccc23)c(=O)n4CCCc5cccc1c54
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D10	compound treatment	1.161	-0.0334	-0.45	1.306	-0.0187	-0.26	-0.4989	-0.964	1485173	Bionet1_003348	Cc1nn(C)c(Oc2ccccc2)c1CCNC(=O)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D11	compound treatment	1.177	-0.0174	-0.23	1.341	0.0163	0.22	-0.0088	-0.0272	1910104	Bionet1_003349	Oc1cccc(/C=N/NC(=O)c2c(O)c3cccc4CCCn(c2=O)c43)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D12	compound treatment	1.174	-0.0204	-0.27	1.296	-0.0287	-0.39	-0.4713	-0.9849	1455182	Bionet1_003350	Cc1nn(C)c(Oc2ccccc2)c1CCNS(=O)(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D13	compound treatment	1.221	0.0266	0.36	1.286	-0.0387	-0.53	-0.1194	-0.1869	1910105	Bionet1_003351	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2cnc(s2)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D14	compound treatment	1.21	0.0156	0.21	1.258	-0.0667	-0.91	-0.4943	-0.5292	1910106	Bionet1_003352	Clc1ccc(N/N=C/2\CCS(=O)(=O)c3sccc23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D15	compound treatment	1.136	-0.0584	-0.79	1.335	0.0103	0.14	-0.4578	-0.5724	1910107	Bionet1_003353	FC(F)(F)c1cc(NC(=S)NC(=O)c2ccccc2)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D16	compound treatment	1.24	0.0456	0.62	1.296	-0.0287	-0.39	0.1583	0.2169	1910108	Bionet1_003354	FC(F)(F)c1cccc(c1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D17	compound treatment	1.241	0.0466	0.63	1.306	-0.0187	-0.26	0.2642	0.3891	1910109	Bionet1_003355	CC(C)c1ccc(Sc2ncnc3n(Cc4ccccc4)c(C)c(C)c23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D18	compound treatment	1.218	0.0236	0.32	1.353	0.0283	0.39	0.498	0.9956	1910110	Bionet1_003356	COc1ccc(cc1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D19	compound treatment	1.225	0.0306	0.41	1.388	0.0633	0.86	0.9023	0.9432	1910111	Bionet1_003357	Cn1c2sc(cc2c3ccccc13)C(=O)NNC(=O)c4c(F)cccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D20	compound treatment	1.192	-0.00236	-0.03	1.31	-0.0147	-0.2	-0.1646	-0.8092	1910112	Bionet1_003358	Fc1cccc(F)c1C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D21	compound treatment	1.184	-0.0104	-0.14	1.329	0.00427	0.06	-0.0577	-0.3812	1910113	Bionet1_003359	Cn1c2sc(cc2c3ccccc13)C(=O)NNC(=O)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	D22	compound treatment	1.153	-0.0414	-0.56	1.312	-0.0127	-0.17	-0.5174	-0.8853	1910114	Bionet1_003360	Cc1ccc(CSc2nc(Sc3ccc(C)cc3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E03	compound treatment	1.132	-0.0624	-0.84	1.334	0.00927	0.13	-0.5056	-0.5942	1910115	Bionet1_003361	COC(=O)c1ccc(Oc2c(cc(cc2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E04	compound treatment	1.206	0.0116	0.16	1.325	2.66E-4	0.0	0.1136	0.7233	1910116	Bionet1_003362	[O-][N+](=O)c1cc(ccc1Sc2ccccc2)C(=O)Nc3ccc(F)cc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E05	compound treatment	1.136	-0.0584	-0.79	1.288	-0.0367	-0.5	-0.9109	-0.9762	1910117	Bionet1_003363	Clc1ccc(COc2ccc(cc2)C(=O)N/N=C/c3ccco3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E06	compound treatment	1.205	0.0106	0.14	1.299	-0.0257	-0.35	-0.1467	-0.3869	1910118	Bionet1_003364	COc1ccc(NC(=O)c2ccc(Sc3ccccc3)c(c2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E07	compound treatment	1.176	-0.0184	-0.25	1.352	0.0273	0.37	0.0877	0.1964	1910119	Bionet1_003365	CN(N1C(=O)c2cccc(O)c2C1=O)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E08	compound treatment	1.266	0.0716	0.97	1.392	0.0673	0.92	1.332	0.9997	1714600	Bionet1_003366	CN1c2ccsc2C(=C(C(=S)Nc3ccc(Cl)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E09	compound treatment	1.163	-0.0314	-0.42	1.32	-0.00473	-0.06	-0.3448	-0.8057	1910120	Bionet1_003367	CN(N1C(=O)c2cccc(N)c2C1=O)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E10	compound treatment	1.265	0.0706	0.95	1.394	0.0693	0.94	1.3417	1.0	1161142	Bionet1_003368	CN1c2ccsc2C(=C(C(=S)Nc3ccc(C)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E11	compound treatment	1.159	-0.0354	-0.48	1.351	0.0263	0.36	-0.0841	-0.1409	1502713	Bionet1_003369	Nc1c(C#N)c(Nc2ccccc2)sc1C(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E12	compound treatment	1.18	-0.0144	-0.19	1.339	0.0143	0.19	5.0E-4	0.002	1910121	Bionet1_003370	C(Sc1nc(NC2CCCCC2)c3sccc3n1)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E13	compound treatment	1.177	-0.0174	-0.23	1.335	0.0103	0.14	-0.0666	-0.2442	1179126	Bionet1_003371	COc1ccc(cc1)C2CC(=O)Nc3c2c(nn3c4ccccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E14	compound treatment	1.178	-0.0164	-0.22	1.328	0.00327	0.04	-0.1246	-0.5533	1910122	Bionet1_003372	Clc1ccc(OCC(=O)NN=C(c2ccccc2)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E15	compound treatment	1.231	0.0366	0.49	1.343	0.0183	0.25	0.5256	0.9497	1910123	Bionet1_003373	CCOC(=O)C1=C(C)N(N(C)c2ncc(cc2Cl)C(F)(F)F)C(=O)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E16	compound treatment	1.208	0.0136	0.18	1.279	-0.0457	-0.62	-0.3109	-0.4782	1910124	Bionet1_003374	COc1ccc(OCC(=O)NN=C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E17	compound treatment	1.185	-0.00936	-0.13	1.36	0.0353	0.48	0.2507	0.5043	1302194	Bionet1_003375	O=C(c1sc(Nc2ccccc2)c(C#N)c1n3cccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E18	compound treatment	1.193	-0.00136	-0.02	1.371	0.0463	0.63	0.4331	0.6862	1910125	Bionet1_003376	Cc1ccc(OCC(=O)NN=C(c2ccccc2)c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E19	compound treatment	1.217	0.0226	0.31	1.33	0.00527	0.07	0.2667	0.8502	1910126	Bionet1_003377	N#CC1=C(Nc2ccccc2)SC=C(N=C1N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E20	compound treatment	1.233	0.0386	0.52	1.356	0.0313	0.43	0.67	0.995	1910127	Bionet1_003378	O=C(COc1ccc2ccccc2c1)NN=C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E21	compound treatment	1.233	0.0386	0.52	1.387	0.0623	0.85	0.969	0.9726	1910128	Bionet1_003379	O=C(NC(=S)Nc1ccc(N=Nc2ccccc2)cc1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	E22	compound treatment	1.224	0.0296	0.4	1.323	-0.00173	-0.02	0.266	0.6641	1910129	Bionet1_003380	Clc1ccc(SCC(=O)NN=C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F03	compound treatment	1.18	-0.0144	-0.19	1.314	-0.0107	-0.15	-0.2405	-0.9904	1519261	Bionet1_003381	Clc1ccc(SCC2CSc3nc4ccccc4c(=O)n23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F04	compound treatment	1.173	-0.0214	-0.29	1.291	-0.0337	-0.46	-0.5291	-0.9746	1910130	Bionet1_003382	Clc1ccc(cn1)C(=O)O/N=C/2\CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F05	compound treatment	1.205	0.0106	0.14	1.325	2.66E-4	0.0	0.104	0.7248	1910131	Bionet1_003383	Cc1ccccc1C(=O)NNC(=O)c2cc3c(s2)n(C)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F06	compound treatment	1.186	-0.00836	-0.11	1.295	-0.0297	-0.41	-0.3665	-0.8708	1264965	Bionet1_003384	CN(C(=O)CN(c1ccc(Cl)cc1Cl)S(=O)(=O)C)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F07	compound treatment	1.188	-0.00636	-0.09	1.291	-0.0337	-0.46	-0.386	-0.8248	1910132	Bionet1_003385	Cc1cccc(c1)C(=O)NNC(=O)c2cc3c(s2)n(C)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F08	compound treatment	1.182	-0.0124	-0.17	1.343	0.0183	0.25	0.0582	0.1941	1298187	Bionet1_003386	CS(=O)(=O)N(CC(=O)N1CCOCC1)c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F09	compound treatment	1.148	-0.0464	-0.63	1.314	-0.0107	-0.15	-0.5458	-0.8496	1910133	Bionet1_003387	Cc1ccc(cc1)C(=O)NNC(=O)c2cc3c(s2)n(C)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F10	compound treatment	1.144	-0.0504	-0.68	1.269	-0.0557	-0.76	-1.0178	-0.9984	1237863	Bionet1_003388	Cc1ccc(CSc2nc(Oc3cc(C)cc(C)c3)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F11	compound treatment	1.208	0.0136	0.18	1.322	-0.00273	-0.04	0.1037	0.5526	1910134	Bionet1_003389	Cn1c2sc(cc2c3ccccc13)C(=O)NNC(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F12	compound treatment	1.181	-0.0134	-0.18	1.266	-0.0587	-0.8	-0.6938	-0.8451	1735998	Bionet1_003390	Cc1ccc(CSc2nc(Oc3ccc(F)cc3F)c4CCCCc4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F13	compound treatment	1.219	0.0246	0.33	1.313	-0.0117	-0.16	0.1219	0.3304	1220641	Bionet1_003391	Clc1ccc(SCC2CSc3nc4ccccc4c(=O)n23)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F14	compound treatment	1.159	-0.0354	-0.48	1.275	-0.0497	-0.68	-0.8169	-0.9852	1910135	Bionet1_003392	CSc1nc(Sc2ccc(Cl)cc2Cl)c3sccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F15	compound treatment	1.191	-0.00336	-0.05	1.358	0.0333	0.45	0.2887	0.6332	1440657	Bionet1_003393	COc1ccc(cc1)c2cc(on2)C(=O)Nc3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F16	compound treatment	1.207	0.0126	0.17	1.284	-0.0407	-0.56	-0.2722	-0.4685	1910136	Bionet1_003394	CSc1nc(Sc2cccc(c2)C(F)(F)F)c3sccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F17	compound treatment	1.217	0.0226	0.31	1.359	0.0343	0.47	0.5463	0.9787	1910137	Bionet1_003395	OC(CS(=O)(=O)c1ccc(Cl)cc1)c2ccc(Cl)c(Cl)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F18	compound treatment	1.192	-0.00236	-0.03	1.287	-0.0377	-0.51	-0.3864	-0.7495	1910138	Bionet1_003396	FC(F)(F)c1cccc(CO/N=C/Nc2ncnc3sccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F19	compound treatment	1.168	-0.0264	-0.36	1.282	-0.0427	-0.58	-0.6635	-0.9719	1444095	Bionet1_003397	Clc1ccccc1SCC2CSc3nc4ccccc4c(=O)n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F20	compound treatment	1.217	0.0226	0.31	1.316	-0.00873	-0.12	0.1317	0.4019	1910139	Bionet1_003398	FC(F)(F)c1cccc(OCCO/N=C/Nc2ncnc3sccc23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F21	compound treatment	1.177	-0.0174	-0.23	1.314	-0.0107	-0.15	-0.2691	-0.9744	1434562	Bionet1_003399	Clc1cccc(SCC2CSc3nc4ccccc4c(=O)n23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	F22	compound treatment	1.15	-0.0444	-0.6	1.342	0.0173	0.24	-0.2567	-0.3991	1910140	Bionet1_003400	Clc1cccc(Cl)c1CO/N=C/Nc2ncnc3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G03	compound treatment	1.196	0.00164	0.02	1.244	-0.0807	-1.1	-0.7629	-0.6928	1910141	Bionet1_003401	Nc1cccc2C(=O)N(CCNc3ncc(cc3Cl)C(F)(F)F)C(=O)c21
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G04	compound treatment	1.234	0.0396	0.53	1.354	0.0293	0.4	0.6603	0.9896	1910142	Bionet1_003402	Cc1ccc(SCC(=O)NN=C(c2ccccc2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G05	compound treatment	1.181	-0.0134	-0.18	1.308	-0.0167	-0.23	-0.2888	-0.9932	1910143	Bionet1_003403	Fc1ccc(COc2ccsc2C(=O)N/N=C/c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G06	compound treatment	1.238	0.0436	0.59	1.339	0.0143	0.19	0.5538	0.8933	1910144	Bionet1_003404	COc1cccc(SCC(=O)NN=C(c2ccccc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G07	compound treatment	1.184	-0.0104	-0.14	1.34	0.0153	0.21	0.0483	0.1928	1910145	Bionet1_003405	Cc1ccc(/C=N/NC(=O)c2sccc2OCc3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G08	compound treatment	1.17	-0.0244	-0.33	1.305	-0.0197	-0.27	-0.4227	-0.9951	1910146	Bionet1_003406	Clc1ccc2SCCC(=Nc2c1)SCc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G09	compound treatment	1.152	-0.0424	-0.57	1.339	0.0143	0.19	-0.2666	-0.4415	1910147	Bionet1_003407	Fc1ccc(COc2ccsc2C(=O)N/N=C/c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G10	compound treatment	1.185	-0.00936	-0.13	1.322	-0.00273	-0.04	-0.1157	-0.8783	1910148	Bionet1_003408	CC(C)(C)C(=O)Cn1ncc(Br)c(Br)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G11	compound treatment	1.191	-0.00336	-0.05	1.307	-0.0177	-0.24	-0.2031	-0.8254	1910149	Bionet1_003409	Cc1ccsc1/C=N/NC(=O)c2sccc2OCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G12	compound treatment	1.234	0.0396	0.53	1.355	0.0303	0.41	0.6699	0.9918	1910150	Bionet1_003410	Clc1ccc(CSC2=Nc3cc(Cl)ccc3SCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G13	compound treatment	1.174	-0.0204	-0.27	1.318	-0.00673	-0.09	-0.2592	-0.8948	1910151	Bionet1_003411	Fc1ccc(COc2ccsc2C(=O)N/N=C/c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G14	compound treatment	1.211	0.0166	0.22	1.339	0.0143	0.19	0.2963	0.9975	1910152	Bionet1_003412	Clc1cccc(CSC2=Nc3cc(Cl)ccc3SCC2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G15	compound treatment	1.198	0.00364	0.05	1.301	-0.0237	-0.32	-0.1942	-0.5931	1910153	Bionet1_003413	Fc1ccc(COc2ccsc2C(=O)N/N=C/c3ccncc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G16	compound treatment	1.21	0.0156	0.21	1.328	0.00327	0.04	0.1807	0.8379	1393961	Bionet1_003414	Clc1ccc(cc1)C(=O)Cn2ncc(N3CCCC3)c(Br)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G17	compound treatment	1.194	-3.64E-4	0.0	1.338	0.0133	0.18	0.1245	0.6877	1427809	Bionet1_003415	Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G18	compound treatment	1.193	-0.00136	-0.02	1.311	-0.0137	-0.19	-0.1454	-0.7728	1910154	Bionet1_003416	COC(=O)c1ccc2SCC(=O)N(Cc3cccc(c3)C(F)(F)F)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G19	compound treatment	1.189	-0.00536	-0.07	1.305	-0.0197	-0.27	-0.2414	-0.8665	1522331	Bionet1_003417	Oc1c(C(=O)Nc2cc(Cl)cc(Cl)c2)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G20	compound treatment	1.231	0.0366	0.49	1.36	0.0353	0.48	0.6895	0.9999	1910155	Bionet1_003418	CN1c2ccccc2C(=C(C(=O)Nc3cccc(Cl)c3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G21	compound treatment	1.242	0.0476	0.64	1.409	0.0843	1.15	1.267	0.9623	1680892	Bionet1_003419	Clc1ccc(cc1)C(=O)CSc2nnc(SC3CCCC3)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	G22	compound treatment	1.239	0.0446	0.6	1.395	0.0703	0.96	1.1033	0.9749	1910156	Bionet1_003420	CN1c2ccccc2C(=C(C(=O)Nc3cccc(c3)C(F)(F)F)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H03	compound treatment	1.172	-0.0224	-0.3	1.3	-0.0247	-0.34	-0.4518	-0.9985	1358708	Bionet1_003421	Clc1cccc(SCC2CSc3nc4ccccc4c(=O)n23)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H04	compound treatment	1.124	-0.0704	-0.95	1.311	-0.0137	-0.19	-0.8036	-0.8306	1910157	Bionet1_003422	FC(=C(F)CCSc1nc2ccsc2c(=O)n1c3ccccc3)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H05	compound treatment	1.192	-0.00236	-0.03	1.343	0.0183	0.25	0.1536	0.6116	1457919	Bionet1_003423	Clc1ccc(Cl)c(SCC2CSc3nc4ccccc4c(=O)n23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H06	compound treatment	1.151	-0.0434	-0.59	1.298	-0.0267	-0.36	-0.6714	-0.9741	1910158	Bionet1_003424	COC(=O)/C(=C\Nc1ccccc1N)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H07	compound treatment	1.203	0.00864	0.12	1.327	0.00227	0.03	0.1042	0.8648	1377998	Bionet1_003425	Clc1ccc(CSCC2CSc3nc4ccccc4c(=O)n23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H08	compound treatment	1.186	-0.00836	-0.11	1.313	-0.0117	-0.16	-0.1929	-0.9854	1027931	Bionet1_003426	Clc1ccc(OCCOc2ccc(Cl)cc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H09	compound treatment	1.206	0.0116	0.16	1.338	0.0133	0.18	0.2389	0.9975	1910159	Bionet1_003427	Cc1ccc(cc1)S(=O)(=O)NNC(=O)c2cc3c(s2)n(C)c4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H10	compound treatment	1.216	0.0216	0.29	1.319	-0.00573	-0.08	0.1511	0.5001	1910160	Bionet1_003428	COc1cccc(CNS(=O)(=O)/C=C/c2ccc(OC)c(OC)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H11	compound treatment	1.199	0.00464	0.06	1.351	0.0263	0.36	0.2975	0.8182	1456037	Bionet1_003429	Clc1ccc(CSC2=CS(=O)(=O)c3ccccc3N2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H12	compound treatment	1.199	0.00464	0.06	1.33	0.00527	0.07	0.095	0.9976	1326910	Bionet1_003430	CCOC(=O)c1c2ccc(OCC(=O)NCc3ccco3)cc2n4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H13	compound treatment	1.188	-0.00636	-0.09	1.361	0.0363	0.49	0.289	0.5757	1910161	Bionet1_003431	Fc1cccc(Cl)c1CSC2=CS(=O)(=O)c3ccccc3N2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H14	compound treatment	1.18	-0.0144	-0.19	1.351	0.0263	0.36	0.1163	0.2855	1910162	Bionet1_003432	FC(F)(F)c1cccc(COc2ccc3c(C#N)c4ccccn4c3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H15	compound treatment	1.217	0.0226	0.31	1.356	0.0313	0.43	0.5174	0.9866	1910163	Bionet1_003433	Cn1c2sc(cc2c3ccccc13)C(=O)NNC(=O)Cc4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H16	compound treatment	1.148	-0.0464	-0.63	1.334	0.00927	0.13	-0.3529	-0.5531	1910164	Bionet1_003434	FC(F)(F)c1cnc(Oc2ccc3c(C#N)c4ccccn4c3c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H17	compound treatment	1.215	0.0206	0.28	1.351	0.0263	0.36	0.4501	0.9922	1910165	Bionet1_003435	COC(=O)c1sccc1NC(=O)CSc2ccccc2C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H18	compound treatment	1.197	0.00264	0.04	1.332	0.00727	0.1	0.0952	0.9044	1303648	Bionet1_003436	COc1ccc(NC(=O)COc2ccc3c(C#N)c4ccccn4c3c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H19	compound treatment	1.212	0.0176	0.24	1.317	-0.00773	-0.11	0.0937	0.3599	1910166	Bionet1_003437	COC(=O)c1sccc1NC(=O)CSc2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H20	compound treatment	1.171	-0.0234	-0.32	1.283	-0.0417	-0.57	-0.6253	-0.9612	1127807	Bionet1_003438	CSc1nc(Oc2ccc(cc2)C(C)(C)C)c3cnn(c4ccccc4)c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H21	compound treatment	1.231	0.0366	0.49	1.385	0.0603	0.82	0.9306	0.9704	1910167	Bionet1_003439	[O-][N+](=O)c1cc(CN2CCOCC2)ccc1Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	H22	compound treatment	1.169	-0.0254	-0.34	1.358	0.0333	0.45	0.0788	0.1387	1147845	Bionet1_003440	CCCCn1c(NC(=O)C(C)C)c(C#N)c(c1c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I03	compound treatment	1.17	-0.0244	-0.33	1.356	0.0313	0.43	0.0691	0.1283	1160435	Bionet1_003441	COc1cccc(Cn2ccc(O)c(Cc3ccc(Cl)cc3)c2=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I04	compound treatment	1.216	0.0216	0.29	1.333	0.00827	0.11	0.2861	0.9144	1342213	Bionet1_003442	CN1c2ccccc2C(=C(C(=O)Nc3c(C)cccc3C)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I05	compound treatment	1.182	-0.0124	-0.17	1.319	-0.00573	-0.08	-0.1732	-0.9404	1910168	Bionet1_003443	Oc1c(C(=O)Nc2cccc(c2)[N+](=O)[O-])c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I06	compound treatment	1.24	0.0456	0.62	1.308	-0.0167	-0.23	0.274	0.4173	1282139	Bionet1_003444	CN1c2ccccc2C(=C(C(=O)Nc3ccc(Cl)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I07	compound treatment	1.139	-0.0554	-0.75	1.305	-0.0197	-0.27	-0.7184	-0.9049	1694746	Bionet1_003445	Oc1c(C(=O)Nc2cc(F)ccc2F)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I08	compound treatment	1.22	0.0256	0.35	1.381	0.0563	0.77	0.7871	0.9352	1910169	Bionet1_003446	CN1c2ccccc2C(=C(C(=O)Nc3ccc(Cl)c(Cl)c3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I09	compound treatment	1.224	0.0296	0.4	1.31	-0.0147	-0.2	0.1406	0.3143	1609852	Bionet1_003447	COc1ccc(CCn2ccc(O)c(Cc3ccc(Cl)cc3)c2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I10	compound treatment	1.182	-0.0124	-0.17	1.366	0.0413	0.56	0.28	0.477	1910170	Bionet1_003448	Clc1ccc2SCCC(=Nc2c1)SCc3c(Cl)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I11	compound treatment	1.222	0.0276	0.37	1.335	0.0103	0.14	0.3626	0.9105	1910171	Bionet1_003449	Cc1ccc(COc2ccc(cc2)C(=O)N/N=C/C=C\c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I12	compound treatment	1.18	-0.0144	-0.19	1.34	0.0153	0.21	0.0102	0.0358	1910172	Bionet1_003450	Clc1ccc(CSC2=Nc3cc(Cl)ccc3SCC2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I13	compound treatment	1.258	0.0636	0.86	1.354	0.0293	0.4	0.8892	0.9393	1910173	Bionet1_003451	[O-][N+](=O)c1ccc(CO/N=C/CC(=O)c2cc(no2)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I14	compound treatment	1.201	0.00664	0.09	1.303	-0.0217	-0.3	-0.1463	-0.4724	1910174	Bionet1_003452	Cc1ccc(Sc2ccc(COC(=O)c3cccs3)cc2[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I15	compound treatment	1.175	-0.0194	-0.26	1.386	0.0613	0.84	0.406	0.4639	1910175	Bionet1_003453	CCOc1ccc(Br)cc1/C=N/NC(=O)c2ccccc2O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I16	compound treatment	1.234	0.0396	0.53	1.358	0.0333	0.45	0.6989	0.9967	1910176	Bionet1_003454	[O-][N+](=O)c1cc(COC(=O)c2ccc(Cl)cc2)ccc1Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I17	compound treatment	1.197	0.00264	0.04	1.326	0.00127	0.02	0.0374	0.9449	1910177	Bionet1_003455	Oc1ccccc1/C=N/NC(=O)c2ccc(OCc3c(F)cccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I18	compound treatment	1.236	0.0416	0.56	1.275	-0.0497	-0.68	-0.0824	-0.0935	1910178	Bionet1_003456	CCNC(=O)OCc1ccc(Sc2ccc(Cl)cc2)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I19	compound treatment	1.185	-0.00936	-0.13	1.385	0.0603	0.82	0.4918	0.5915	1910179	Bionet1_003457	CC(C)(C)c1ccc(Oc2ccccc2/C=C/3\SC(=O)NC3=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I20	compound treatment	1.243	0.0486	0.66	1.382	0.0573	0.78	1.0161	0.9963	1910180	Bionet1_003458	[O-][N+](=O)c1cc(COC(=O)Nc2ccc(F)cc2)ccc1Sc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I21	compound treatment	1.253	0.0586	0.79	1.435	0.11	1.5	1.6226	0.955	1910181	Bionet1_003459	Clc1ncc(COc2ccc(/C=N/NC(=O)c3ccncc3)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	I22	compound treatment	1.213	0.0186	0.25	1.366	0.0413	0.56	0.5757	0.934	1487542	Bionet1_003460	COC(=O)c1ccc2SCC(=O)N(Cc3ccc(Cl)cc3Cl)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J03	compound treatment	1.209	0.0146	0.2	1.358	0.0333	0.45	0.4604	0.9306	1910182	Bionet1_003461	[O-][N+](=O)c1cc(CN2CCCCC2)ccc1Sc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J04	compound treatment	1.166	-0.0284	-0.38	1.258	-0.0667	-0.91	-0.914	-0.9259	1426452	Bionet1_003462	Cc1c(C)n(Cc2ccccc2)c(NC(=O)c3ccccc3Cl)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J05	compound treatment	1.177	-0.0174	-0.23	1.323	-0.00173	-0.02	-0.1824	-0.7745	1910183	Bionet1_003463	COC(=O)c1sccc1NC(=O)CSc2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J06	compound treatment	1.164	-0.0304	-0.41	1.265	-0.0597	-0.81	-0.8656	-0.9494	1646382	Bionet1_003464	Cc1c(C)n(Cc2ccccc2)c(NC(=O)c3cccc(Cl)c3)c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J07	compound treatment	1.193	-0.00136	-0.02	1.298	-0.0267	-0.36	-0.2708	-0.7418	1910184	Bionet1_003465	COC(=O)c1sccc1NC(=O)CSc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J08	compound treatment	1.18	-0.0144	-0.19	1.31	-0.0147	-0.2	-0.2791	-0.9998	1910185	Bionet1_003466	CO/N=C(/CNS(=O)(=O)c1ccc(OC)cc1)\c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J09	compound treatment	1.193	-0.00136	-0.02	1.3	-0.0247	-0.34	-0.2515	-0.7446	1910186	Bionet1_003467	COC(=O)c1sccc1NC(=O)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J10	compound treatment	1.153	-0.0414	-0.56	1.289	-0.0357	-0.49	-0.7391	-0.9977	1498526	Bionet1_003468	Clc1cccc(Cl)c1SC2CCS(=O)(=O)c3sccc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J11	compound treatment	1.18	-0.0144	-0.19	1.327	0.00227	0.03	-0.1152	-0.5869	1910187	Bionet1_003469	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2c[nH]nc2c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J12	compound treatment	1.174	-0.0204	-0.27	1.223	-0.102	-1.39	-1.1752	-0.831	1390228	Bionet1_003470	Fc1ccc(Oc2cc(nc(n2)c3ccccc3)N4CCOCC4)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J13	compound treatment	1.197	0.00264	0.04	1.341	0.0163	0.22	0.182	0.8101	1910188	Bionet1_003471	Oc1ccn(Cc2cccc(Cl)c2)c(=O)c1C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J14	compound treatment	1.224	0.0296	0.4	1.282	-0.0427	-0.58	-0.1293	-0.183	1588462	Bionet1_003472	O=S(=O)(c1ccccc1)c2cnc(nc2N3CCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J15	compound treatment	1.186	-0.00836	-0.11	1.32	-0.00473	-0.06	-0.1254	-0.9649	1910189	Bionet1_003473	Oc1ccn(Cc2cccc(c2)C(F)(F)F)c(=O)c1C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J16	compound treatment	1.182	-0.0124	-0.17	1.285	-0.0397	-0.54	-0.5011	-0.8838	1910190	Bionet1_003474	FC(F)(F)c1cccc(Sc2nccc(n2)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J17	compound treatment	1.232	0.0376	0.51	1.343	0.0183	0.25	0.5352	0.9463	1910191	Bionet1_003475	CCOC(=O)/C(=C/N(C)C)/NC=C(C(=O)c1ccccc1)C(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J18	compound treatment	1.154	-0.0404	-0.54	1.309	-0.0157	-0.21	-0.5368	-0.9171	1583381	Bionet1_003476	Cc1ccc(cc1)S(=O)(=O)c2cnc(nc2N3CCCCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J19	compound treatment	1.247	0.0526	0.71	1.331	0.00627	0.09	0.5625	0.7865	1910192	Bionet1_003477	O=C(C(=CNc1cnc2ccccn2c1=O)C(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J20	compound treatment	1.162	-0.0324	-0.44	1.323	-0.00173	-0.02	-0.3254	-0.7443	1183782	Bionet1_003478	Cc1cc(Cl)ccc1Oc2nc(ncc2S(=O)(=O)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J21	compound treatment	1.212	0.0176	0.24	1.399	0.0743	1.01	0.8843	0.8501	1910193	Bionet1_003479	O=C(N/N=C/c1cnc(s1)S(=O)(=O)c2ccccc2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	J22	compound treatment	1.164	-0.0304	-0.41	1.309	-0.0157	-0.21	-0.4414	-0.9545	1427611	Bionet1_003480	CN1CCN(CC1)c2nc(ncc2S(=O)(=O)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K03	compound treatment	1.175	-0.0194	-0.26	1.322	-0.00273	-0.04	-0.2111	-0.7999	1910194	Bionet1_003481	Clc1ncc(COc2ccc(/C=C\3/SC(=O)NC3=O)cc2)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K04	compound treatment	1.2	0.00564	0.08	1.32	-0.00473	-0.06	0.0081	0.0815	1910195	Bionet1_003482	CC(Sc1ccc(C)cc1)C(=O)NN=C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K05	compound treatment	1.146	-0.0484	-0.65	1.337	0.0123	0.17	-0.3431	-0.5094	1194760	Bionet1_003483	O=C(C1CN(CC1C(=O)c2ccccc2)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K06	compound treatment	1.2	0.00564	0.08	1.333	0.00827	0.11	0.1335	0.9816	1910196	Bionet1_003484	CC(Sc1ccccc1)C(=O)NN=C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K07	compound treatment	1.132	-0.0624	-0.84	1.335	0.0103	0.14	-0.4959	-0.5814	1709080	Bionet1_003485	Cc1ccc(cc1)C(=O)C2CN(CC2C(=O)c3ccc(C)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K08	compound treatment	1.216	0.0216	0.29	1.353	0.0283	0.39	0.479	0.9906	1910197	Bionet1_003486	COc1cccc(SC(C)C(=O)NN=C(c2ccccc2)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K09	compound treatment	1.229	0.0346	0.47	1.292	-0.0327	-0.45	0.0148	0.0229	1260235	Bionet1_003487	Oc1c(C(=O)NCc2cccc(Cl)c2)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K10	compound treatment	1.22	0.0256	0.35	1.371	0.0463	0.63	0.6907	0.96	1910198	Bionet1_003488	CC(Sc1ccc(Cl)cc1)C(=O)NN=C(c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K11	compound treatment	1.211	0.0166	0.22	1.359	0.0343	0.47	0.4891	0.9435	1910199	Bionet1_003489	CC(C)(C)c1cc(C#N)c(OCc2ccc(cc2)C(F)(F)F)c(C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K12	compound treatment	1.217	0.0226	0.31	1.291	-0.0337	-0.46	-0.1093	-0.198	1910200	Bionet1_003490	CC1CN(CC(=O)NN=C(c2ccccc2)c3ccccc3)CC(C)O1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K13	compound treatment	1.147	-0.0474	-0.64	1.335	0.0103	0.14	-0.3528	-0.5394	1910201	Bionet1_003491	CCCc1ccc(c(F)c1)c2ccc(cc2)C(=O)Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K14	compound treatment	1.228	0.0336	0.45	1.335	0.0103	0.14	0.4199	0.8841	1910202	Bionet1_003492	O=C(CN1CCN(CC1)c2ncccn2)NN=C(c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K15	compound treatment	1.208	0.0136	0.18	1.309	-0.0157	-0.21	-0.0216	-0.0765	1910203	Bionet1_003493	Brc1nc(Br)n(n1)C(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K16	compound treatment	1.228	0.0336	0.45	1.358	0.0333	0.45	0.6416	1.0	1673550	Bionet1_003494	COc1ccc(OC)c(c1)n2c(C)ccc2c3ccc(cc3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K17	compound treatment	1.243	0.0486	0.66	1.345	0.0203	0.28	0.6594	0.9261	1910204	Bionet1_003495	CC(C)(C)c1cc(C#N)c(OC(=O)c2ccc(cc2)C(F)(F)F)c(C#N)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K18	compound treatment	1.233	0.0386	0.52	1.344	0.0193	0.26	0.5543	0.9497	1910205	Bionet1_003496	Cc1ccc(Sc2nc(cc(c2C#N)C(F)(F)F)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K19	compound treatment	1.184	-0.0104	-0.14	1.353	0.0283	0.39	0.1737	0.4236	1910206	Bionet1_003497	Clc1ncc(COc2ccccc2/C=N/NC(=O)c3cccnc3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K20	compound treatment	1.199	0.00464	0.06	1.377	0.0523	0.71	0.5482	0.7662	1588099	Bionet1_003498	COC(=O)c1cc(C#N)c(NCc2cc(no2)c3ccc(OC)cc3)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K21	compound treatment	1.124	-0.0704	-0.95	1.384	0.0593	0.81	-0.0998	-0.08	1910207	Bionet1_003499	FC(F)(F)c1ccc(cc1)C(=O)N/N=C/c2ccccc2Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	K22	compound treatment	1.252	0.0576	0.78	1.391	0.0663	0.9	1.1888	0.9972	1910208	Bionet1_003500	CC(=O)c1cc(C#N)c(NCc2cc(no2)c3ccc(Cl)cc3)nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L03	compound treatment	1.199	0.00464	0.06	1.315	-0.00973	-0.13	-0.0496	-0.3382	1910209	Bionet1_003501	Fc1ccc(cc1)c2n[nH]cc2/C=N\OCc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L04	compound treatment	1.167	-0.0274	-0.37	1.314	-0.0107	-0.15	-0.3645	-0.9179	1910210	Bionet1_003502	COC(=O)c1sccc1Oc2nc(SC)nc3n(ncc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L05	compound treatment	1.194	-3.64E-4	0.0	1.288	-0.0367	-0.5	-0.3577	-0.714	1910211	Bionet1_003503	COC(=O)c1ccc(/N=C/c2cnc(s2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L06	compound treatment	1.181	-0.0134	-0.18	1.293	-0.0317	-0.43	-0.4335	-0.9247	1910212	Bionet1_003504	Cc1ccc2SCc3cnc(SCc4ccc(F)cc4)nc3-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L07	compound treatment	1.163	-0.0314	-0.42	1.287	-0.0377	-0.51	-0.663	-0.9953	1910213	Bionet1_003505	Fc1ccc(cc1)c2n[nH]cc2/C=N\Nc3ccnc4cc(Cl)ccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L08	compound treatment	1.164	-0.0304	-0.41	1.251	-0.0737	-1.01	-1.0006	-0.9216	1910214	Bionet1_003506	Cc1ccc2SCc3cnc(SCc4c(F)cccc4Cl)nc3-c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L09	compound treatment	1.244	0.0496	0.67	1.333	0.00827	0.11	0.5532	0.8147	1910215	Bionet1_003507	CN(C)/C=C/C(=O)C(Cc1c(Cl)cccc1Cl)C(=O)/C=C\N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L10	compound treatment	1.211	0.0166	0.22	1.262	-0.0627	-0.86	-0.4462	-0.5045	1579848	Bionet1_003508	Cc1ccc(cc1)S(=O)(=O)c2cnc(nc2N3CCOCC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L11	compound treatment	1.188	-0.00636	-0.09	1.325	2.66E-4	0.0	-0.0581	-0.6766	1910216	Bionet1_003509	CN(C)/C=C/C(=O)C(Cc1c(F)cccc1Cl)C(=O)/C=C\N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L12	compound treatment	1.159	-0.0354	-0.48	1.301	-0.0237	-0.32	-0.5662	-0.9821	1664188	Bionet1_003510	CCN(CC)c1nc(ncc1S(=O)(=O)c2ccc(C)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L13	compound treatment	1.153	-0.0414	-0.56	1.348	0.0233	0.32	-0.1702	-0.2652	1542564	Bionet1_003511	Cc1ccccc1OCC2Cc3c(O2)nc(c(C#N)c3n4cccc4)n5cccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L14	compound treatment	1.211	0.0166	0.22	1.289	-0.0357	-0.49	-0.1859	-0.3464	1910217	Bionet1_003512	CSc1nc(Oc2ccc3ccccc3c2)c4cnn(c5ccc(C)cc5)c4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L15	compound treatment	1.124	-0.0704	-0.95	1.324	-7.34E-4	-0.01	-0.6783	-0.7145	1494141	Bionet1_003513	CC(CO)Oc1ccc(cc1)c2ccc(c(F)c2)c3ccc(OC(C)CO)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L16	compound treatment	1.183	-0.0114	-0.15	1.302	-0.0227	-0.31	-0.3276	-0.9473	1566962	Bionet1_003514	COc1cc2ncnc(Nc3ccc(Br)cc3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L17	compound treatment	1.215	0.0206	0.28	1.284	-0.0407	-0.56	-0.1959	-0.3153	1011790	Bionet1_003515	CCCCCCCCCCCCCCCCCC[n+]1ccccc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L18	compound treatment	1.168	-0.0264	-0.36	1.296	-0.0287	-0.39	-0.5286	-0.9988	1277018	Bionet1_003516	COc1cc2ncnc(Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L19	compound treatment	1.221	0.0266	0.36	1.307	-0.0177	-0.24	0.0831	0.1919	1910218	Bionet1_003517	CS(=O)(=O)/C(=C\c1cnc(s1)S(=O)(=O)c2ccccc2)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L20	compound treatment	1.177	-0.0174	-0.23	1.275	-0.0497	-0.68	-0.6452	-0.8992	1473188	Bionet1_003518	COc1cc2ncnc(Nc3ccc(Cl)cc3Cl)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L21	compound treatment	1.18	-0.0144	-0.19	1.336	0.0113	0.15	-0.0284	-0.1148	1910219	Bionet1_003519	FC(=C(F)CCSc1nc2nccc(c3ccc(F)cc3)n2n1)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	L22	compound treatment	1.176	-0.0184	-0.25	1.295	-0.0297	-0.41	-0.4619	-0.9721	1603939	Bionet1_003520	COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M03	compound treatment	1.19	-0.00436	-0.06	1.339	0.0143	0.19	0.0959	0.472	1910220	Bionet1_003521	Cc1ccc(Oc2ccccc2/C=N/NC(=O)c3ccc(cc3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M04	compound treatment	1.209	0.0146	0.2	1.338	0.0133	0.18	0.2675	0.999	1910221	Bionet1_003522	CN(CC(=O)NCc1cc(no1)c2ccc(Cl)cc2)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M05	compound treatment	1.216	0.0216	0.29	1.311	-0.0137	-0.19	0.074	0.2133	1910222	Bionet1_003523	Oc1ccn(Nc2ncccc2[N+](=O)[O-])c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M06	compound treatment	1.251	0.0566	0.76	1.305	-0.0197	-0.27	0.35	0.4321	1910223	Bionet1_003524	Cc1cc(Sc2cccc(c2)C(F)(F)F)nc3ccc(Cl)cc13
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M07	compound treatment	1.179	-0.0154	-0.21	1.282	-0.0427	-0.58	-0.5586	-0.9032	1910224	Bionet1_003525	CSc1nc(N(C)NC(=O)c2ccc(Cl)cc2)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M08	compound treatment	1.223	0.0286	0.39	1.33	0.00527	0.07	0.324	0.8244	1375673	Bionet1_003526	Cc1ccc(cc1)n2nc(cc2c3ccc(Cl)cc3)C(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M09	compound treatment	1.155	-0.0394	-0.53	1.316	-0.00873	-0.12	-0.4597	-0.8447	1910225	Bionet1_003527	CSc1nc(Sc2cc(Cl)ccc2Cl)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M10	compound treatment	1.215	0.0206	0.28	1.283	-0.0417	-0.57	-0.2056	-0.3245	1910226	Bionet1_003528	Clc1ccccc1c2cc(on2)C(=O)NCc3cc(no3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M11	compound treatment	1.208	0.0136	0.18	1.308	-0.0167	-0.23	-0.0313	-0.1067	1910227	Bionet1_003529	CSc1nc(Sc2ccc(Cl)cc2Cl)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M12	compound treatment	1.224	0.0296	0.4	1.344	0.0193	0.26	0.4685	0.9793	1910228	Bionet1_003530	COc1cccc(c1)C(=O)Nc2ccc(/C=C/c3nc4ccccc4o3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M13	compound treatment	1.204	0.00964	0.13	1.361	0.0363	0.49	0.4416	0.8636	1910229	Bionet1_003531	CSc1nc(Oc2cc(Cl)c(Cl)cc2Cl)c3ccccc3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M14	compound treatment	1.225	0.0306	0.41	1.346	0.0213	0.29	0.4973	0.985	1910230	Bionet1_003532	Fc1cccc(F)c1C(=O)Nc2ccc(/C=C/c3nc4ccccc4o3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M15	compound treatment	1.267	0.0726	0.98	1.329	0.00427	0.06	0.734	0.7478	1910231	Bionet1_003533	CSc1nc(Oc2cc(Cl)c(Cl)cc2Cl)cc(n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M16	compound treatment	1.134	-0.0604	-0.81	1.302	-0.0227	-0.31	-0.795	-0.9124	1370465	Bionet1_003534	Fc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M17	compound treatment	1.182	-0.0124	-0.17	1.324	-7.34E-4	-0.01	-0.125	-0.7482	1910232	Bionet1_003535	COc1ccc(CCOC(=O)Nc2cn(C)nc2C(F)(F)F)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M18	compound treatment	1.248	0.0536	0.72	1.356	0.0313	0.43	0.8131	0.9682	1680960	Bionet1_003536	Cc1ccc(cc1)S(=O)(=O)N2C(COc3ccc(C)cc23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M19	compound treatment	1.242	0.0476	0.64	1.316	-0.00873	-0.12	0.3702	0.5664	1728119	Bionet1_003537	CC1COc2ccccc2N1S(=O)(=O)c3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M20	compound treatment	1.251	0.0566	0.76	1.326	0.00127	0.02	0.5525	0.7229	1518407	Bionet1_003538	Cc1ccc2OCC(N(c2c1)S(=O)(=O)c3ccc(F)cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M21	compound treatment	1.176	-0.0184	-0.25	1.395	0.0703	0.96	0.5024	0.5076	1615505	Bionet1_003539	COc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	M22	compound treatment	1.246	0.0516	0.7	1.376	0.0513	0.7	0.9869	1.0	1585848	Bionet1_003540	COc1ccc(Oc2c(Cl)cnn(c3ccc(Cl)c(Cl)c3)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N03	compound treatment	1.175	-0.0194	-0.26	1.287	-0.0377	-0.51	-0.5486	-0.9506	1910233	Bionet1_003541	FC(F)(F)c1cccc(c1)N2CCN(CC(=O)c3cccs3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N04	compound treatment	1.155	-0.0394	-0.53	1.26	-0.0647	-0.88	-0.9997	-0.9704	1303887	Bionet1_003542	COc1cc2ncnc(Nc3ccc(cc3)N4CCOCC4)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N05	compound treatment	1.197	0.00264	0.04	1.298	-0.0267	-0.36	-0.2326	-0.6351	1910234	Bionet1_003543	COc1ccc(cc1)C2=NN(C(C2)c3ccc(Cl)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N06	compound treatment	1.169	-0.0254	-0.34	1.315	-0.00973	-0.13	-0.3358	-0.915	1412837	Bionet1_003544	COc1cc2ncnc(NCc3ccc(Cl)cc3Cl)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N07	compound treatment	1.196	0.00164	0.02	1.298	-0.0267	-0.36	-0.2422	-0.6631	1910235	Bionet1_003545	Fc1ccc(N2N=C(CC2c3ccccc3)c4ccc(Cl)cc4)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N08	compound treatment	1.141	-0.0534	-0.72	1.267	-0.0577	-0.79	-1.0657	-0.999	1910236	Bionet1_003546	COc1cc2ncnc(NCc3ccccc3C(F)(F)F)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N09	compound treatment	1.191	-0.00336	-0.05	1.361	0.0363	0.49	0.3176	0.6395	1910237	Bionet1_003547	CC(=O)Nc1ccc(cc1)C2CC(=NN2c3ccccc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N10	compound treatment	1.134	-0.0604	-0.81	1.284	-0.0407	-0.56	-0.9686	-0.9826	1736243	Bionet1_003548	Clc1ccc2c(Nc3ccc(I)cc3)ncnc2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N11	compound treatment	1.142	-0.0524	-0.71	1.321	-0.00373	-0.05	-0.5355	-0.7561	1910238	Bionet1_003549	COc1cccc(c1)C2=NN(C(C2)c3ccc(Cl)cc3)c4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N12	compound treatment	1.207	0.0126	0.17	1.263	-0.0617	-0.84	-0.4747	-0.5527	1284145	Bionet1_003550	COc1cc2ncnc(NCc3ccc(Cl)c(Cl)c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N13	compound treatment	1.153	-0.0414	-0.56	1.28	-0.0447	-0.61	-0.8259	-0.999	1910239	Bionet1_003551	COc1ccc(cc1)c2cnc3nc(SCCC(=C(F)F)F)nn3c2N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N14	compound treatment	1.196	0.00164	0.02	1.291	-0.0337	-0.46	-0.3097	-0.6724	1646584	Bionet1_003552	COc1ccc(CNc2ncnc3cc(OC)c(OC)cc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N15	compound treatment	1.231	0.0366	0.49	1.327	0.00227	0.03	0.3713	0.7499	1910240	Bionet1_003553	FC(=C(F)CCSc1nc2nccc(/C=C\c3cccs3)n2n1)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N16	compound treatment	1.1	-0.0944	-1.27	1.293	-0.0317	-0.43	-1.2062	-0.8971	1910241	Bionet1_003554	COc1cc2ncnc(NCc3cccc(c3)C(F)(F)F)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N17	compound treatment	1.247	0.0526	0.71	1.33	0.00527	0.07	0.5529	0.7747	1463826	Bionet1_003555	Cc1ccc(cc1)C2CN(CC2C(=O)c3ccc(F)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N18	compound treatment	1.203	0.00864	0.12	1.304	-0.0207	-0.28	-0.1175	-0.3844	1631243	Bionet1_003556	COc1ccc(CCNc2ncnc3cc(OC)c(OC)cc23)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N19	compound treatment	1.176	-0.0184	-0.25	1.31	-0.0147	-0.2	-0.3172	-0.9946	1127217	Bionet1_003557	Clc1ccc(cc1)C2CN(CC2C(=O)c3cccs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N20	compound treatment	1.152	-0.0424	-0.57	1.306	-0.0187	-0.26	-0.5848	-0.9341	1398126	Bionet1_003558	COc1cc2ncnc(NCCc3ccc(cc3)S(=O)(=O)N)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N21	compound treatment	1.267	0.0726	0.98	1.337	0.0123	0.17	0.8112	0.816	1910242	Bionet1_003559	COc1ccc(NC(=O)c2ccccc2SCCC(=C(F)F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	N22	compound treatment	1.14	-0.0544	-0.73	1.3	-0.0247	-0.34	-0.7571	-0.9379	1910243	Bionet1_003560	Clc1ccc(SCCNc2ncnc3cc(Cl)ccc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O03	compound treatment	1.16	-0.0344	-0.46	1.307	-0.0177	-0.24	-0.4988	-0.954	1353850	Bionet1_003561	CC(C)(C)C1COc2ccccc2N1S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O04	compound treatment	1.217	0.0226	0.31	1.362	0.0373	0.51	0.5753	0.9703	1435481	Bionet1_003562	COc1ccc(Oc2c(cnn(c3ccc(C)cc3)c2=O)N4CCOCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O05	compound treatment	1.215	0.0206	0.28	1.284	-0.0407	-0.56	-0.1959	-0.3153	1333895	Bionet1_003563	Clc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O06	compound treatment	1.178	-0.0164	-0.22	1.33	0.00527	0.07	-0.1053	-0.4537	1364036	Bionet1_003564	COc1ccc(Oc2c(Cl)cnn(c3cccc(C)c3C)c2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O07	compound treatment	1.123	-0.0714	-0.96	1.307	-0.0177	-0.24	-0.8518	-0.8581	1147999	Bionet1_003565	COc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O08	compound treatment	1.196	0.00164	0.02	1.305	-0.0197	-0.27	-0.1747	-0.6469	1910244	Bionet1_003566	FC(F)(F)c1cc(nc(N2CCOCC2)c1C#N)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O09	compound treatment	1.26	0.0656	0.89	1.371	0.0463	0.63	1.0722	0.9862	1910245	Bionet1_003567	Cn1nc(OCC(O)CS(=O)(=O)c2ccc(Cl)cc2)cc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O10	compound treatment	1.18	-0.0144	-0.19	1.323	-0.00173	-0.02	-0.1537	-0.7875	1910246	Bionet1_003568	COC(=O)c1ccccc1Sc2nc(C)cc(c2C#N)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O11	compound treatment	1.179	-0.0154	-0.21	1.294	-0.0307	-0.42	-0.4429	-0.9473	1510173	Bionet1_003569	CN1CCN(CC1)c2cnn(c3ccc(F)cc3)c(=O)c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O12	compound treatment	1.22	0.0256	0.35	1.367	0.0423	0.58	0.6521	0.9702	1458590	Bionet1_003570	COc1ccc(cc1)C2C(CN3CCOCC3)C(=O)N2c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O13	compound treatment	1.213	0.0186	0.25	1.294	-0.0307	-0.42	-0.1186	-0.2426	1515952	Bionet1_003571	CN(Cc1ccccc1)c2cnn(c3ccc(F)cc3)c(=O)c2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O14	compound treatment	1.188	-0.00636	-0.09	1.324	-7.34E-4	-0.01	-0.0678	-0.7842	1910247	Bionet1_003572	COc1cccc(c1)C(=O)Nc2ccc(/C=C/c3nc4ccccc4s3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O15	compound treatment	1.218	0.0236	0.32	1.318	-0.00673	-0.09	0.1605	0.4838	1248744	Bionet1_003573	OCc1cnc(n1Cc2ccccc2)S(=O)(=O)Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O16	compound treatment	1.194	-3.64E-4	0.0	1.34	0.0153	0.21	0.1437	0.6903	1698392	Bionet1_003574	CCS(=O)(=O)c1ccc(c2csc(n2)c3ccccc3)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O17	compound treatment	1.231	0.0366	0.49	1.311	-0.0137	-0.19	0.2171	0.4107	1910248	Bionet1_003575	Clc1ccc(cc1)c2cc(CS(=O)(=O)c3cccc(Cl)c3)on2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O18	compound treatment	1.223	0.0286	0.39	1.372	0.0473	0.64	0.7289	0.97	1388552	Bionet1_003576	CCS(=O)(=O)c1ccc(c2csc(n2)c3ccccn3)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O19	compound treatment	1.218	0.0236	0.32	1.319	-0.00573	-0.08	0.1702	0.5184	1654004	Bionet1_003577	CC(C)(C)c1ccc(CN2C(=O)CCSc3ccc(Cl)cc23)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O20	compound treatment	1.218	0.0236	0.32	1.345	0.0203	0.28	0.4209	0.9975	1329709	Bionet1_003578	CCS(=O)(=O)c1ccc(c2csc(n2)c3ccncc3)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O21	compound treatment	1.212	0.0176	0.24	1.383	0.0583	0.79	0.7301	0.8802	1910249	Bionet1_003579	Clc1ccc2SCCC(=O)N(Cc3ccc(Cl)c(Cl)c3)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	O22	compound treatment	1.246	0.0516	0.7	1.363	0.0383	0.52	0.8616	0.9899	1910250	Bionet1_003580	Cc1ccc(cc1)n2ncc(Cl)c(Sc3ccc(Cl)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P03	compound treatment	1.156	-0.0384	-0.52	1.348	0.0233	0.32	-0.1416	-0.2333	1910251	Bionet1_003581	FC(=C(F)CCSc1ncn(n1)c2ncc(cc2Cl)C(F)(F)F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P04	compound treatment	1.175	-0.0194	-0.26	1.242	-0.0827	-1.13	-0.9825	-0.8484	1440383	Bionet1_003582	OC(CNc1ncnc2cc(Cl)ccc12)c3ccc4ccccc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P05	compound treatment	1.19	-0.00436	-0.06	1.296	-0.0287	-0.39	-0.3187	-0.8043	1910252	Bionet1_003583	FC(=C(F)CCSc1ncccc1C(=O)NC2CCCCCCC2)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P06	compound treatment	1.145	-0.0494	-0.67	1.228	-0.0967	-1.32	-1.4036	-0.9499	1910253	Bionet1_003584	Cc1ccc(CSC/2=Nc3ccccc3\C2=N/Nc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P07	compound treatment	1.167	-0.0274	-0.37	1.278	-0.0467	-0.64	-0.7117	-0.9663	1295777	Bionet1_003585	CCOC(=O)c1c2ccc(OCc3ccc(C)cc3)cc2n4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P08	compound treatment	1.187	-0.00736	-0.1	1.243	-0.0817	-1.11	-0.8584	-0.7671	1910254	Bionet1_003586	N#Cc1cc(oc1/N=C/c2ccc(Oc3ccccc3)cc2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P09	compound treatment	1.065	-0.129	-1.75	1.219	-0.106	-1.44	-2.2536	-0.9955	1436818	Bionet1_003587	COc1ccc2ccccc2c1S(=O)N3CCN(Cc4ccccc4)CC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P10	compound treatment	0.622	-0.572	-7.72	0.438	-0.887	-12.09	-14.0102	-0.9765	1910255	Bionet1_003588	Brc1ccc(/C=N/c2oc(cc2C#N)c3ccccc3)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P11	compound treatment	1.146	-0.0484	-0.65	1.28	-0.0447	-0.61	-0.8927	-0.9994	1910256	Bionet1_003589	COc1ccc2ccccc2c1S(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P12	compound treatment	1.143	-0.0514	-0.69	1.216	-0.109	-1.48	-1.5384	-0.94	1910257	Bionet1_003590	FC(F)(F)c1ccccc1C(=O)Nc2oc(cc2C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P13	compound treatment	1.171	-0.0234	-0.32	1.308	-0.0167	-0.23	-0.3842	-0.9874	1147892	Bionet1_003591	COc1ccc2ccccc2c1S(=O)N3CCN(CC3)c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P14	compound treatment	1.152	-0.0424	-0.57	1.269	-0.0557	-0.76	-0.9415	-0.9901	1910258	Bionet1_003592	Cc1ccc(cc1)S(=O)(=O)NNC(=O)c2cc3CCc4ccccc4-c3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P15	compound treatment	1.19	-0.00436	-0.06	1.291	-0.0337	-0.46	-0.3669	-0.7911	1521904	Bionet1_003593	COc1ccc2ccccc2c1S(=O)N3CCN(CC3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P16	compound treatment	1.134	-0.0604	-0.81	1.288	-0.0367	-0.5	-0.93	-0.9728	1910259	Bionet1_003594	Clc1ccc(/C=N/NC(=O)c2cc3CCc4ccccc4-c3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P17	compound treatment	1.168	-0.0264	-0.36	1.273	-0.0517	-0.71	-0.7503	-0.9497	1237317	Bionet1_003595	CCOC(=O)c1c2ccc(OCc3c(F)cccc3Cl)cc2n4ccccc14
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P18	compound treatment	1.115	-0.0794	-1.07	1.301	-0.0237	-0.32	-0.9859	-0.8815	1910260	Bionet1_003596	FC(F)(F)c1cccc(/C=N/NC(=O)c2cc3CCc4ccccc4-c3s2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P19	compound treatment	1.205	0.0106	0.14	1.298	-0.0267	-0.36	-0.1563	-0.399	1910261	Bionet1_003597	FC(=C(F)CCSc1ncccc1C(=O)NCc2ccccc2)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P20	compound treatment	1.137	-0.0574	-0.77	1.314	-0.0107	-0.15	-0.6507	-0.8262	1910262	Bionet1_003598	Fc1ccc(/C=N/NC(=O)c2cc3CCc4ccccc4-c3s2)cc1F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P21	compound treatment	1.167	-0.0274	-0.37	1.385	0.0603	0.82	0.3201	0.3553	1667164	Bionet1_003599	COC(=O)c1sccc1NC(=O)COc2ccsc2C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.578	P22	compound treatment	1.235	0.0406	0.55	1.296	-0.0287	-0.39	0.1106	0.1641	1446805	Bionet1_003600	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A03	compound treatment	1.229	0.016	0.22	1.327	7.87E-4	0.01	0.16	0.7414	1376399	Bionet1_003601	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A04	compound treatment	1.243	0.03	0.4	1.33	0.00379	0.05	0.3225	0.791	1910263	Bionet1_003602	FC(F)(F)c1cccc(c1)N2CCN(Cc3cnc(Cl)s3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A05	compound treatment	1.211	-0.00202	-0.03	1.322	-0.00421	-0.06	-0.0599	-0.9418	1183828	Bionet1_003603	Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCN(CC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A06	compound treatment	1.2	-0.013	-0.18	1.338	0.0118	0.16	-0.0105	-0.0443	1910264	Bionet1_003604	COc1cc(Br)c(O)c(/C=N/Cc2ccc3OCOc3c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A07	compound treatment	1.218	0.00498	0.07	1.335	0.00879	0.12	0.1322	0.9626	1910265	Bionet1_003605	FC(F)(F)c1ccccc1C(=O)N2CCN(CC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A08	compound treatment	1.219	0.00598	0.08	1.394	0.0678	0.92	0.7107	0.7659	1910266	Bionet1_003606	COc1cc(Br)c(O)c(/C=N/c2ccc(cc2)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A09	compound treatment	1.186	-0.027	-0.36	1.278	-0.0482	-0.66	-0.7226	-0.9613	1910267	Bionet1_003607	FC(F)(F)c1ccccc1S(=O)(=O)N2CCN(CC2)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A10	compound treatment	1.27	0.057	0.77	1.339	0.0128	0.17	0.6669	0.846	1910268	Bionet1_003608	COc1cc(Br)cc(/C=N/c2cccc(Br)c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A11	compound treatment	1.252	0.039	0.53	1.31	-0.0162	-0.22	0.2155	0.3778	1350151	Bionet1_003609	Clc1cccc(C(=O)Nc2oc(cc2C#N)c3ccccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A12	compound treatment	1.265	0.052	0.7	1.346	0.0198	0.27	0.6867	0.9139	1910269	Bionet1_003610	COc1cc(OC)cc(/N=C/c2cc(Br)cc(OC)c2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A13	compound treatment	1.18	-0.033	-0.45	1.337	0.0108	0.15	-0.211	-0.4497	1910270	Bionet1_003611	FC(F)(F)c1cccc(CSc2nc(ccc2C#N)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A14	compound treatment	1.201	-0.012	-0.16	1.32	-0.00621	-0.08	-0.1746	-0.9542	1910271	Bionet1_003612	COC(=O)c1cccc(/N=C/c2cc(Br)cc(OC)c2O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A15	compound treatment	1.17	-0.043	-0.58	1.355	0.0288	0.39	-0.1328	-0.1895	1289590	Bionet1_003613	Clc1cccc(C(=O)N2CCN(CC2)C(=O)c3ccccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A16	compound treatment	1.238	0.025	0.34	1.384	0.0578	0.79	0.7955	0.9282	1910272	Bionet1_003614	COc1cc(Br)c(O)c(/C=N/Cc2ccc(OC)c(OC)c2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A17	compound treatment	1.232	0.019	0.26	1.344	0.0178	0.24	0.3526	0.9996	1201217	Bionet1_003615	Clc1ccc(C(=O)N2CCN(CC2)C(=O)c3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A18	compound treatment	1.273	0.06	0.81	1.366	0.0398	0.54	0.9558	0.9811	1910273	Bionet1_003616	Oc1c(Br)cc(Br)cc1/C=N/Cc2ccc(F)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A19	compound treatment	1.24	0.027	0.36	1.328	0.00179	0.02	0.2746	0.7528	1213082	Bionet1_003617	COc1cc2ncnc(NCC(O)c3ccc4ccccc4c3)c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A20	compound treatment	1.254	0.041	0.55	1.323	-0.00321	-0.04	0.36	0.649	1489756	Bionet1_003618	CN1OC(CC(=O)NCc2ccc(F)cc2)N(C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A21	compound treatment	1.184	-0.029	-0.39	1.334	0.00779	0.11	-0.2017	-0.4973	1910274	Bionet1_003619	CCOC(=O)c1ccc(/N=C/c2ccccc2Oc3ccc(F)c(F)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	A22	compound treatment	1.217	0.00398	0.05	1.346	0.0198	0.27	0.2288	0.8315	1910275	Bionet1_003620	FC(F)(F)c1ccc2[nH]cc(c3ncc(cc3Cl)C(F)(F)F)c(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B03	compound treatment	1.23	0.017	0.23	1.327	7.87E-4	0.01	0.1696	0.7394	1910276	Bionet1_003621	Cc1ccc(CSc2nnc(o2)c3cc4CCc5ccccc5-c4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B04	compound treatment	1.188	-0.025	-0.34	1.349	0.0228	0.31	-0.0189	-0.0413	1910277	Bionet1_003622	CCOC(=O)/C(=N\Nc1ccccc1[N+](=O)[O-])/NC(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B05	compound treatment	1.254	0.041	0.55	1.332	0.00579	0.08	0.4467	0.7999	1910278	Bionet1_003623	CCOC(=O)c1cnc2ccc(OC)cc2c1Nc3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B06	compound treatment	1.213	-1.88E-5	0.0	1.335	0.00879	0.12	0.0845	0.7056	1910279	Bionet1_003624	Cc1ccc(cc1)C(=O)Oc2ccc(cc2)c3nccc(n3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B07	compound treatment	1.232	0.019	0.26	1.337	0.0108	0.15	0.2851	0.9654	1247702	Bionet1_003625	CCOC(=O)c1cnc2ccc(OC)cc2c1Nc3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B08	compound treatment	1.234	0.021	0.28	1.353	0.0268	0.37	0.4584	0.9921	1910280	Bionet1_003626	Fc1ccc(cc1)C(=O)Oc2ccc(cc2)c3nccc(n3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B09	compound treatment	1.212	-0.00102	-0.01	1.338	0.0118	0.16	0.1039	0.6443	1910281	Bionet1_003627	Clc1ccc(cc1)C(=O)ON=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B10	compound treatment	1.193	-0.02	-0.27	1.32	-0.00621	-0.08	-0.2509	-0.8863	1739750	Bionet1_003628	O=C(Cc1ccccc1)Oc2ccc(cc2)c3nccc(n3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B11	compound treatment	1.208	-0.00502	-0.07	1.367	0.0408	0.56	0.3454	0.6165	1910282	Bionet1_003629	Fc1ccc(cc1)C(=O)ON=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B12	compound treatment	1.167	-0.046	-0.62	1.336	0.00979	0.13	-0.3446	-0.5427	1910283	Bionet1_003630	Clc1ccc(cc1)C(=O)Oc2ccc(cc2)c3nccc(n3)c4ccccn4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B13	compound treatment	1.238	0.025	0.34	1.37	0.0438	0.6	0.6605	0.9634	1910284	Bionet1_003631	Cc1ccc(cc1)C(=O)ON=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B14	compound treatment	1.231	0.018	0.24	1.324	-0.00221	-0.03	0.1502	0.6144	1910285	Bionet1_003632	CCCCCCCCS(=O)(=O)c1nnc(o1)c2ccc(OC)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B15	compound treatment	1.244	0.031	0.42	1.331	0.00479	0.07	0.3417	0.8077	1910286	Bionet1_003633	Clc1cccc(c1)C(=O)ON=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B16	compound treatment	1.215	0.00198	0.03	1.368	0.0418	0.57	0.4218	0.7395	1910287	Bionet1_003634	O=S(=O)(Oc1ccc(cc1)c2nccc(n2)c3ccccn3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B17	compound treatment	1.237	0.024	0.32	1.343	0.0168	0.23	0.3906	0.9857	1910288	Bionet1_003635	O=C(ON=C1CCN(CC1)S(=O)(=O)c2ccccc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B18	compound treatment	1.22	0.00698	0.09	1.302	-0.0242	-0.33	-0.1669	-0.486	1910289	Bionet1_003636	CC(C)(C)c1ccc(cc1)c2nnc(SCc3ccc(cc3)[N+](=O)[O-])o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B19	compound treatment	1.212	-0.00102	-0.01	1.382	0.0558	0.76	0.5282	0.6942	1910290	Bionet1_003637	O=S(=O)(ON=C1CCN(CC1)S(=O)(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B20	compound treatment	1.207	-0.00602	-0.08	1.331	0.00479	0.07	-0.0113	-0.1081	1910291	Bionet1_003638	CC(C)(C)c1ccc(cc1)c2nnc(SCc3ccc(Cl)cc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B21	compound treatment	1.187	-0.026	-0.35	1.357	0.0308	0.42	0.0487	0.0889	1910292	Bionet1_003639	Cc1ccn2c(/C=C(\C#N)/c3ccccn3)c(nc2c1)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	B22	compound treatment	1.218	0.00498	0.07	1.361	0.0348	0.47	0.3829	0.7993	1910293	Bionet1_003640	Fc1cccc(Cl)c1COc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C03	compound treatment	1.19	-0.023	-0.31	1.286	-0.0402	-0.55	-0.6073	-0.9637	1217132	Bionet1_003641	CCOC(=O)c1ccc(NCc2ccccc2Oc3ccc(F)c(F)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C04	compound treatment	1.256	0.043	0.58	1.335	0.00879	0.12	0.4947	0.8356	1910294	Bionet1_003642	Fc1ccc(F)c2c(=O)c(c[nH]c12)c3ncc(cc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C05	compound treatment	1.228	0.015	0.2	1.307	-0.0192	-0.26	-0.0424	-0.128	1910295	Bionet1_003643	FC(F)(F)c1cnc(CC(=O)NCc2ccc(Cl)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C06	compound treatment	1.231	0.018	0.24	1.327	7.87E-4	0.01	0.1791	0.7377	1664882	Bionet1_003644	CN1OC(CC(=O)NCc2ccc(C)cc2)N(C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C07	compound treatment	1.22	0.00698	0.09	1.376	0.0498	0.68	0.5467	0.7976	1910296	Bionet1_003645	Cc1cccc(n1)n2cnc(c2)C(=O)N/N=C\c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C08	compound treatment	1.265	0.052	0.7	1.401	0.0748	1.02	1.217	0.9833	1910297	Bionet1_003646	Oc1ccn(CCc2c[nH]c3ccccc23)c(=O)c1C/C=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C09	compound treatment	1.212	-0.00102	-0.01	1.297	-0.0292	-0.4	-0.2914	-0.7311	1910298	Bionet1_003647	COc1ccc(cc1)S(=O)(=O)NNC(=O)c2cn(cn2)c3cccc(C)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C10	compound treatment	1.235	0.022	0.3	1.354	0.0278	0.38	0.4776	0.9926	1910299	Bionet1_003648	Cc1ccc(cc1)C(C#N)c2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C11	compound treatment	1.207	-0.00602	-0.08	1.369	0.0428	0.58	0.3552	0.6029	1910300	Bionet1_003649	COc1cc(/C=N/NC(=O)c2cn(cn2)c3cccc(C)n3)ccc1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C12	compound treatment	1.238	0.025	0.34	1.361	0.0348	0.47	0.5737	0.986	1910301	Bionet1_003650	Fc1ccc(cc1)C(C#N)c2ccc3c(cc(nc3n2)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C13	compound treatment	1.273	0.06	0.81	1.35	0.0238	0.32	0.8015	0.9194	1910302	Bionet1_003651	OC(CN1CCN(CC1)C(c2ccccc2)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C14	compound treatment	1.255	0.042	0.57	1.382	0.0558	0.76	0.9384	0.9894	1910303	Bionet1_003652	COC(=O)Cc1nnc2c3nnc(CC(=O)OC)n3c4ccccc4n12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C15	compound treatment	1.203	-0.01	-0.14	1.33	0.00379	0.05	-0.0591	-0.4082	1910304	Bionet1_003653	Oc1c(C(=O)Nc2ccc(cc2)C(F)(F)F)c(=O)n3CCCc4cccc1c43
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C16	compound treatment	1.229	0.016	0.22	1.374	0.0478	0.65	0.6132	0.8934	1910305	Bionet1_003654	CCOC(=O)c1cnc(nc1Oc2cccc(c2)C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C17	compound treatment	1.184	-0.029	-0.39	1.387	0.0608	0.83	0.3093	0.3374	1224256	Bionet1_003655	Oc1ccn(Cc2cccc(Cl)c2)c(=O)c1Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C18	compound treatment	1.205	-0.00802	-0.11	1.358	0.0318	0.43	0.23	0.5148	1910306	Bionet1_003656	CCOC(=O)c1cnc(nc1Oc2ccc(OC)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C19	compound treatment	1.207	-0.00602	-0.08	1.367	0.0408	0.56	0.3359	0.5975	1649511	Bionet1_003657	OCC(Cc1ccccc1)n2ccc(O)c(Cc3ccc(F)cc3)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C20	compound treatment	1.226	0.013	0.18	1.309	-0.0172	-0.23	-0.0421	-0.1439	1910307	Bionet1_003658	CN1c2ccsc2/C(=N/NC(=O)c3c(F)cccc3F)/CS1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C21	compound treatment	1.237	0.024	0.32	1.356	0.0298	0.41	0.516	0.9936	1910308	Bionet1_003659	O=C(Sc1nnc(SCCOc2ccccc2)s1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	C22	compound treatment	1.261	0.048	0.65	1.387	0.0608	0.83	1.0438	0.9925	1910309	Bionet1_003660	CN1c2ccsc2/C(=N/NC(=O)c3ccc(Cl)cc3)/CS1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D03	compound treatment	1.214	9.81E-4	0.01	1.33	0.00379	0.05	0.0459	0.8605	1910310	Bionet1_003661	COc1ccc(NC(=O)c2cc3CSc4ccc(C)cc4-c3s2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D04	compound treatment	1.271	0.058	0.78	1.371	0.0448	0.61	0.985	0.9925	1910311	Bionet1_003662	O=C(Oc1ccc(cc1)c2nccc(n2)c3cccs3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D05	compound treatment	1.227	0.014	0.19	1.378	0.0518	0.71	0.6327	0.8656	1910312	Bionet1_003663	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Nc4ccc(F)cc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D06	compound treatment	1.164	-0.049	-0.66	1.31	-0.0162	-0.22	-0.6239	-0.8948	1459451	Bionet1_003664	Cc1cccc(c1)C(=O)Oc2ccc(cc2)c3nccc(n3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D07	compound treatment	1.255	0.042	0.57	1.311	-0.0152	-0.21	0.2538	0.4208	1910313	Bionet1_003665	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Nc4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D08	compound treatment	1.183	-0.03	-0.4	1.317	-0.00921	-0.13	-0.3752	-0.8849	1730123	Bionet1_003666	O=C(Oc1ccc(cc1)c2nccc(n2)c3cccs3)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D09	compound treatment	1.203	-0.01	-0.14	1.35	0.0238	0.32	0.1338	0.3807	1910314	Bionet1_003667	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Nc4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D10	compound treatment	1.185	-0.028	-0.38	1.299	-0.0272	-0.37	-0.5297	-1.0	1910315	Bionet1_003668	CC(C)(C)c1ccc(cc1)C(=O)N/N=C/c2ccc(OCCCF)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D11	compound treatment	1.195	-0.018	-0.24	1.337	0.0108	0.15	-0.0679	-0.2389	1910316	Bionet1_003669	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Nc4ccc(Cl)cc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D12	compound treatment	1.193	-0.02	-0.27	1.316	-0.0102	-0.14	-0.2894	-0.9526	1910317	Bionet1_003670	FCCCOc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D13	compound treatment	1.245	0.032	0.43	1.337	0.0108	0.15	0.4091	0.8975	1378719	Bionet1_003671	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Oc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D14	compound treatment	1.223	0.00998	0.13	1.265	-0.0612	-0.83	-0.495	-0.5855	1910318	Bionet1_003672	Clc1ccc(COc2ccc(/C=C\3/SC(=O)NC3=O)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D15	compound treatment	1.143	-0.07	-0.94	1.31	-0.0162	-0.22	-0.8243	-0.8496	1379260	Bionet1_003673	Cc1ccc2SCc3cc(sc3-c2c1)C(=O)Oc4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D16	compound treatment	1.246	0.033	0.44	1.329	0.00279	0.04	0.3415	0.7647	1910319	Bionet1_003674	Brc1ccc(COc2ccc(/C=C\3/SC(=O)NC3=O)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D17	compound treatment	1.243	0.03	0.4	1.291	-0.0352	-0.48	-0.0535	-0.0853	1910320	Bionet1_003675	Fc1ccccc1N2CCN(CC(=O)Nc3nnc(s3)C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D18	compound treatment	1.234	0.021	0.28	1.337	0.0108	0.15	0.3042	0.9535	1645641	Bionet1_003676	O=C(NC1CCCCC1)Oc2ccc(cc2)c3nccc(n3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D19	compound treatment	1.228	0.015	0.2	1.382	0.0558	0.76	0.6808	0.865	1910321	Bionet1_003677	Fc1ccc(cc1)N2CCN(CC(=O)Nc3nnc(s3)C(F)(F)F)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D20	compound treatment	1.202	-0.011	-0.15	1.334	0.00779	0.11	-0.03	-0.1644	1910322	Bionet1_003678	CN1C(=O)N(C)C(=O)C(=Cc2ccc(OCc3ccccc3)cc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D21	compound treatment	1.2	-0.013	-0.18	1.289	-0.0372	-0.51	-0.483	-0.8995	1910323	Bionet1_003679	Clc1ccccc1c2nc(no2)c3cc(oc3n4cccc4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	D22	compound treatment	1.169	-0.044	-0.59	1.338	0.0118	0.16	-0.3063	-0.4978	1394938	Bionet1_003680	O=C(Oc1ccc(cc1)c2nccc(n2)c3cccs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E03	compound treatment	1.19	-0.023	-0.31	1.294	-0.0322	-0.44	-0.5302	-0.9856	1387635	Bionet1_003681	Oc1ccn(Cc2ccc(F)cc2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E04	compound treatment	1.216	0.00298	0.04	1.334	0.00779	0.11	0.1035	0.9117	1910324	Bionet1_003682	CN1c2ccsc2/C(=N/NC(=O)Cc3cccs3)/CS1(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E05	compound treatment	1.176	-0.037	-0.5	1.308	-0.0182	-0.25	-0.5288	-0.948	1254553	Bionet1_003683	CCOC(=O)C(Cc1c(F)cccc1Cl)c2ccnc3nc(N)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E06	compound treatment	1.216	0.00298	0.04	1.347	0.0208	0.28	0.2289	0.7994	1910325	Bionet1_003684	COC(=O)c1sccc1Oc2cc(nc(SC)n2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E07	compound treatment	1.2	-0.013	-0.18	1.359	0.0328	0.45	0.192	0.3996	1335360	Bionet1_003685	Oc1ccn(CCCN2CCOCC2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E08	compound treatment	1.234	0.021	0.28	1.349	0.0228	0.31	0.4199	0.9989	1910326	Bionet1_003686	CC(OC(=O)Nc1cccc(c1)C(F)(F)F)c2sc3ncnn3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E09	compound treatment	1.236	0.023	0.31	1.345	0.0188	0.26	0.4004	0.9955	1151858	Bionet1_003687	Oc1ccn(CCc2ccccn2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E10	compound treatment	1.263	0.05	0.67	1.369	0.0428	0.58	0.8894	0.9974	1910327	Bionet1_003688	CC(OC(=O)NS(=O)(=O)c1ccc(C)cc1)c2sc3ncnn3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E11	compound treatment	1.193	-0.02	-0.27	1.325	-0.00121	-0.02	-0.2027	-0.749	1525023	Bionet1_003689	CCOC(=O)C(Cc1c(F)cccc1Cl)c2ccnn2c3cccc(F)n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E12	compound treatment	1.203	-0.01	-0.14	1.351	0.0248	0.34	0.1434	0.394	1910328	Bionet1_003690	COc1cccc(Sc2nc(SCc3ccccc3)nc4ccsc24)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E13	compound treatment	1.197	-0.016	-0.22	1.338	0.0118	0.16	-0.0392	-0.1454	1229087	Bionet1_003691	Oc1ccn(Cc2cccc(Cl)c2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E14	compound treatment	1.187	-0.026	-0.35	1.323	-0.00321	-0.04	-0.2792	-0.7892	1910329	Bionet1_003692	Cc1ccc(Sc2nc(SCc3ccccc3)nc4ccsc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E15	compound treatment	1.255	0.042	0.57	1.322	-0.00421	-0.06	0.3598	0.6321	1297010	Bionet1_003693	Oc1ccn(Cc2ccc3OCOc3c2)c(=O)c1Cc4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E16	compound treatment	1.221	0.00798	0.11	1.319	-0.00721	-0.1	0.0066	0.0451	1910330	Bionet1_003694	COc1ccc(Oc2nc(SCc3ccccc3)nc4ccsc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E17	compound treatment	1.234	0.021	0.28	1.348	0.0218	0.3	0.4102	0.9997	1424403	Bionet1_003695	CN1CC(C(C1)C(=O)c2ccc(Cl)cc2)C(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E18	compound treatment	1.207	-0.00602	-0.08	1.382	0.0558	0.76	0.4805	0.6281	1910331	Bionet1_003696	Fc1ccc(Oc2nc(SCc3ccccc3)nc4ccsc24)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E19	compound treatment	1.201	-0.012	-0.16	1.332	0.00579	0.08	-0.0589	-0.3264	1143157	Bionet1_003697	COc1ccc(cc1)C(=O)C2CN(C)CC2C(=O)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E20	compound treatment	1.256	0.043	0.58	1.366	0.0398	0.54	0.7937	0.9994	1910332	Bionet1_003698	Cc1ccc(Oc2nc(SCc3ccccc3)nc4ccsc24)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E21	compound treatment	1.249	0.036	0.49	1.375	0.0488	0.67	0.8137	0.988	1291386	Bionet1_003699	COc1ccc(NC(=O)c2c(O)c3cccc4CCCn(c2=O)c43)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	E22	compound treatment	1.236	0.023	0.31	1.375	0.0488	0.67	0.6896	0.9396	1910333	Bionet1_003700	C=CCSc1nc(Oc2ccc3ccccc3c2)c4sccc4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F03	compound treatment	1.218	0.00498	0.07	1.322	-0.00421	-0.06	0.0069	0.078	1910334	Bionet1_003701	Nc1c(C#N)c(SCc2ccccc2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F04	compound treatment	1.2	-0.013	-0.18	1.301	-0.0252	-0.34	-0.3673	-0.9514	1687952	Bionet1_003702	Clc1ccc(cc1)C(=O)Oc2ccc(cc2)c3nccc(n3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F05	compound treatment	1.242	0.029	0.39	1.351	0.0248	0.34	0.5155	0.9974	1910335	Bionet1_003703	COc1ccc(CSc2sc(C(=O)c3ccccc3)c(N)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F06	compound treatment	1.191	-0.022	-0.3	1.313	-0.0132	-0.18	-0.3375	-0.9713	1910336	Bionet1_003704	Clc1ccc(N/N=C/c2ccc(OCc3ccccc3)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F07	compound treatment	1.193	-0.02	-0.27	1.322	-0.00421	-0.06	-0.2316	-0.8388	1910337	Bionet1_003705	Cc1ccccc1CSc2sc(C(=O)c3ccccc3)c(N)c2C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F08	compound treatment	1.197	-0.016	-0.22	1.36	0.0338	0.46	0.173	0.3399	1910338	Bionet1_003706	CC(C)(C)c1ccc(N/N=C/c2ccc(OCc3ccccc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F09	compound treatment	1.18	-0.033	-0.45	1.312	-0.0142	-0.19	-0.452	-0.9305	1910339	Bionet1_003707	Nc1c(C#N)c(SCC(=O)c2ccccc2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F10	compound treatment	1.202	-0.011	-0.15	1.276	-0.0502	-0.68	-0.5893	-0.841	1910340	Bionet1_003708	Clc1ccc(CO/N=C/c2ccc(OCc3ccccc3)cc2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F11	compound treatment	1.222	0.00898	0.12	1.323	-0.00321	-0.04	0.0547	0.4245	1910341	Bionet1_003709	Nc1c(sc2sc(C(=O)c3ccccc3)c(N)c12)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F12	compound treatment	1.221	0.00798	0.11	1.301	-0.0252	-0.34	-0.167	-0.4635	1910342	Bionet1_003710	COC(=O)c1cc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F13	compound treatment	1.26	0.047	0.63	1.32	-0.00621	-0.08	0.3883	0.6072	1910343	Bionet1_003711	Nc1c(C#N)c(SCc2cccc(F)c2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F14	compound treatment	1.184	-0.029	-0.39	1.273	-0.0532	-0.73	-0.7899	-0.9581	1910344	Bionet1_003712	CCOC(=O)c1cnn(c1n2cccc2C(=O)C(=O)NCC=C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F15	compound treatment	1.217	0.00398	0.05	1.33	0.00379	0.05	0.0745	0.9998	1910345	Bionet1_003713	Nc1c(C#N)c(SCc2ccc(F)cc2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F16	compound treatment	1.221	0.00798	0.11	1.297	-0.0292	-0.4	-0.2056	-0.4981	1910346	Bionet1_003714	CCOC(=O)c1cnn(c1n2cccc2C(=O)C(=O)N(C)C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F17	compound treatment	1.232	0.019	0.26	1.357	0.0308	0.42	0.4779	0.9719	1910347	Bionet1_003715	Cc1ccc(CSc2sc(C(=O)c3ccccc3)c(N)c2C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F18	compound treatment	1.202	-0.011	-0.15	1.276	-0.0502	-0.68	-0.5893	-0.841	1910348	Bionet1_003716	CC(C)Sc1nnc(c2cnn(c2n3cccc3)c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F19	compound treatment	1.19	-0.023	-0.31	1.327	7.87E-4	0.01	-0.212	-0.6823	1910349	Bionet1_003717	Nc1c(C#N)c(SCc2cccc(Cl)c2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F20	compound treatment	1.222	0.00898	0.12	1.317	-0.00921	-0.13	-0.0032	-0.0181	1910350	Bionet1_003718	CCSc1nnc(c2cnn(c2n3cccc3)c4ccccc4)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F21	compound treatment	1.205	-0.00802	-0.11	1.347	0.0208	0.28	0.1239	0.4085	1910351	Bionet1_003719	Nc1c(C#N)c(SCc2ccc(Cl)cc2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	F22	compound treatment	1.161	-0.052	-0.7	1.317	-0.00921	-0.13	-0.5851	-0.8207	1910352	Bionet1_003720	FC(F)(F)c1cc(=O)n(nc1C(=O)Nc2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G03	compound treatment	1.207	-0.00602	-0.08	1.282	-0.0442	-0.6	-0.4837	-0.7952	1910353	Bionet1_003721	CC(=O)C(Cc1cnc(Cl)s1)(Cc2cnc(Cl)s2)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G04	compound treatment	1.274	0.061	0.82	1.356	0.0298	0.41	0.8689	0.9471	1240057	Bionet1_003722	COC(=O)c1ccccc1Oc2nc(SCC=C)nc3ccsc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G05	compound treatment	1.174	-0.039	-0.53	1.297	-0.0292	-0.4	-0.6539	-0.9906	1183374	Bionet1_003723	COc1ccc(CCn2ccc(O)c(Cc3ccccc3)c2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G06	compound treatment	1.254	0.041	0.55	1.358	0.0318	0.43	0.6974	0.9928	1910354	Bionet1_003724	Cc1c(sc2ncnn12)/C(=N\O)/CSCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G07	compound treatment	1.196	-0.017	-0.23	1.37	0.0438	0.6	0.2599	0.4062	1227988	Bionet1_003725	Oc1ccn(Cc2ccc(Cl)cc2Cl)c(=O)c1Cc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G08	compound treatment	1.185	-0.028	-0.38	1.313	-0.0132	-0.18	-0.3947	-0.9426	1491407	Bionet1_003726	Clc1ccc(cc1)C(=O)CSc2nc3n(ncc3c(=O)[nH]2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G09	compound treatment	1.189	-0.024	-0.32	1.353	0.0268	0.37	0.0292	0.0597	1910355	Bionet1_003727	Clc1cccc(C(=O)NNC(=O)c2sccc2n3cccc3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G10	compound treatment	1.215	0.00198	0.03	1.296	-0.0302	-0.41	-0.2724	-0.6598	1910356	Bionet1_003728	Clc1ccc(cc1)c2csc3nc4n(ncc4c(=O)n23)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G11	compound treatment	1.199	-0.014	-0.19	1.307	-0.0192	-0.26	-0.319	-0.9872	1910357	Bionet1_003729	C/C(=N\OCc1ccc(Cl)cc1)/c2sc3nc4ccccc4n3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G12	compound treatment	1.229	0.016	0.22	1.343	0.0168	0.23	0.3143	0.9996	1286687	Bionet1_003730	COc1ccc(cc1)C(=O)CSc2nc3n(ncc3c(=O)[nH]2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G13	compound treatment	1.224	0.011	0.15	1.375	0.0488	0.67	0.5752	0.8439	1376211	Bionet1_003731	COC(=O)CSc1nnc(s1)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G14	compound treatment	1.247	0.034	0.46	1.319	-0.00721	-0.1	0.2546	0.543	1492995	Bionet1_003732	O=C(CSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G15	compound treatment	1.208	-0.00502	-0.07	1.312	-0.0142	-0.19	-0.1849	-0.9007	1445945	Bionet1_003733	CC(C)(C)c1cc(cc(c1O)C(C)(C)C)c2nnc(SCC=C)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G16	compound treatment	1.244	0.031	0.42	1.336	0.00979	0.13	0.3899	0.8887	1910358	Bionet1_003734	Brc1ccc(cc1)C2=Nn3c(nnc3SC2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G17	compound treatment	1.218	0.00498	0.07	1.356	0.0298	0.41	0.3347	0.813	1910359	Bionet1_003735	FC(F)(F)c1cccc(c1)n2ccc(=O)c(n2)C(=O)Nc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G18	compound treatment	1.185	-0.028	-0.38	1.331	0.00479	0.07	-0.2211	-0.5765	1161908	Bionet1_003736	Brc1cc(Br)c2oc(cc2c1)C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G19	compound treatment	1.218	0.00498	0.07	1.336	0.00979	0.13	0.1419	0.9496	1910360	Bionet1_003737	COc1cccc(c1)C(=O)O/N=C(\C)/c2sc3nc4ccccc4n3c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G20	compound treatment	1.228	0.015	0.2	1.317	-0.00921	-0.13	0.0541	0.2272	1910361	Bionet1_003738	O/N=C(\c1cc2cc(Br)cc(Br)c2o1)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G21	compound treatment	1.217	0.00398	0.05	1.414	0.0878	1.2	0.8845	0.7381	1712484	Bionet1_003739	Clc1ccc(CN2CCN(CC2)c3nc4ccccc4s3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	G22	compound treatment	1.224	0.011	0.15	1.381	0.0548	0.75	0.633	0.8311	1910362	Bionet1_003740	COc1ccc(cc1)c2nnc(SCc3ccc(Cl)cc3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H03	compound treatment	1.194	-0.019	-0.26	1.312	-0.0142	-0.19	-0.3185	-0.9904	1910363	Bionet1_003741	Nc1c(C#N)c(SCc2ccccc2Cl)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H04	compound treatment	1.129	-0.084	-1.13	1.293	-0.0332	-0.45	-1.1217	-0.919	1910364	Bionet1_003742	FC(F)(F)c1cc(=O)n(nc1C(=O)Nc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H05	compound treatment	1.249	0.036	0.49	1.342	0.0158	0.22	0.4955	0.9331	1910365	Bionet1_003743	Nc1c(C#N)c(SCC(=O)c2ccc(F)cc2)sc1C(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H06	compound treatment	1.168	-0.045	-0.61	1.312	-0.0142	-0.19	-0.5665	-0.8886	1910366	Bionet1_003744	FC(F)(F)c1cccc(NC(=O)C2CCC(=O)N2Cc3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H07	compound treatment	1.219	0.00598	0.08	1.302	-0.0242	-0.33	-0.1764	-0.519	1910367	Bionet1_003745	Cc1cccn2c(/C=N/OC(=O)c3cccs3)c(nc12)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H08	compound treatment	1.189	-0.024	-0.32	1.288	-0.0382	-0.52	-0.5976	-0.9739	1910368	Bionet1_003746	FC(F)(F)c1cccc(NC(=O)C2CCC(=O)N2Cc3ccccc3Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H09	compound treatment	1.218	0.00498	0.07	1.352	0.0258	0.35	0.2962	0.8273	1910369	Bionet1_003747	Cc1ccc(cc1)C(=O)O/N=C/c2c(nc3ccc(Cl)cn23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H10	compound treatment	1.188	-0.025	-0.34	1.315	-0.0112	-0.15	-0.3468	-0.9359	1448522	Bionet1_003748	Clc1ccc(NC(=O)C2CCC(=O)N2Cc3ccccc3Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H11	compound treatment	1.176	-0.037	-0.5	1.364	0.0378	0.52	0.0112	0.0156	1910370	Bionet1_003749	Cc1cccn2c(/C=N/OC(=O)C3CC3)c(nc12)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H12	compound treatment	1.202	-0.011	-0.15	1.335	0.00879	0.12	-0.0204	-0.1068	1590698	Bionet1_003750	Clc1ccc(NC(=O)C2CCC(=O)N2Cc3ccccc3Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H13	compound treatment	1.186	-0.027	-0.36	1.352	0.0258	0.35	-0.0091	-0.018	1910371	Bionet1_003751	O=C(NN=C1CCN(CC1)S(=O)(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H14	compound treatment	1.167	-0.046	-0.62	1.347	0.0208	0.28	-0.2386	-0.3495	1910372	Bionet1_003752	FC(F)(F)c1ccc(NC(=O)C2CCC(=O)N2Cc3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H15	compound treatment	1.216	0.00298	0.04	1.345	0.0188	0.26	0.2096	0.8082	1910373	Bionet1_003753	O=C(ON=C1CCN(CC1)S(=O)(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H16	compound treatment	1.166	-0.047	-0.63	1.308	-0.0182	-0.25	-0.6241	-0.9162	1150108	Bionet1_003754	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H17	compound treatment	1.213	-1.88E-5	0.0	1.355	0.0288	0.39	0.2774	0.7066	1910374	Bionet1_003755	CCOC(=O)c1cnc2c(C)cccc2c1Nc3ccc(OC(F)(F)F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H18	compound treatment	1.198	-0.015	-0.2	1.322	-0.00421	-0.06	-0.1839	-0.8732	1555155	Bionet1_003756	Fc1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H19	compound treatment	1.23	0.017	0.23	1.305	-0.0212	-0.29	-0.0426	-0.1153	1910375	Bionet1_003757	Clc1ccc(cc1)C(=O)NN=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H20	compound treatment	1.178	-0.035	-0.47	1.275	-0.0512	-0.7	-0.8279	-0.9819	1452723	Bionet1_003758	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H21	compound treatment	1.236	0.023	0.31	1.347	0.0208	0.28	0.4197	0.999	1910376	Bionet1_003759	Fc1ccc(cc1)C(=O)NN=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	H22	compound treatment	1.179	-0.034	-0.46	1.345	0.0188	0.26	-0.1434	-0.2728	1910377	Bionet1_003760	FC(F)(F)S(=O)(=O)N1CCC(CC1)c2nc3ccccc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I03	compound treatment	1.197	-0.016	-0.22	1.316	-0.0102	-0.14	-0.2513	-0.9774	1910378	Bionet1_003761	[O-][N+](=O)c1ccc(CN2CCN(CC2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I04	compound treatment	1.209	-0.00402	-0.05	1.298	-0.0282	-0.38	-0.3104	-0.7989	1455660	Bionet1_003762	CCOC(=O)COc1ccc(cc1)c2nccc(n2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I05	compound treatment	1.209	-0.00402	-0.05	1.309	-0.0172	-0.23	-0.2043	-0.8481	1910379	Bionet1_003763	FC(F)(F)c1cccc(CN2CCN(CC2)c3nc4ccccc4s3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I06	compound treatment	1.235	0.022	0.3	1.315	-0.0112	-0.15	0.1016	0.3044	1910380	Bionet1_003764	COC(=O)COc1ccc(cc1)c2nccc(n2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I07	compound treatment	1.185	-0.028	-0.38	1.273	-0.0532	-0.73	-0.7804	-0.9538	1332242	Bionet1_003765	Fc1cccc(Cl)c1CN2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I08	compound treatment	1.207	-0.00602	-0.08	1.315	-0.0112	-0.15	-0.1655	-0.9561	1910381	Bionet1_003766	CCCCCCCc1ccc(CNc2ccc(cc2)C(=O)OCC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I09	compound treatment	1.219	0.00598	0.08	1.346	0.0198	0.27	0.2478	0.8801	1910382	Bionet1_003767	FC(F)(F)c1cccc(c1)C(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I10	compound treatment	1.201	-0.012	-0.16	1.327	7.87E-4	0.01	-0.1071	-0.6589	1910383	Bionet1_003768	COc1ccc(cc1)C(=O)c2nnn(c2C)c3cc(Cl)cc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I11	compound treatment	1.251	0.038	0.51	1.361	0.0348	0.47	0.6977	0.9993	1673809	Bionet1_003769	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I12	compound treatment	1.181	-0.032	-0.43	1.34	0.0138	0.19	-0.1725	-0.3662	1910384	Bionet1_003770	COC(=O)c1ccc(OCCCCCCOc2ccc(cc2)C(=O)OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I13	compound treatment	1.258	0.045	0.61	1.325	-0.00121	-0.02	0.4174	0.6876	1379240	Bionet1_003771	COc1cccc(c1)C(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I14	compound treatment	1.21	-0.00302	-0.04	1.324	-0.00221	-0.03	-0.0501	-0.9891	1567386	Bionet1_003772	CC(C)(C)c1ccc(Oc2ccc(cc2)c3nc(N)c(C#N)c(C#N)c3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I15	compound treatment	1.246	0.033	0.44	1.344	0.0178	0.24	0.4861	0.9593	1149384	Bionet1_003773	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I16	compound treatment	1.228	0.015	0.2	1.336	0.00979	0.13	0.2373	0.9797	1910385	Bionet1_003774	[O-][N+](=O)c1ccc(NCCc2c[nH]c3ccccc23)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I17	compound treatment	1.204	-0.00902	-0.12	1.331	0.00479	0.07	-0.0399	-0.2888	1147923	Bionet1_003775	O=S(=O)(N1CCN(CC1)c2nc3ccccc3s2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I18	compound treatment	1.234	0.021	0.28	1.257	-0.0692	-0.94	-0.4672	-0.4742	1910386	Bionet1_003776	CCOC(=O)C(CSC(=O)c1ccc(cc1)[N+](=O)[O-])NC(=O)OC(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I19	compound treatment	1.179	-0.034	-0.46	1.372	0.0458	0.62	0.117	0.151	1173610	Bionet1_003777	Cc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I20	compound treatment	1.239	0.026	0.35	1.402	0.0758	1.03	0.9786	0.8968	1910387	Bionet1_003778	Brc1ccc(cc1)C(=O)CSc2nnc(o2)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I21	compound treatment	1.246	0.033	0.44	1.39	0.0638	0.87	0.9297	0.9515	1555729	Bionet1_003779	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	I22	compound treatment	1.23	0.017	0.23	1.362	0.0358	0.49	0.5071	0.9406	1910388	Bionet1_003780	COc1cc(Br)c(O)c(/C=N/NC(=O)c2cccnc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J03	compound treatment	1.235	0.022	0.3	1.35	0.0238	0.32	0.439	0.999	1910389	Bionet1_003781	Cc1ccc(cc1)C(=O)NN=C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J04	compound treatment	1.208	-0.00502	-0.07	1.289	-0.0372	-0.51	-0.4067	-0.7944	1696263	Bionet1_003782	COc1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J05	compound treatment	1.19	-0.023	-0.31	1.324	-0.00221	-0.03	-0.2409	-0.7722	1910390	Bionet1_003783	O=C(NN=C1CCN(CC1)S(=O)(=O)c2ccccc2)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J06	compound treatment	1.196	-0.017	-0.23	1.262	-0.0642	-0.88	-0.7815	-0.8633	1491125	Bionet1_003784	O=S(=O)(N1CCC(CC1)c2nc3ccccc3s2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J07	compound treatment	1.218	0.00498	0.07	1.317	-0.00921	-0.13	-0.0413	-0.29	1910391	Bionet1_003785	CCOC(=O)c1cnc2ccc(cc2c1NCc3ccc(C)cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J08	compound treatment	1.214	9.81E-4	0.01	1.317	-0.00921	-0.13	-0.0795	-0.6291	1422608	Bionet1_003786	O=S(=O)(Cc1ccccc1)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J09	compound treatment	1.216	0.00298	0.04	1.29	-0.0362	-0.49	-0.3207	-0.6474	1910392	Bionet1_003787	CCOC(=O)c1cnc2ccc(cc2c1Nc3ccccc3F)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J10	compound treatment	1.184	-0.029	-0.39	1.271	-0.0552	-0.75	-0.8092	-0.9536	1412011	Bionet1_003788	Clc1ccc(cc1)S(=O)(=O)N2CCCC2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J11	compound treatment	1.223	0.00998	0.13	1.355	0.0288	0.39	0.3728	0.8983	1910393	Bionet1_003789	Clc1ccc(cc1Cl)C(=O)Nc2ccc3sc4ccccc4c(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J12	compound treatment	1.202	-0.011	-0.15	1.26	-0.0662	-0.9	-0.7436	-0.8126	1202686	Bionet1_003790	Cc1ccc(cc1)S(=O)(=O)N2CCCC2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J13	compound treatment	1.191	-0.022	-0.3	1.331	0.00479	0.07	-0.1639	-0.5389	1910394	Bionet1_003791	Clc1cccc(c1)C(=O)Nc2ccc3sc4ccccc4c(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J14	compound treatment	1.247	0.034	0.46	1.295	-0.0312	-0.43	0.0232	0.0371	1334878	Bionet1_003792	COc1ccc(cc1)S(=O)(=O)N2CCCC2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J15	compound treatment	1.206	-0.00702	-0.09	1.318	-0.00821	-0.11	-0.1461	-0.9965	1910395	Bionet1_003793	COc1ccc(cc1)/C(=C/c2c(nc3c(C)cccn23)c4ccc(Cl)cc4)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J16	compound treatment	1.198	-0.015	-0.2	1.287	-0.0392	-0.53	-0.5214	-0.9118	1719153	Bionet1_003794	O=S(=O)(Cc1ccccc1)N2CCCC2c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J17	compound treatment	1.261	0.048	0.65	1.359	0.0328	0.45	0.7739	0.9837	1910396	Bionet1_003795	COc1cccc(c1)/C(=C/c2c(nc3c(C)cccn23)c4ccc(Cl)cc4)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J18	compound treatment	1.155	-0.058	-0.78	1.308	-0.0182	-0.25	-0.7291	-0.8879	1910397	Bionet1_003796	COc1cc(NC(=O)c2ccc(cc2)C(=O)C(F)(F)F)c(Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J19	compound treatment	1.273	0.06	0.81	1.355	0.0288	0.39	0.8498	0.9448	1910398	Bionet1_003797	COc1cccc(c1)/C(=C/c2c(nc3cc(C)ccn23)c4ccc(Cl)cc4)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J20	compound treatment	1.194	-0.019	-0.26	1.293	-0.0332	-0.45	-0.5017	-0.9638	1910399	Bionet1_003798	CCOC(=O)c1nn(c2cccc(c2)C(F)(F)F)c(=O)cc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J21	compound treatment	1.291	0.078	1.05	1.392	0.0658	0.9	1.3782	0.9969	1910400	Bionet1_003799	Cc1nc(sc1C(=O)/C=C/c2ccccc2[N+](=O)[O-])c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	J22	compound treatment	1.182	-0.031	-0.42	1.303	-0.0232	-0.32	-0.5197	-0.9905	1910401	Bionet1_003800	CCOC(=O)c1nn(c2ccc(cc2)C(F)(F)F)c(=O)cc1C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K03	compound treatment	1.187	-0.026	-0.35	1.334	0.00779	0.11	-0.1731	-0.4721	1910402	Bionet1_003801	Cc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ncccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K04	compound treatment	1.202	-0.011	-0.15	1.309	-0.0172	-0.23	-0.2711	-0.9757	1910403	Bionet1_003802	COC(=O)c1ccc(/N=C/c2cc(OC)cc(Br)c2O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K05	compound treatment	1.174	-0.039	-0.53	1.329	0.00279	0.04	-0.3453	-0.6544	1269742	Bionet1_003803	Clc1cccc(c1)C(=O)N2CCC(CC2)c3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K06	compound treatment	1.215	0.00198	0.03	1.348	0.0218	0.3	0.229	0.7676	1910404	Bionet1_003804	COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K07	compound treatment	1.151	-0.062	-0.84	1.291	-0.0352	-0.48	-0.9312	-0.9653	1910405	Bionet1_003805	CC(C)(C)c1cc(O)cc(c1/C=N/Nc2cccc3cccnc23)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K08	compound treatment	1.237	0.024	0.32	1.316	-0.0102	-0.14	0.1303	0.3699	1910406	Bionet1_003806	Fc1ccccc1/C=C\2/C(OC(=O)Nc3ccccc3)C4CCN2CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K09	compound treatment	1.245	0.032	0.43	1.301	-0.0252	-0.34	0.062	0.1123	1910407	Bionet1_003807	CCOC(=O)C(=CNc1nc(cs1)c2ccc(C)cc2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K10	compound treatment	1.23	0.017	0.23	1.347	0.0208	0.28	0.3624	0.9944	1910408	Bionet1_003808	COc1cc(Br)c(O)c(/C=N/Cc2ccc(Cl)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K11	compound treatment	1.231	0.018	0.24	1.391	0.0648	0.88	0.7962	0.8691	1910409	Bionet1_003809	Fc1ccc(SCc2ccc(CSc3ccc(F)cc3)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K12	compound treatment	1.254	0.041	0.55	1.306	-0.0202	-0.28	0.196	0.3173	1910410	Bionet1_003810	COc1cccc2cc(oc12)/C(=N/NC(=O)c3ccc(cc3)C(F)(F)F)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K13	compound treatment	1.176	-0.037	-0.5	1.301	-0.0252	-0.34	-0.5963	-0.9834	1642102	Bionet1_003811	CC(C)(C)c1nc(NC(=O)Nc2ccccc2)sc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K14	compound treatment	1.235	0.022	0.3	1.356	0.0298	0.41	0.4969	0.988	1910411	Bionet1_003812	COc1cccc2cc(oc12)/C(=N/Nc3ncc(cc3Cl)C(F)(F)F)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K15	compound treatment	1.236	0.023	0.31	1.419	0.0928	1.27	1.1139	0.8551	1370781	Bionet1_003813	Clc1ccc(NC(=O)Nc2nc(cs2)c3cccc4ccccc34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K16	compound treatment	1.241	0.028	0.38	1.342	0.0158	0.22	0.4191	0.9645	1492345	Bionet1_003814	CC(C)(C)C(=O)Cn1ncc(N2CCOCC2)c(Br)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K17	compound treatment	1.249	0.036	0.49	1.361	0.0348	0.47	0.6787	0.9999	1571877	Bionet1_003815	CSc1nc(Sc2ccccc2)cc(n1)N3CCCc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K18	compound treatment	1.231	0.018	0.24	1.356	0.0298	0.41	0.4587	0.9696	1414611	Bionet1_003816	Clc1ccc(cc1)C(=O)Cn2ncc(N3CCOCC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K19	compound treatment	1.194	-0.019	-0.26	1.351	0.0248	0.34	0.0576	0.1357	1910412	Bionet1_003817	CCOC(=O)C(=CNc1nc(cs1)c2ccc3ccccc3c2)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K20	compound treatment	1.231	0.018	0.24	1.355	0.0288	0.39	0.4491	0.9732	1391382	Bionet1_003818	Clc1ccc(cc1)C(=O)Cn2ncc(N3CCCC3)c(Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K21	compound treatment	1.276	0.063	0.85	1.381	0.0548	0.75	1.1291	0.9979	1441061	Bionet1_003819	Oc1ccn(CCc2c[nH]c3ccccc23)c(=O)c1Cc4c(F)cccc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	K22	compound treatment	1.239	0.026	0.35	1.363	0.0368	0.5	0.6026	0.9846	1910413	Bionet1_003820	CO/N=C(\Cn1ncc(N2CCOCC2)c(Cl)c1=O)/c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L03	compound treatment	1.218	0.00498	0.07	1.299	-0.0272	-0.37	-0.2149	-0.5698	1910414	Bionet1_003821	Clc1ccc(Oc2ccccc2/C=C\3/SC(=O)NC3=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L04	compound treatment	1.201	-0.012	-0.16	1.288	-0.0382	-0.52	-0.4831	-0.8853	1910415	Bionet1_003822	[O-][N+](=O)c1ccc2sc(cc2c1)C(=O)Nc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L05	compound treatment	1.218	0.00498	0.07	1.275	-0.0512	-0.7	-0.4463	-0.6361	1910416	Bionet1_003823	Clc1ccc(Oc2ccccc2C=C3C(=O)NC(=O)NC3=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L06	compound treatment	1.199	-0.014	-0.19	1.282	-0.0442	-0.6	-0.5601	-0.8863	1910417	Bionet1_003824	COC(=O)c1ccc(NC(=O)c2cc3cc(ccc3s2)[N+](=O)[O-])cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L07	compound treatment	1.209	-0.00402	-0.05	1.287	-0.0392	-0.53	-0.4164	-0.7748	1910418	Bionet1_003825	Fc1cc(Br)ccc1Oc2ccccc2/C=C/3\SC(=O)NC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L08	compound treatment	1.165	-0.048	-0.65	1.26	-0.0662	-0.9	-1.0965	-0.9867	1452589	Bionet1_003826	Clc1ncc(CC(Cc2cnc(Cl)s2)c3ccnc4ncnn34)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L09	compound treatment	1.253	0.04	0.54	1.316	-0.0102	-0.14	0.2829	0.5079	1910419	Bionet1_003827	Fc1cc(Oc2ccccc2/C=C/3\SC(=O)NC3=O)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L10	compound treatment	1.237	0.024	0.32	1.282	-0.0442	-0.6	-0.1976	-0.2887	1910420	Bionet1_003828	[O-][N+](=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L11	compound treatment	1.208	-0.00502	-0.07	1.303	-0.0232	-0.32	-0.2717	-0.8394	1910421	Bionet1_003829	CN1C(=O)N(C)C(=O)C(=Cc2ccccc2Oc3ccc(Cl)cc3)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L12	compound treatment	1.176	-0.037	-0.5	1.295	-0.0312	-0.43	-0.6541	-0.9968	1910422	Bionet1_003830	[O-][N+](=O)c1ccc(Oc2cc(Cl)cc(Cl)c2)c(Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L13	compound treatment	1.171	-0.042	-0.57	1.356	0.0298	0.41	-0.1136	-0.1629	1910423	Bionet1_003831	FC(F)(F)c1ccc(cc1)c2nnc(SCC(=O)c3ccc(Cl)cc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L14	compound treatment	1.237	0.024	0.32	1.273	-0.0532	-0.73	-0.2843	-0.3579	1910424	Bionet1_003832	COCCCNC(=O)/C=C/c1ccc(OCc2c(F)cccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L15	compound treatment	1.158	-0.055	-0.74	1.321	-0.00521	-0.07	-0.5751	-0.7713	1910425	Bionet1_003833	COc1ccc(cc1)S(=O)(=O)Oc2ccc(c(F)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L16	compound treatment	1.211	-0.00202	-0.03	1.33	0.00379	0.05	0.0173	0.2956	1910426	Bionet1_003834	Fc1cccc(Cl)c1COc2ccc(/C=C/C(=O)N3CCOCC3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L17	compound treatment	1.239	0.026	0.35	1.292	-0.0342	-0.47	-0.0821	-0.1406	1910427	Bionet1_003835	Fc1cc(OC(=O)c2cccc(c2)C(F)(F)F)ccc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L18	compound treatment	1.177	-0.036	-0.49	1.29	-0.0362	-0.49	-0.6928	-1.0	1910428	Bionet1_003836	Fc1cccc(Cl)c1COc2ccc(/C=C/C(=O)NC3CCCC3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L19	compound treatment	1.244	0.031	0.42	1.324	-0.00221	-0.03	0.2742	0.6543	1364921	Bionet1_003837	COc1ccc(cc1)c2ccnc(n2)c3ccc(OC(=O)c4ccco4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L20	compound treatment	1.191	-0.022	-0.3	1.289	-0.0372	-0.51	-0.5689	-0.9675	1910429	Bionet1_003838	Cc1ccccc1NC(=O)/C=C/c2ccc(OCc3c(F)cccc3Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L21	compound treatment	1.199	-0.014	-0.19	1.32	-0.00621	-0.08	-0.1936	-0.9344	1910430	Bionet1_003839	COc1ccc(cc1)c2ccnc(n2)c3ccc(OC(=O)c4cccs4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	L22	compound treatment	1.194	-0.019	-0.26	1.316	-0.0102	-0.14	-0.2799	-0.9588	1910431	Bionet1_003840	O=C/1/C(=C/c2ccccc2)/CN(Cc3ccccc3)C\C1=C/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M03	compound treatment	1.201	-0.012	-0.16	1.323	-0.00321	-0.04	-0.1456	-0.8671	1128240	Bionet1_003841	Oc1ccn(CCCn2ccnc2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M04	compound treatment	1.212	-0.00102	-0.01	1.32	-0.00621	-0.08	-0.0696	-0.8112	1324499	Bionet1_003842	Clc1cccc(Cl)c1SCC2CSc3nc4ccccc4c(=O)n23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M05	compound treatment	1.242	0.029	0.39	1.317	-0.00921	-0.13	0.1876	0.4569	1712969	Bionet1_003843	CC(C)(Cn1ccc(O)c(Cc2ccccc2)c1=O)SCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M06	compound treatment	1.238	0.025	0.34	1.285	-0.0412	-0.56	-0.1591	-0.2428	1123883	Bionet1_003844	COc1cccc(SCC2CSc3nc4ccccc4c(=O)n23)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M07	compound treatment	1.216	0.00298	0.04	1.304	-0.0222	-0.3	-0.1857	-0.6079	1910432	Bionet1_003845	CCOC(=O)C(Cc1ccccc1)c2ccnc3nc(nn23)n4c(C)ccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M08	compound treatment	1.286	0.073	0.98	1.348	0.0218	0.3	0.9063	0.8812	1910433	Bionet1_003846	CN1c2ccccc2C(=C(C(=S)Nc3ccc(Cl)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M09	compound treatment	1.151	-0.062	-0.84	1.31	-0.0162	-0.22	-0.748	-0.8643	1494949	Bionet1_003847	Oc1ccn(C2CCCCCC2)c(=O)c1Cc3c(F)cccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M10	compound treatment	1.301	0.088	1.19	1.322	-0.00421	-0.06	0.7987	0.6721	1453081	Bionet1_003848	COc1ccccc1NC(=S)C2=C(O)c3ccccc3N(C)S2(=O)=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M11	compound treatment	1.233	0.02	0.27	1.315	-0.0112	-0.15	0.0825	0.2662	1910434	Bionet1_003849	COC(=O)/C(=C\Nc1ccc(Cl)cc1)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M12	compound treatment	1.276	0.063	0.85	1.351	0.0248	0.34	0.8398	0.9184	1298145	Bionet1_003850	CN1c2ccccc2C(=C(C(=S)Nc3ccc(C)cc3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M13	compound treatment	1.223	0.00998	0.13	1.316	-0.0102	-0.14	-0.0033	-0.0169	1910435	Bionet1_003851	FC(F)(F)c1cnc(c(Cl)c1)c2c[nH]c3ccc(Cl)cc3c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M14	compound treatment	1.263	0.05	0.67	1.366	0.0398	0.54	0.8604	0.9942	1168222	Bionet1_003852	CN1c2ccccc2C(=C(C(=S)Nc3ccc(F)c(Cl)c3)S1(=O)=O)O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M15	compound treatment	1.288	0.075	1.01	1.3	-0.0262	-0.36	0.4625	0.4311	1910436	Bionet1_003853	COC(=O)/C(=C\Nc1cc(F)ccc1F)/c2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M16	compound treatment	1.138	-0.075	-1.01	1.311	-0.0152	-0.21	-0.8623	-0.8347	1910437	Bionet1_003854	Fc1cccc(Cl)c1CSC2=Nc3cc(Cl)ccc3SCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M17	compound treatment	1.184	-0.029	-0.39	1.315	-0.0112	-0.15	-0.3849	-0.9159	1910438	Bionet1_003855	COc1ccc(Cn2ccc(O)c(C/C=C/c3ccccc3)c2=O)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M18	compound treatment	1.253	0.04	0.54	1.345	0.0188	0.26	0.5625	0.9421	1910439	Bionet1_003856	COc1ccc(CSC2=Nc3cc(Cl)ccc3SCC2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M19	compound treatment	1.252	0.039	0.53	1.33	0.00379	0.05	0.4084	0.7728	1910440	Bionet1_003857	Oc1ccn(Cc2ccc(Cl)cc2Cl)c(=O)c1C/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M20	compound treatment	1.262	0.049	0.66	1.36	0.0338	0.46	0.793	0.9845	1910441	Bionet1_003858	FC(F)(F)c1cccc(CSC2=CS(=O)(=O)c3ccccc3N2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M21	compound treatment	1.247	0.034	0.46	1.356	0.0298	0.41	0.6114	0.9982	1211240	Bionet1_003859	COc1ccc(NC(=O)CC2ON(C)C(=O)N2c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	M22	compound treatment	1.269	0.056	0.76	1.382	0.0558	0.76	1.0719	1.0	1280568	Bionet1_003860	CC(C)(C)c1ccc(CSC2=CS(=O)(=O)c3ccccc3N2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N03	compound treatment	1.221	0.00798	0.11	1.303	-0.0232	-0.32	-0.1477	-0.4417	1910442	Bionet1_003861	CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc2ccc(c(F)c2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N04	compound treatment	1.165	-0.048	-0.65	1.249	-0.0772	-1.05	-1.2026	-0.9728	1910443	Bionet1_003862	CN1N=C/2C(CN(Cc3ccccc3)C\C2=C/c4ccccc4)C1c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N05	compound treatment	1.238	0.025	0.34	1.287	-0.0392	-0.53	-0.1398	-0.2212	1910444	Bionet1_003863	Fc1cc(OC(=O)c2cccc(Cl)c2Cl)ccc1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N06	compound treatment	1.187	-0.026	-0.35	1.285	-0.0412	-0.56	-0.6456	-0.9743	1910445	Bionet1_003864	CN(C)/C=C\C(=O)c1nc2ccccc2n1Cc3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N07	compound treatment	1.226	0.013	0.18	1.276	-0.0502	-0.68	-0.3603	-0.5098	1362335	Bionet1_003865	OC(c1cc2cc(Br)cc(Br)c2o1)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N08	compound treatment	1.162	-0.051	-0.69	1.265	-0.0612	-0.83	-1.0769	-0.9954	1219502	Bionet1_003866	COc1ccc(cc1)c2cn3cc(I)ccc3n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N09	compound treatment	1.202	-0.011	-0.15	1.309	-0.0172	-0.23	-0.2711	-0.9757	1910446	Bionet1_003867	C/C(=N/NC(=O)c1cn(cn1)c2cccc(C)n2)/c3ccc(cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N10	compound treatment	1.145	-0.068	-0.92	1.298	-0.0282	-0.38	-0.9209	-0.9255	1910447	Bionet1_003868	Fc1ccccc1/C=C\2/C(OC(=O)c3c(F)cccc3F)C4CCN2CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N11	compound treatment	1.161	-0.052	-0.7	1.322	-0.00421	-0.06	-0.5368	-0.7624	1489529	Bionet1_003869	CC(Oc1ccc(c(F)c1)c2ccccc2)c3ccn(n3)C(=O)C4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N12	compound treatment	1.204	-0.00902	-0.12	1.246	-0.0802	-1.09	-0.8595	-0.7809	1327990	Bionet1_003870	COC(=O)c1ccc(cc1OC(=O)c2ccccc2Cl)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N13	compound treatment	1.165	-0.048	-0.65	1.264	-0.0622	-0.85	-1.058	-0.9911	1706126	Bionet1_003871	CCCc1ccc(c(F)c1)c2ccc(cc2)c3nocc3c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N14	compound treatment	1.197	-0.016	-0.22	1.283	-0.0432	-0.59	-0.5695	-0.9073	1910448	Bionet1_003872	[O-][N+](=O)c1ccc(cc1)C(=O)OC/2C3CCN(CC3)\C2=C/c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N15	compound treatment	1.241	0.028	0.38	1.286	-0.0402	-0.55	-0.1208	-0.1815	1588140	Bionet1_003873	CCOC(=O)Cn1ccc(O)c(Cc2ccc(Cl)cc2Cl)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N16	compound treatment	1.12	-0.093	-1.25	1.311	-0.0152	-0.21	-1.034	-0.813	1361101	Bionet1_003874	COC(=O)c1cc(Br)c(NC(=O)c2cccs2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N17	compound treatment	1.281	0.068	0.92	1.365	0.0388	0.53	1.0225	0.9658	1224039	Bionet1_003875	Oc1ccn(CCc2ccccc2)c(=O)c1Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N18	compound treatment	1.206	-0.00702	-0.09	1.301	-0.0252	-0.34	-0.3101	-0.8695	1910449	Bionet1_003876	Oc1ccn(CC(F)(F)F)c(=O)c1Cc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N19	compound treatment	1.186	-0.027	-0.36	1.308	-0.0182	-0.25	-0.4334	-0.9825	1211376	Bionet1_003877	Oc1ccn(Cc2ccncc2)c(=O)c1Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N20	compound treatment	1.164	-0.049	-0.66	1.282	-0.0442	-0.6	-0.8939	-0.9989	1712954	Bionet1_003878	CCC(=O)C(Cc1ccc(Cl)cc1Cl)c2ccnc3nc(N)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N21	compound treatment	1.289	0.076	1.03	1.36	0.0338	0.46	1.0506	0.9348	1361337	Bionet1_003879	Oc1ccn(Cc2ccc(Cl)cc2)c(=O)c1Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	N22	compound treatment	1.155	-0.058	-0.78	1.293	-0.0332	-0.45	-0.8737	-0.9662	1626178	Bionet1_003880	Oc1nc2sc3ccccc3n2c(=O)c1C(=O)Nc4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O03	compound treatment	1.21	-0.00302	-0.04	1.337	0.0108	0.15	0.0752	0.4928	1910450	Bionet1_003881	Cc1ccc(N/C=C(/c2ccc(Cl)nc2)\S(=O)(=O)c3ccccc3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O04	compound treatment	1.24	0.027	0.36	1.357	0.0308	0.42	0.5542	0.9975	1255091	Bionet1_003882	Clc1ccc(CSC2=CS(=O)(=O)c3ccccc3N2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O05	compound treatment	1.223	0.00998	0.13	1.318	-0.00821	-0.11	0.016	0.0915	1910451	Bionet1_003883	FC(F)(F)c1ccc(cc1)C(=O)Nc2ccc(cc2)c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O06	compound treatment	1.216	0.00298	0.04	1.328	0.00179	0.02	0.0457	0.9712	1910452	Bionet1_003884	Cn1c2sc(cc2c3ccccc13)C(=O)NNC(=O)c4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O07	compound treatment	1.134	-0.079	-1.07	1.244	-0.0822	-1.12	-1.5465	-0.9997	1316690	Bionet1_003885	COc1ccc(Oc2ccc(cc2)c3nc(N)c(C#N)c(C#N)c3C#N)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O08	compound treatment	1.236	0.023	0.31	1.34	0.0138	0.19	0.3522	0.9713	1910453	Bionet1_003886	CN1CCN(Cc2ccc(Sc3ccc(Cl)cc3)c(c2)[N+](=O)[O-])CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O09	compound treatment	1.279	0.066	0.89	1.385	0.0588	0.8	1.1963	0.9986	3006735	Bionet1_003887	CN1CCOCC1.O=C1CC(C(=C(N1)[C-](C#N)C#N)C#N)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O10	compound treatment	1.19	-0.023	-0.31	1.318	-0.00821	-0.11	-0.2988	-0.9051	1910455	Bionet1_003888	[O-][N+](=O)c1cc(CN2CCOCC2)ccc1Sc3nc4ccccc4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O11	compound treatment	1.201	-0.012	-0.16	1.322	-0.00421	-0.06	-0.1553	-0.9027	1910456	Bionet1_003889	OC(CN(Cc1ccc(Cl)cc1)C(=O)Nc2cccc(F)c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O12	compound treatment	1.224	0.011	0.15	1.351	0.0248	0.34	0.3438	0.9315	1249045	Bionet1_003890	COC(=O)Cc1cc(OC)c(OC)cc1S(=O)(=O)N2CCOCC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O13	compound treatment	1.212	-0.00102	-0.01	1.29	-0.0362	-0.49	-0.3589	-0.7265	1141297	Bionet1_003891	Clc1ccc(cc1Cl)C(=O)Nc2ccc(cc2)c3nc4ccccc4o3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O14	compound treatment	1.176	-0.037	-0.5	1.322	-0.00421	-0.06	-0.3938	-0.7833	1910457	Bionet1_003892	COC(=O)c1sccc1NC(=O)CN2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O15	compound treatment	1.255	0.042	0.57	1.381	0.0548	0.75	0.9287	0.9907	1331590	Bionet1_003893	Clc1ccc(C(=O)Nc2ccc(cc2)c3nc4ccccc4o3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O16	compound treatment	1.204	-0.00902	-0.12	1.341	0.0148	0.2	0.0565	0.2401	1910458	Bionet1_003894	COC(=O)c1sccc1NC(=O)CN2CCN(CC2)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O17	compound treatment	1.26	0.047	0.63	1.363	0.0368	0.5	0.8029	0.9933	1654630	Bionet1_003895	Clc1cccc(C(=O)Nc2ccc(cc2)c3nc4ccccc4o3)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O18	compound treatment	1.253	0.04	0.54	1.4	0.0738	1.01	1.0929	0.9573	1704616	Bionet1_003896	COc1ccccc1C(=O)Nc2c(C#N)c(C)c(C)n2Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O19	compound treatment	1.214	9.81E-4	0.01	1.326	-2.13E-4	0.0	0.0073	0.539	1910459	Bionet1_003897	Brc1ccc(cc1)C(=O)CSc2nnc(o2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O20	compound treatment	1.233	0.02	0.27	1.362	0.0358	0.49	0.5357	0.9609	1910460	Bionet1_003898	FC(F)(F)c1ccccc1c2nnc(o2)c3cc4CCc5ccccc5-c4s3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O21	compound treatment	1.158	-0.055	-0.74	1.359	0.0328	0.45	-0.2087	-0.2409	1910461	Bionet1_003899	O=C(CSc1nnc(o1)c2ccccc2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	O22	compound treatment	1.268	0.055	0.74	1.337	0.0108	0.15	0.6285	0.8311	1910462	Bionet1_003900	Fc1ccc(CSc2nnc(o2)c3cc4CCc5ccccc5-c4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P03	compound treatment	1.182	-0.031	-0.42	1.311	-0.0152	-0.21	-0.4426	-0.9476	1739357	Bionet1_003901	Cn1cccc1C(=O)Nn2ccc(O)c(Cc3ccc(Cl)cc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P04	compound treatment	1.181	-0.032	-0.43	1.261	-0.0652	-0.89	-0.9343	-0.945	1687068	Bionet1_003902	Oc1nc2sc3ccccc3n2c(=O)c1C(=O)Nc4nc5ccccc5s4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P05	compound treatment	1.206	-0.00702	-0.09	1.28	-0.0462	-0.63	-0.5126	-0.8043	1910463	Bionet1_003903	CCOC(=O)C(Cc1ccc(Cl)cc1Cl)C(=O)/C=C/NCC(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P06	compound treatment	1.15	-0.063	-0.85	1.256	-0.0702	-0.96	-1.2782	-0.9982	1910464	Bionet1_003904	FC(F)(F)c1cnc(CC(=O)NCc2ccc3OCOc3c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P07	compound treatment	1.182	-0.031	-0.42	1.264	-0.0622	-0.85	-0.8958	-0.947	1383151	Bionet1_003905	CN1OC(CC(=O)Nc2cc(C)on2)N(C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P08	compound treatment	1.193	-0.02	-0.27	1.231	-0.0952	-1.3	-1.1091	-0.8363	1910465	Bionet1_003906	FC(F)(F)c1cccc(CNC(=O)Cc2ncc(cc2Cl)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P09	compound treatment	1.085	-0.128	-1.73	1.198	-0.128	-1.75	-2.4575	-1.0	1470073	Bionet1_003907	CN1OC(CC(=O)NC2CCCCCC2)N(C1=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P10	compound treatment	0.098	-1.12	-15.04	0.421	-0.905	-12.34	-19.365	-0.9952	1313971	Bionet1_003908	Oc1ccn(CCCN2CCOCC2)c(=O)c1Cc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P11	compound treatment	1.194	-0.019	-0.26	1.316	-0.0102	-0.14	-0.2799	-0.9588	1546856	Bionet1_003909	CSc1cccc(c1)n2ccc(O)c(Cc3ccc(Cl)cc3Cl)c2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P12	compound treatment	1.166	-0.047	-0.63	1.232	-0.0942	-1.28	-1.357	-0.9471	1910466	Bionet1_003910	CCSc1ncc(/C=N/Nc2c(Cl)cc(Cl)cc2Cl)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P13	compound treatment	1.197	-0.016	-0.22	1.313	-0.0132	-0.18	-0.2802	-0.9959	1910467	Bionet1_003911	Fc1cccc(CSc2nnc(o2)c3ccc(cc3)C(F)(F)F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P14	compound treatment	1.145	-0.068	-0.92	1.292	-0.0342	-0.47	-0.9788	-0.9508	1910468	Bionet1_003912	CCSc1ncc(/C=N/Nc2c(Cl)cc(cc2Cl)C(F)(F)F)n1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P15	compound treatment	1.207	-0.00602	-0.08	1.303	-0.0232	-0.32	-0.2812	-0.8606	1910469	Bionet1_003913	FC(F)(F)c1ccc(cc1)c2nnc(SCCOc3ccccc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P16	compound treatment	1.15	-0.063	-0.85	1.316	-0.0102	-0.14	-0.6996	-0.8121	1910470	Bionet1_003914	Clc1ccc(N/N=C/c2cnc(SCC=C)n2Cc3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P17	compound treatment	1.189	-0.024	-0.32	1.273	-0.0532	-0.73	-0.7422	-0.934	1910471	Bionet1_003915	COc1ccc(cc1)c2nnc(SCc3cccc(c3)C(F)(F)F)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P18	compound treatment	1.124	-0.089	-1.2	1.318	-0.00821	-0.11	-0.9284	-0.7697	1401200	Bionet1_003916	CCS(=O)(=O)c1ccc(C(=O)Nc2ccccc2OC)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P19	compound treatment	1.212	-0.00102	-0.01	1.289	-0.0372	-0.51	-0.3685	-0.726	1910472	Bionet1_003917	Fc1cccc(Cl)c1CSc2nnc(o2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P20	compound treatment	1.134	-0.079	-1.07	1.298	-0.0282	-0.38	-1.0258	-0.9052	1438845	Bionet1_003918	CCS(=O)(=O)c1ccc(C(=O)N2CCOCC2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P21	compound treatment	1.19	-0.023	-0.31	1.365	0.0388	0.53	0.1544	0.2518	1910473	Bionet1_003919	Cc1ccc(cc1)C(=O)CSc2nnc(o2)c3ccc(cc3)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.579	P22	compound treatment	1.266	0.053	0.71	1.288	-0.0382	-0.52	0.1369	0.1548	1424958	Bionet1_003920	CCS(=O)(=O)c1ccc(C(=O)Nc2cccc(Cl)c2)c(Cl)c1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A03	compound treatment	1.251	0.00771	0.1	1.335	-0.0134	-0.18	-0.0559	-0.2655	1910703	Bionet1_004241	FC(F)(F)c1cccc(Oc2ccccc2/C=C\3/SC(=O)NC3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A04	compound treatment	1.287	0.0437	0.59	1.33	-0.0184	-0.25	0.2393	0.3733	1910704	Bionet1_004242	Cc1ccc(CSc2nc(nnc2C(F)(F)F)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A05	compound treatment	1.249	0.00571	0.08	1.357	0.00857	0.12	0.1372	0.9795	1910705	Bionet1_004243	FC(F)(F)c1ccccc1n2cc(nn2)C(=O)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A06	compound treatment	1.231	-0.0123	-0.17	1.379	0.0306	0.42	0.1776	0.3958	1910706	Bionet1_004244	FC(F)(F)c1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A07	compound treatment	1.216	-0.0273	-0.37	1.348	-4.26E-4	-0.01	-0.2644	-0.7182	1163461	Bionet1_004245	CN1CCN(CC1)c2ccc(cc2)C(=O)c3cn(nn3)c4ccc(C)c(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A08	compound treatment	1.252	0.00871	0.12	1.411	0.0626	0.85	0.6865	0.797	1407957	Bionet1_004246	Clc1ccc(c(Cl)c1)S(=O)(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A09	compound treatment	1.212	-0.0313	-0.42	1.316	-0.0324	-0.44	-0.6111	-0.9997	1910707	Bionet1_004247	FC(F)(F)C(CN1CCCCC1)OC(=O)Nc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A10	compound treatment	1.27	0.0267	0.36	1.353	0.00457	0.06	0.2989	0.8173	1206614	Bionet1_004248	Clc1cccc(c1Cl)S(=O)(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A11	compound treatment	1.218	-0.0253	-0.34	1.31	-0.0384	-0.52	-0.6118	-0.9784	1910708	Bionet1_004249	Brc1ccc(CSC2=Nc3ccccc3C4=NC(=O)CN42)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A12	compound treatment	1.146	-0.0973	-1.31	1.344	-0.00443	-0.06	-0.9707	-0.7388	1315919	Bionet1_004250	Clc1ccc(cc1Cl)S(=O)(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A13	compound treatment	1.2	-0.0433	-0.58	1.351	0.00257	0.04	-0.3881	-0.6634	1910709	Bionet1_004251	Clc1ccc(CSC2=Nc3ccccc3C4=NC(=O)CN42)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A14	compound treatment	1.254	0.0107	0.14	1.351	0.00257	0.04	0.127	0.854	1241057	Bionet1_004252	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A15	compound treatment	1.199	-0.0443	-0.6	1.39	0.0416	0.57	-0.0216	-0.0262	1910710	Bionet1_004253	FC(F)(F)c1nc2cc(Cl)c(Cl)cc2nc1C(C#N)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A16	compound treatment	1.226	-0.0173	-0.23	1.406	0.0576	0.79	0.3902	0.4765	1426382	Bionet1_004254	Clc1ccc(CC(=O)c2cc(C#N)n(Cc3cccc(Cl)c3)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A17	compound treatment	1.231	-0.0123	-0.17	1.4	0.0516	0.7	0.3801	0.526	1276216	Bionet1_004255	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A18	compound treatment	1.276	0.0327	0.44	1.389	0.0406	0.55	0.7033	0.9937	1910711	Bionet1_004256	COc1cc2N=C(SCc3ccc(C)cc3)N4CC(=O)N=C4c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A19	compound treatment	1.255	0.0117	0.16	1.288	-0.0604	-0.82	-0.4709	-0.5613	1910712	Bionet1_004257	Clc1ccc(cc1)C(=O)O/N=C/c2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A20	compound treatment	1.251	0.00771	0.1	1.343	-0.00543	-0.07	0.0212	0.1664	1910713	Bionet1_004258	COc1cc2N=C(SCc3cccc(F)c3)N4CC(=O)N=C4c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A21	compound treatment	1.253	0.00971	0.13	1.352	0.00357	0.05	0.1271	0.9093	1910714	Bionet1_004259	FC(F)(F)c1ccc(cc1)C(=O)O/N=C/c2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	A22	compound treatment	1.216	-0.0273	-0.37	1.343	-0.00543	-0.07	-0.3126	-0.8326	1910715	Bionet1_004260	COc1cc2N=C(SCc3cccc(C)c3)N4CC(=O)N=C4c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B03	compound treatment	1.259	0.0157	0.21	1.371	0.0226	0.31	0.3675	0.9834	1910716	Bionet1_004261	COc1ccccc1/C=C(\C(=O)NCc2ccc(F)cc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B04	compound treatment	1.238	-0.00529	-0.07	1.375	0.0266	0.36	0.2058	0.5572	1910717	Bionet1_004262	Clc1cccc(COc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B05	compound treatment	1.284	0.0407	0.55	1.344	-0.00443	-0.06	0.3457	0.6256	1910718	Bionet1_004263	COc1cc(Br)cc(/C=N/c2ccc3nc(C)c(C)nc3c2)c1O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B06	compound treatment	1.253	0.00971	0.13	1.353	0.00457	0.06	0.1367	0.9424	1689914	Bionet1_004264	Cc1ccc(COc2ccc(cc2)c3nccc(n3)c4cccs4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B07	compound treatment	1.258	0.0147	0.2	1.359	0.0106	0.14	0.2423	0.9877	1910719	Bionet1_004265	Cc1nc2ccc(NS(=O)(=O)c3cccc(c3)C(F)(F)F)cc2nc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B08	compound treatment	1.266	0.0227	0.31	1.36	0.0116	0.16	0.3283	0.9524	1910720	Bionet1_004266	CC(Oc1ccc(c(F)c1)c2ccccc2)c3ccn(n3)C(=O)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B09	compound treatment	1.208	-0.0353	-0.48	1.372	0.0236	0.32	-0.1093	-0.1903	1498604	Bionet1_004267	CCOC(=O)NC(C1CCCC(C(=O)OCC)C1=O)c2ccccc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B10	compound treatment	1.238	-0.00529	-0.07	1.332	-0.0164	-0.22	-0.2088	-0.8884	1544575	Bionet1_004268	COC(=O)Cc1c(O)ccn(CCc2ccc(cc2)S(=O)(=O)N)c1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B11	compound treatment	1.236	-0.00729	-0.1	1.39	0.0416	0.57	0.3313	0.5759	1910721	Bionet1_004269	COc1ccccc1/C=C(\C(=O)N2CCN(CC2)c3ccccc3)/c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B12	compound treatment	1.21	-0.0333	-0.45	1.338	-0.0104	-0.14	-0.4181	-0.8876	1910722	Bionet1_004270	COc1ccc(cc1)C2C(=C(N)Oc3c2c(C)nn3c4ccc(C)cc4)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B13	compound treatment	1.253	0.00971	0.13	1.388	0.0396	0.54	0.4742	0.854	1910723	Bionet1_004271	COc1ccc(CNC(=O)/C(=C\c2ccccc2OC)/c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B14	compound treatment	1.233	-0.0103	-0.14	1.349	5.74E-4	0.01	-0.0926	-0.6662	1910724	Bionet1_004272	COc1ccc(cc1)C2C(C#N)C(=O)Nc3c2c(C)nn3C4=NCCCN4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B15	compound treatment	1.27	0.0267	0.36	1.316	-0.0324	-0.44	-0.0579	-0.1014	1910725	Bionet1_004273	COc1ccccc1/C=C(\C(=O)NCc2ccc(C)cc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B16	compound treatment	1.238	-0.00529	-0.07	1.395	0.0466	0.64	0.3986	0.6238	1910726	Bionet1_004274	Cc1nc(sc1C(=O)/C=C/c2ccc(Cl)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B17	compound treatment	1.224	-0.0193	-0.26	1.351	0.00257	0.04	-0.1592	-0.6062	1910727	Bionet1_004275	COc1ccccc1/C=C(/C(=O)NCCCn2ccnc2)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B18	compound treatment	1.236	-0.00729	-0.1	1.32	-0.0284	-0.39	-0.3436	-0.8593	1910728	Bionet1_004276	Cc1nn2c(cc(nc2c1Br)c3ccccc3Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B19	compound treatment	1.222	-0.0213	-0.29	1.392	0.0436	0.59	0.2171	0.3289	1910729	Bionet1_004277	Clc1ccc(cc1)C(=O)NNC(=O)C2Cc3c(O2)ccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B20	compound treatment	1.242	-0.00129	-0.02	1.348	-4.26E-4	-0.01	-0.0164	-0.8949	1910730	Bionet1_004278	Fc1ccc(CNC(=O)/C=C/c2cc3OCOc3cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B21	compound treatment	1.213	-0.0303	-0.41	1.377	0.0286	0.39	-0.0134	-0.0238	1910731	Bionet1_004279	Cc1ccc(cc1)S(=O)(=O)NNC(=O)C2Cc3c(O2)ccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	B22	compound treatment	1.233	-0.0103	-0.14	1.353	0.00457	0.06	-0.054	-0.3552	1910732	Bionet1_004280	COc1ccc(CNC(=O)/C=C/c2cc3OCOc3cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C03	compound treatment	1.215	-0.0283	-0.38	1.333	-0.0154	-0.21	-0.4186	-0.9606	1233450	Bionet1_004281	CCOC(=O)c1c(C)nn(c1C)c2ccc(NC(=O)Nc3ccccc3)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C04	compound treatment	1.274	0.0307	0.41	1.354	0.00557	0.08	0.3467	0.8231	1910733	Bionet1_004282	COc1cc2N=C(SCC(=O)OC(C)(C)C)N3CC(=O)N=C3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C05	compound treatment	1.254	0.0107	0.14	1.32	-0.0284	-0.39	-0.1719	-0.4156	1267560	Bionet1_004283	CCOC(=O)c1c(C)nn(c1C)c2ccc(NC(=O)Nc3ccc(C)cc3)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C06	compound treatment	1.257	0.0137	0.18	1.355	0.00657	0.09	0.1942	0.9447	1910734	Bionet1_004284	COc1cc2N=C(SCc3ccccc3)N4CC(=O)N=C4c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C07	compound treatment	1.268	0.0247	0.33	1.305	-0.0434	-0.59	-0.183	-0.2693	1910735	Bionet1_004285	COc1ccc(cc1)C(=O)O/N=C/c2ccc(OCc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C08	compound treatment	1.266	0.0227	0.31	1.425	0.0766	1.04	0.955	0.8776	1910736	Bionet1_004286	FC(F)(F)c1cccc(c1)C(=O)N2CCN(CC2)c3ccc(C#N)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C09	compound treatment	1.257	0.0137	0.18	1.342	-0.00643	-0.09	0.0688	0.3363	1910737	Bionet1_004287	Cc1ccc(N/C=C/C(=O)c2ccccc2OCc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C10	compound treatment	1.205	-0.0383	-0.52	1.385	0.0366	0.5	-0.0126	-0.0175	1430967	Bionet1_004288	Fc1cccc(Cl)c1Cn2cc(cc2C#N)C(=O)Cc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C11	compound treatment	1.207	-0.0363	-0.49	1.395	0.0466	0.64	0.1029	0.1283	1212717	Bionet1_004289	CCOC(=O)c1ccc(cc1)n2cc(nn2)C(=O)c3ccc(cc3)n4ccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C12	compound treatment	1.294	0.0507	0.68	1.407	0.0586	0.8	1.0485	0.997	1741576	Bionet1_004290	Clc1cc(Cl)cc(Oc2nc3ccccc3nc2Cc4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C13	compound treatment	1.306	0.0627	0.85	1.371	0.0226	0.31	0.8159	0.9063	1910738	Bionet1_004291	Cc1ccc(/C=N/NC(=O)c2sc3nc(C)cc(C)c3c2n4cccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C14	compound treatment	1.266	0.0227	0.31	1.405	0.0566	0.77	0.7622	0.9182	1910739	Bionet1_004292	[O-][N+](=O)c1ccc(C/2CCCC\C2=N\Nc3cccc(F)n3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C15	compound treatment	1.244	7.12E-4	0.01	1.37	0.0216	0.29	0.2148	0.7298	1541859	Bionet1_004293	Clc1ccccc1Cn2nc(c3ccccc3)c(cc2=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C16	compound treatment	1.254	0.0107	0.14	1.386	0.0376	0.51	0.4645	0.8725	1910740	Bionet1_004294	[O-][N+](=O)c1ccc(C/2CCCC\C2=N\Nc3cccc(Cl)n3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C17	compound treatment	1.201	-0.0423	-0.57	1.427	0.0786	1.07	0.3542	0.2918	1166194	Bionet1_004295	Cc1ccc(SCC2(O)CCN(CC2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C18	compound treatment	1.228	-0.0153	-0.21	1.436	0.0876	1.19	0.6986	0.5764	1910741	Bionet1_004296	[O-][N+](=O)c1ccc(C/2CCCC\C2=N\Nc3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C19	compound treatment	1.247	0.00371	0.05	1.412	0.0636	0.87	0.6484	0.7467	1652199	Bionet1_004297	Fc1ccc(Cn2nc(c3ccccc3)c(cc2=O)N4CCCCC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C20	compound treatment	1.243	-2.88E-4	0.0	1.326	-0.0224	-0.31	-0.219	-0.716	1234234	Bionet1_004298	Brc1ccccc1C(=O)c2c[nH]c(c2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C21	compound treatment	1.26	0.0167	0.23	1.376	0.0276	0.38	0.4253	0.9701	1492477	Bionet1_004299	Cc1cccc(Cn2nc(c3ccccc3)c(cc2=O)N4CCCCC4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	C22	compound treatment	1.264	0.0207	0.28	1.382	0.0336	0.46	0.5213	0.9719	1910742	Bionet1_004300	FC(F)(F)C(=O)/C=C/N1CCN(CC1)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D03	compound treatment	1.244	7.12E-4	0.01	1.358	0.00957	0.13	0.0991	0.7571	1910743	Bionet1_004301	COc1ccccc1/C=C(/C(=O)NCCc2ccccc2)\c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D04	compound treatment	1.264	0.0207	0.28	1.368	0.0196	0.27	0.3863	0.9997	1910744	Bionet1_004302	Cc1ccc(N/C=C/C(=O)c2cnc(s2)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D05	compound treatment	1.25	0.00671	0.09	1.396	0.0476	0.65	0.5227	0.7981	1910745	Bionet1_004303	COc1ccc(cc1)S(=O)(=O)NNC(=O)C2Cc3c(O2)ccc4ccccc34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D06	compound treatment	1.203	-0.0403	-0.54	1.324	-0.0244	-0.33	-0.6199	-0.9724	1910746	Bionet1_004304	COc1ccc(Oc2nc3cc(Cl)c(Cl)cc3nc2C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D07	compound treatment	1.285	0.0417	0.56	1.36	0.0116	0.16	0.5095	0.8718	1910747	Bionet1_004305	Fc1ccc(/C=N/Nc2nc3ccccc3nc2Cc4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D08	compound treatment	1.207	-0.0363	-0.49	1.339	-0.00943	-0.13	-0.4371	-0.8635	1119539	Bionet1_004306	COc1ccc(cc1)c2ccnc(n2)c3ccc(OCc4cccc(F)c4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D09	compound treatment	1.235	-0.00829	-0.11	1.364	0.0156	0.21	0.0711	0.2962	1910748	Bionet1_004307	COCCN1C(=O)NC(=O)/C(=C\c2ccc(Br)cc2)/C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D10	compound treatment	1.228	-0.0153	-0.21	1.314	-0.0344	-0.47	-0.4778	-0.9318	1910749	Bionet1_004308	CN(C)CCCNC(=O)c1cc(c[nH]1)C(=O)c2cccc(Cl)c2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D11	compound treatment	1.227	-0.0163	-0.22	1.342	-0.00643	-0.09	-0.2173	-0.9187	1910750	Bionet1_004309	CCc1cc(=O)[nH]c(SCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D12	compound treatment	1.232	-0.0113	-0.15	1.348	-4.26E-4	-0.01	-0.1118	-0.7336	1389266	Bionet1_004310	O=C(COc1ccc(cc1)c2nccc(n2)c3ccccn3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D13	compound treatment	1.32	0.0767	1.03	1.371	0.0226	0.31	0.9494	0.8794	1259631	Bionet1_004311	COc1ccc(NC(=O)c2ccc(cc2)N3CCS(=O)(=O)CC3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D14	compound treatment	1.252	0.00871	0.12	1.295	-0.0534	-0.73	-0.4321	-0.5855	1910751	Bionet1_004312	COCCCNC(=O)COc1ccc(cc1)c2nccc(n2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D15	compound treatment	1.188	-0.0553	-0.75	1.344	-0.00443	-0.06	-0.5701	-0.7618	1910752	Bionet1_004313	CCOC(=O)c1cnn2c(C)c(Cc3c(Cl)cccc3Cl)c(C)nc12
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D16	compound treatment	1.254	0.0107	0.14	1.355	0.00657	0.09	0.1656	0.9736	1910753	Bionet1_004314	CC(=O)Oc1c(C(=O)C)c2ccccn2c1c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D17	compound treatment	1.288	0.0447	0.6	1.323	-0.0254	-0.35	0.1813	0.2607	1910754	Bionet1_004315	CC(=O)c1ccccc1N/C=C/C(=O)c2ccc(Oc3ccccc3)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D18	compound treatment	1.258	0.0147	0.2	1.364	0.0156	0.21	0.2905	0.9994	1671266	Bionet1_004316	O=C1C2(CC2c3ccccc3)CN(Cc4ccccc4)CC51CC5c6ccccc6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D19	compound treatment	1.263	0.0197	0.27	1.402	0.0536	0.73	0.7046	0.9063	1426932	Bionet1_004317	CCOC(=O)c1cnc2ccc(C)cc2c1Sc3ccccc3C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D20	compound treatment	1.23	-0.0133	-0.18	1.347	-0.00143	-0.02	-0.1405	-0.7793	1439112	Bionet1_004318	CCOC(=O)c1c(C)nn(c1C)c2ccc(NC(=O)c3cccs3)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D21	compound treatment	1.25	0.00671	0.09	1.327	-0.0214	-0.29	-0.1426	-0.4661	1910755	Bionet1_004319	CCOC(=O)c1cnc2c(F)cccc2c1Oc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	D22	compound treatment	1.182	-0.0613	-0.83	1.354	0.00557	0.08	-0.5309	-0.6394	1397683	Bionet1_004320	CCOC(=O)c1c(C)nn(c1C)c2ccc(NC(=O)c3c(F)cccc3F)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E03	compound treatment	1.232	-0.0113	-0.15	1.37	0.0216	0.29	0.1003	0.3029	1910756	Bionet1_004321	COc1cnc(nc1Oc2ccc(Cl)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E04	compound treatment	1.232	-0.0113	-0.15	1.386	0.0376	0.51	0.2546	0.4763	1910757	Bionet1_004322	Clc1ncc(COc2ccc3ccccc3c2C=C(C#N)C#N)s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E05	compound treatment	1.19	-0.0533	-0.72	1.328	-0.0204	-0.28	-0.7053	-0.9148	1210306	Bionet1_004323	OC1(CSc2ccccc2)CCN(CC1)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E06	compound treatment	1.233	-0.0103	-0.14	1.36	0.0116	0.16	0.0135	0.064	1148614	Bionet1_004324	CC(Oc1ccc(c(F)c1)c2ccccc2)c3ccn(n3)C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E07	compound treatment	1.226	-0.0173	-0.23	1.395	0.0466	0.64	0.2842	0.42	1590913	Bionet1_004325	OC1(CSc2ccc(F)cc2)CCN(CC1)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E08	compound treatment	1.302	0.0587	0.79	1.386	0.0376	0.51	0.9224	0.9778	1910758	Bionet1_004326	Cc1ccc(cc1)c2ccnc(n2)c3ccc(OCc4ccc(cc4)[N+](=O)[O-])cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E09	compound treatment	1.201	-0.0423	-0.57	1.384	0.0356	0.49	-0.0604	-0.0806	1349748	Bionet1_004327	OC1(CN2CCOCC2)CCN(CC1)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E10	compound treatment	1.295	0.0517	0.7	1.41	0.0616	0.84	1.087	0.9958	1910759	Bionet1_004328	Cc1nc(sc1C(=O)CC(C(C#N)C#N)c2ccccc2)c3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E11	compound treatment	1.231	-0.0123	-0.17	1.344	-0.00443	-0.06	-0.1599	-0.9064	1372261	Bionet1_004329	CN1CCN(CC2(O)CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)CC1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E12	compound treatment	1.196	-0.0473	-0.64	1.394	0.0456	0.62	-0.0117	-0.0131	1910760	Bionet1_004330	FC(F)(F)c1cc(cc(c1)C(F)(F)F)n2cc(nn2)C(=O)c3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E13	compound treatment	1.241	-0.00229	-0.03	1.365	0.0166	0.23	0.138	0.6049	1274041	Bionet1_004331	Cc1cc(C)c(C#N)c(Sc2ccccc2NC(=O)c3cccs3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E14	compound treatment	1.216	-0.0273	-0.37	1.362	0.0136	0.19	-0.1294	-0.3141	1910761	Bionet1_004332	Cc1c(nnn1c2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)c3ccncc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E15	compound treatment	1.283	0.0397	0.54	1.375	0.0266	0.36	0.6351	0.9819	1251569	Bionet1_004333	Cc1cc(C)c(C#N)c(Sc2ccccc2NC(=O)c3ccc(F)cc3)n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E16	compound treatment	1.258	0.0147	0.2	1.336	-0.0124	-0.17	0.0205	0.0786	1137482	Bionet1_004334	CC(Oc1ccc(c(F)c1)c2ccccc2)c3ccn(n3)C(=O)c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E17	compound treatment	1.307	0.0637	0.86	1.394	0.0456	0.62	1.0472	0.9873	1611768	Bionet1_004335	COc1cccc(c1)C(=O)Nc2ccccc2Sc3nc(C)cc(C)c3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E18	compound treatment	1.217	-0.0263	-0.35	1.397	0.0486	0.66	0.2176	0.2896	1910762	Bionet1_004336	FCCCOc1ccc(cc1)c2nccc(n2)c3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E19	compound treatment	1.255	0.0117	0.16	1.383	0.0346	0.47	0.4451	0.8951	1372524	Bionet1_004337	Cc1cccc(c1)C(=O)Nc2ccccc2Sc3nc(C)cc(C)c3C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E20	compound treatment	1.282	0.0387	0.52	1.386	0.0376	0.51	0.7316	1.0	1262404	Bionet1_004338	CC(Oc1ccc(c(F)c1)c2ccccc2)c3ccn(n3)C(=O)c4ccco4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E21	compound treatment	1.272	0.0287	0.39	1.383	0.0346	0.47	0.6073	0.9952	1200589	Bionet1_004339	Cn1nc(c(c1Cl)c2nc(no2)c3ccccc3Cl)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	E22	compound treatment	1.25	0.00671	0.09	1.355	0.00657	0.09	0.1274	1.0	1910763	Bionet1_004340	FCCCOc1ccc(cc1)c2nccc(n2)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F03	compound treatment	1.221	-0.0223	-0.3	1.363	0.0146	0.2	-0.0721	-0.2	1536260	Bionet1_004341	CCOC(=O)c1cnc2c(F)cccc2c1Oc3ccccc3C(=O)OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F04	compound treatment	1.242	-0.00129	-0.02	1.307	-0.0414	-0.56	-0.4117	-0.7285	1311426	Bionet1_004342	CCOC(=O)c1c(C)nn(c1C)c2ccc(NC(=O)c3ccco3)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F05	compound treatment	1.269	0.0257	0.35	1.381	0.0326	0.44	0.5594	0.9925	1910764	Bionet1_004343	COC(=O)c1cc2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F06	compound treatment	1.239	-0.00429	-0.06	1.321	-0.0274	-0.37	-0.3054	-0.8069	1492508	Bionet1_004344	COC(=O)C1=C(C)NC(=C(C1c2ccc3ccccc3n2)C(=O)OC)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F07	compound treatment	1.242	-0.00129	-0.02	1.349	5.74E-4	0.01	-0.0068	-0.3546	1910765	Bionet1_004345	COC(=O)c1cc2cc(NS(=O)(=O)Cc3ccccc3)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F08	compound treatment	1.251	0.00771	0.1	1.377	0.0286	0.39	0.3491	0.8656	1910766	Bionet1_004346	Brc1cc2OCOc2cc1/C=C/C(=O)NCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F09	compound treatment	1.205	-0.0383	-0.52	1.343	-0.00543	-0.07	-0.4176	-0.8002	1910767	Bionet1_004347	COC(=O)c1cc2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2s1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F10	compound treatment	1.212	-0.0313	-0.42	1.292	-0.0564	-0.77	-0.8426	-0.96	1910768	Bionet1_004348	COCCCNC(=O)c1cc(c[nH]1)C(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F11	compound treatment	1.287	0.0437	0.59	1.329	-0.0194	-0.26	0.2297	0.3553	1601368	Bionet1_004349	COC(=O)C(C)Oc1ccc(cc1)c2nccc(n2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F12	compound treatment	1.253	0.00971	0.13	1.313	-0.0354	-0.48	-0.249	-0.4974	1910769	Bionet1_004350	Clc1ccc(NC(=O)NNC(=O)C2CC(=NO2)c3cccnc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F13	compound treatment	1.282	0.0387	0.52	1.355	0.00657	0.09	0.4327	0.8165	1910770	Bionet1_004351	COC(=O)CCCOc1ccc(cc1)c2nccc(n2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F14	compound treatment	1.23	-0.0133	-0.18	1.295	-0.0534	-0.73	-0.6419	-0.8556	1910771	Bionet1_004352	Cc1ccc(/C=C/2\S/C(=N\n3cnnc3)/N(C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F15	compound treatment	1.27	0.0267	0.36	1.355	0.00657	0.09	0.3182	0.8569	1262536	Bionet1_004353	COc1ccc(cc1)c2nnc3SCC(=Nn23)c4ccc(Cl)cc4Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F16	compound treatment	1.249	0.00571	0.08	1.32	-0.0284	-0.39	-0.2196	-0.5557	1910772	Bionet1_004354	CCCCCCCNC(=O)c1cc(c[nH]1)C(=O)c2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F17	compound treatment	1.296	0.0527	0.71	1.394	0.0456	0.62	0.9423	0.9977	1593127	Bionet1_004355	Cc1nnc(COc2cccc3n(ccc23)S(=O)(=O)c4ccc(C)cc4)o1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F18	compound treatment	1.236	-0.00729	-0.1	1.294	-0.0544	-0.74	-0.5943	-0.7938	1910773	Bionet1_004356	Clc1ccccc1NC(=O)NNC(=O)C2CC(=NO2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F19	compound treatment	1.246	0.00271	0.04	1.324	-0.0244	-0.33	-0.2097	-0.6257	1910774	Bionet1_004357	Cc1ccc(cc1)C(=O)CSc2nnc(o2)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F20	compound treatment	1.266	0.0227	0.31	1.343	-0.00543	-0.07	0.1643	0.5213	1910775	Bionet1_004358	FC(F)(F)c1cccc(c1)C(=O)c2c[nH]c(c2)C(=O)NCc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F21	compound treatment	1.221	-0.0223	-0.3	1.342	-0.00643	-0.09	-0.2746	-0.8767	1910776	Bionet1_004359	FC(F)(F)c1cccc(Oc2ccccc2C=C3C(=O)NC(=O)NC3=O)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	F22	compound treatment	1.173	-0.0703	-0.95	1.315	-0.0334	-0.46	-0.9928	-0.9436	1910777	Bionet1_004360	COc1ccc(NC(=O)NNC(=O)C2CC(=NO2)c3cccnc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G03	compound treatment	1.237	-0.00629	-0.08	1.345	-0.00343	-0.05	-0.093	-0.9605	1412425	Bionet1_004361	Cn1nc(c(c1Cl)c2nc(no2)c3cccc(Cl)c3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G04	compound treatment	1.272	0.0287	0.39	1.365	0.0166	0.23	0.4337	0.9671	1910778	Bionet1_004362	Cn1cccc1c2nnc(SCc3ccc(Br)cc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G05	compound treatment	1.225	-0.0183	-0.25	1.321	-0.0274	-0.37	-0.4389	-0.9796	1910779	Bionet1_004363	Cn1nc(c(c1Cl)c2nc(no2)c3ccc(Cl)cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G06	compound treatment	1.288	0.0447	0.6	1.356	0.00757	0.1	0.4995	0.8163	1910780	Bionet1_004364	COc1ccc(cc1)C(=O)CSc2nnc(o2)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G07	compound treatment	1.236	-0.00729	-0.1	1.392	0.0436	0.59	0.3506	0.5822	1202055	Bionet1_004365	Cc1ccc(OC(=O)CN(c2ccccc2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G08	compound treatment	1.23	-0.0133	-0.18	1.339	-0.00943	-0.13	-0.2177	-0.9867	1910781	Bionet1_004366	COc1ccc(cc1)c2nnc(SCc3ccc(cc3)C(F)(F)F)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G09	compound treatment	1.225	-0.0183	-0.25	1.399	0.0506	0.69	0.3132	0.4276	1443924	Bionet1_004367	Fc1ccc(OC(=O)CN(c2ccccc2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G10	compound treatment	1.249	0.00571	0.08	1.353	0.00457	0.06	0.0986	0.9945	1910782	Bionet1_004368	COc1ccc(cc1)c2nnc(SCC(=O)c3ccc(Cl)cc3Cl)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G11	compound treatment	1.227	-0.0163	-0.22	1.348	-4.26E-4	-0.01	-0.1595	-0.7256	1910783	Bionet1_004369	N/C(=N\OC(=O)c1ccccc1C(F)(F)F)/CS(=O)(=O)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G12	compound treatment	1.294	0.0507	0.68	1.395	0.0466	0.64	0.9328	0.9993	1390277	Bionet1_004370	CCOC(=O)COc1ccc(cc1)c2nccc(n2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G13	compound treatment	1.261	0.0177	0.24	1.4	0.0516	0.7	0.6663	0.897	1910784	Bionet1_004371	FC(F)(F)c1ccccc1C(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G14	compound treatment	1.251	0.00771	0.1	1.352	0.00357	0.05	0.108	0.9403	1910785	Bionet1_004372	OC(CN1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G15	compound treatment	1.279	0.0357	0.48	1.33	-0.0184	-0.25	0.163	0.3	1910786	Bionet1_004373	FC(F)(F)c1cccc(c1)C(=O)NNC(=O)c2sccc2n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G16	compound treatment	1.273	0.0297	0.4	1.362	0.0136	0.19	0.4143	0.9384	1910787	Bionet1_004374	COc1ccc(/C=C/C(OC(=O)Nc2cccc(F)c2)c3ccccn3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G17	compound treatment	1.251	0.00771	0.1	1.381	0.0326	0.44	0.3877	0.8497	1471906	Bionet1_004375	COc1ccccc1NC(=O)c2nn(ccc2=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G18	compound treatment	1.269	0.0257	0.35	1.35	0.00157	0.02	0.2604	0.7494	1910788	Bionet1_004376	COC(=O)CCCSC1=Nc2cc(OC)c(OC)cc2C3=NC(=O)CN31
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G19	compound treatment	1.234	-0.00929	-0.13	1.373	0.0246	0.34	0.1483	0.4146	1910789	Bionet1_004377	COc1ccccc1NC(=O)c2nn(ccc2=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G20	compound treatment	1.23	-0.0133	-0.18	1.349	5.74E-4	0.01	-0.1212	-0.6756	1910790	Bionet1_004378	COc1cc2NC(=S)N3C(Cc4ccccc4)C(=O)N=C3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G21	compound treatment	1.271	0.0277	0.37	1.422	0.0736	1.0	0.9738	0.9095	1502411	Bionet1_004379	COc1ccccc1NC(=O)c2nn(ccc2=O)c3ccc(F)c(F)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	G22	compound treatment	1.254	0.0107	0.14	1.421	0.0726	0.99	0.802	0.8019	1910791	Bionet1_004380	Cc1ccc(cc1)C(=O)NNC(=O)C2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H03	compound treatment	1.204	-0.0393	-0.53	1.337	-0.0114	-0.16	-0.485	-0.8778	1910792	Bionet1_004381	Cc1ccc(cc1)C2=Nn3c(nnc3SC2)c4ccc(cc4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H04	compound treatment	1.165	-0.0783	-1.06	1.305	-0.0434	-0.59	-1.1656	-0.9626	1720607	Bionet1_004382	O=C(C1Cc2c(O1)ccc3ccccc23)N4CCN(CC4)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H05	compound treatment	1.256	0.0127	0.17	1.368	0.0196	0.27	0.31	0.9771	1910793	Bionet1_004383	O=C(Oc1ccc(cc1)c2nccc(n2)c3ccccn3)c4cccs4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H06	compound treatment	1.204	-0.0393	-0.53	1.317	-0.0314	-0.43	-0.6778	-0.9944	1529856	Bionet1_004384	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H07	compound treatment	1.279	0.0357	0.48	1.329	-0.0194	-0.26	0.1533	0.2789	1422956	Bionet1_004385	Cc1nc(sc1C(=O)COc2ccc(Cl)c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H08	compound treatment	1.24	-0.00329	-0.04	1.307	-0.0414	-0.56	-0.4308	-0.7603	1440387	Bionet1_004386	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCc3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H09	compound treatment	1.249	0.00571	0.08	1.365	0.0166	0.23	0.2143	0.8975	1126110	Bionet1_004387	CCn1c(S)nnc1C2CCN(CC2)S(=O)(=O)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H10	compound treatment	1.259	0.0157	0.21	1.327	-0.0214	-0.29	-0.0567	-0.1571	1910794	Bionet1_004388	Clc1ccccc1CNC(=O)/C=C/c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H11	compound treatment	1.205	-0.0383	-0.52	1.374	0.0256	0.35	-0.1187	-0.1904	1910795	Bionet1_004389	NC(=O)C1(CCN(CC1)c2ccc(cn2)C(F)(F)F)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H12	compound treatment	1.266	0.0227	0.31	1.344	-0.00443	-0.06	0.174	0.5571	1910796	Bionet1_004390	FC(F)(F)c1cccc(CNC(=O)C2Cc3c(O2)ccc4ccccc34)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H13	compound treatment	1.217	-0.0263	-0.35	1.364	0.0156	0.21	-0.1006	-0.2434	1910797	Bionet1_004391	NC(=O)C1(CCN(CC1)c2ncc(cc2Cl)C(F)(F)F)N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H14	compound treatment	1.242	-0.00129	-0.02	1.37	0.0216	0.29	0.1957	0.6642	1910798	Bionet1_004392	Clc1ccc(CNC(=O)/C=C/c2cc3OCOc3cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H15	compound treatment	1.242	-0.00129	-0.02	1.356	0.00757	0.1	0.0607	0.5799	1742891	Bionet1_004393	CCn1c(SC)nnc1C2CCN(CC2)S(=O)(=O)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H16	compound treatment	1.209	-0.0343	-0.46	1.318	-0.0304	-0.41	-0.6205	-0.9985	1910799	Bionet1_004394	Clc1ccc(CN2CCC(CC2)C(=O)NNC(=O)C3CC3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H17	compound treatment	1.226	-0.0173	-0.23	1.349	5.74E-4	0.01	-0.1594	-0.683	1910800	Bionet1_004395	COc1cccc(c1)C(=O)Nc2ccc3sc4ccccc4c(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H18	compound treatment	1.255	0.0117	0.16	1.331	-0.0174	-0.24	-0.0563	-0.1973	1253700	Bionet1_004396	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCc3ccco3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H19	compound treatment	1.247	0.00371	0.05	1.35	0.00157	0.02	0.0506	0.9285	1910801	Bionet1_004397	CCOC(=O)c1cnc2ccc(cc2c1NCc3ccc(OC)cc3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H20	compound treatment	1.226	-0.0173	-0.23	1.295	-0.0534	-0.73	-0.6801	-0.889	1910802	Bionet1_004398	CCCCN(CCCC)C(=O)c1cc(c[nH]1)C(=O)c2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H21	compound treatment	1.258	0.0147	0.2	1.378	0.0296	0.4	0.4255	0.9467	1193957	Bionet1_004399	Nc1c(C#N)c(Oc2ccc3ccccc3c2)sc1C(=O)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	H22	compound treatment	1.196	-0.0473	-0.64	1.368	0.0196	0.27	-0.2624	-0.3794	1910803	Bionet1_004400	Fc1ccc(cc1)S(=O)(=O)NNC(=O)C2CC(=NO2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I03	compound treatment	1.263	0.0197	0.27	1.332	-0.0164	-0.22	0.0296	0.0853	1910804	Bionet1_004401	Cc1ccccc1NC(=O)c2nn(ccc2=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I04	compound treatment	1.213	-0.0303	-0.41	1.35	0.00157	0.02	-0.2738	-0.669	1910805	Bionet1_004402	Cc1ccc(cc1)S(=O)(=O)NNC(=O)C2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I05	compound treatment	1.254	0.0107	0.14	1.342	-0.00643	-0.09	0.0402	0.238	1910806	Bionet1_004403	Cc1nnsc1SCCNS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I06	compound treatment	1.264	0.0207	0.28	1.331	-0.0174	-0.24	0.0295	0.0805	1910807	Bionet1_004404	Clc1cccc(c1)C(=O)NNC(=O)C2CCN(Cc3ccccc3)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I07	compound treatment	1.222	-0.0213	-0.29	1.336	-0.0124	-0.17	-0.3229	-0.9683	1910808	Bionet1_004405	Nn1c(SCc2ccc(Cl)cc2Cl)nnc1c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I08	compound treatment	1.289	0.0457	0.62	1.342	-0.00643	-0.09	0.3741	0.6006	1338374	Bionet1_004406	Clc1ccc(C(=O)c2c[nH]c(c2)C(=O)NCC3CCCO3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I09	compound treatment	1.226	-0.0173	-0.23	1.377	0.0286	0.39	0.1106	0.2436	1910809	Bionet1_004407	Cc1ccc(cc1)S(=O)(=O)NNC(=O)/C=C/c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I10	compound treatment	1.245	0.00171	0.02	1.266	-0.0824	-1.12	-0.7785	-0.6924	1734049	Bionet1_004408	Cc1ccc(cc1)C(=O)n2ccc(n2)c3ccccc3OCc4ccc(F)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I11	compound treatment	1.281	0.0377	0.51	1.37	0.0216	0.29	0.5678	0.9661	1910810	Bionet1_004409	Clc1ccc(/C=C/C(=O)NNC(=O)c2ccc(Cl)c(Cl)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I12	compound treatment	1.213	-0.0303	-0.41	1.389	0.0406	0.55	0.1023	0.1487	1196488	Bionet1_004410	Fc1ccc(COc2ccccc2c3ccn(n3)C(=O)c4ccc(F)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I13	compound treatment	1.306	0.0627	0.85	1.354	0.00557	0.08	0.652	0.7675	1439273	Bionet1_004411	COc1ccc(Cc2nc(cs2)C(=O)Nc3ccc(OC)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I14	compound treatment	1.255	0.0117	0.16	1.352	0.00357	0.05	0.1462	0.8841	1267271	Bionet1_004412	Fc1ccc(COc2ccccc2c3ccn(Cc4ccc(Cl)cc4)n3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I15	compound treatment	1.226	-0.0173	-0.23	1.381	0.0326	0.44	0.1492	0.2973	1481246	Bionet1_004413	COc1ccc(NC(=O)c2csc(Cc3ccc(Cl)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I16	compound treatment	1.277	0.0337	0.45	1.343	-0.00543	-0.07	0.2693	0.5844	1700978	Bionet1_004414	COCc1cc(nc(n1)S(=O)(=O)Cc2ccc(Cl)cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I17	compound treatment	1.217	-0.0263	-0.35	1.374	0.0256	0.35	-0.0042	-0.0084	1614068	Bionet1_004415	COc1ccc(Cc2nc(cs2)C(=O)Nc3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I18	compound treatment	1.285	0.0417	0.56	1.285	-0.0634	-0.86	-0.2137	-0.2071	1565931	Bionet1_004416	OC1(CN2CCCC2)CCN(CC1)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I19	compound treatment	1.224	-0.0193	-0.26	1.406	0.0576	0.79	0.3712	0.4487	1667686	Bionet1_004417	COc1ccc(Cc2nc(cs2)C(=O)Nc3cc(Cl)cc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I20	compound treatment	1.265	0.0217	0.29	1.397	0.0486	0.66	0.6755	0.9327	1329348	Bionet1_004418	OC1(CN2CCCCC2)CCN(CC1)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I21	compound treatment	1.253	0.00971	0.13	1.451	0.103	1.4	1.0817	0.77	1910811	Bionet1_004419	COc1ccc(Cc2nc(cs2)C(=O)Nc3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	I22	compound treatment	1.257	0.0137	0.18	1.392	0.0436	0.59	0.551	0.8853	1224949	Bionet1_004420	CCN(CC)CC1(O)CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J03	compound treatment	1.264	0.0207	0.28	1.369	0.0206	0.28	0.396	1.0	1569213	Bionet1_004421	Fc1ccc(SCC(=O)N2CCC(CC2)c3nc4ccccc4s3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J04	compound treatment	1.239	-0.00429	-0.06	1.316	-0.0324	-0.44	-0.3536	-0.7929	1910812	Bionet1_004422	COc1ccccc1CNC(=O)/C=C/c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J05	compound treatment	1.23	-0.0133	-0.18	1.352	0.00357	0.05	-0.0923	-0.4969	1910813	Bionet1_004423	FC(F)(F)c1cccc(c1)C(=O)Nc2ccc3sc4ccccc4c(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J06	compound treatment	1.24	-0.00329	-0.04	1.273	-0.0754	-1.03	-0.7587	-0.7369	1689211	Bionet1_004424	COc1ccc(CNC(=O)c2cc(c[nH]2)C(=O)c3ccc(cc3)C(C)(C)C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J07	compound treatment	1.256	0.0127	0.17	1.326	-0.0224	-0.31	-0.095	-0.2709	1910814	Bionet1_004425	Clc1ccccc1C(=O)Nc2ccc3sc4ccccc4c(=O)c3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J08	compound treatment	1.223	-0.0203	-0.27	1.344	-0.00443	-0.06	-0.2362	-0.8428	1910815	Bionet1_004426	CS(=O)(=O)O/N=C/1\CCCCC1c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J09	compound treatment	1.25	0.00671	0.09	1.326	-0.0224	-0.31	-0.1522	-0.4773	1521833	Bionet1_004427	CC(=O)N(N1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O)C(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J10	compound treatment	1.257	0.0137	0.18	1.289	-0.0594	-0.81	-0.4422	-0.532	1910816	Bionet1_004428	Fc1ccccc1CO/N=C/c2cc3OCOc3cc2Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J11	compound treatment	1.258	0.0147	0.2	1.381	0.0326	0.44	0.4544	0.9341	1208446	Bionet1_004429	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J12	compound treatment	1.245	0.00171	0.02	1.274	-0.0744	-1.01	-0.7013	-0.6908	1910817	Bionet1_004430	CN1C(=O)N(C)C(=O)C(=Cc2cc3OCOc3cc2Br)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J13	compound treatment	1.26	0.0167	0.23	1.341	-0.00743	-0.1	0.0878	0.3553	1521290	Bionet1_004431	CC(C)NC(=O)NC1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J14	compound treatment	1.266	0.0227	0.31	1.294	-0.0544	-0.74	-0.3081	-0.3838	1910818	Bionet1_004432	COc1ccc(OC(=O)/C=C/c2cc3OCOc3cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J15	compound treatment	1.233	-0.0103	-0.14	1.354	0.00557	0.08	-0.0444	-0.2806	1675076	Bionet1_004433	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J16	compound treatment	1.217	-0.0263	-0.35	1.301	-0.0474	-0.65	-0.7081	-0.96	1440868	Bionet1_004434	CN1CCN(CC1)c2ncc(CN3CCN(CC3)c4ccccc4)s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J17	compound treatment	1.258	0.0147	0.2	1.39	0.0416	0.57	0.5412	0.901	1243115	Bionet1_004435	CC(C)OC(=O)NC1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J18	compound treatment	1.188	-0.0553	-0.75	1.34	-0.00843	-0.11	-0.6087	-0.8065	1737861	Bionet1_004436	Fc1cc(Br)ccc1NC(=S)Nc2ccc3nccnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J19	compound treatment	1.311	0.0677	0.91	1.384	0.0356	0.49	0.9889	0.9562	1416509	Bionet1_004437	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)OCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J20	compound treatment	1.219	-0.0243	-0.33	1.314	-0.0344	-0.47	-0.5636	-0.9845	1910819	Bionet1_004438	O=C/1N(/C(=N/n2cnnc2)/S\C1=C/c3cccs3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J21	compound treatment	1.266	0.0227	0.31	1.419	0.0706	0.96	0.8972	0.8883	1910820	Bionet1_004439	COc1cc(nc(Oc2cc(Cl)c(Cl)cc2Cl)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	J22	compound treatment	1.232	-0.0113	-0.15	1.317	-0.0314	-0.43	-0.4107	-0.9031	1375910	Bionet1_004440	CCC(=O)CC(C)(O)Nc1cc(n[nH]1)c2sccc2n3c(C)ccc3C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K03	compound treatment	1.241	-0.00229	-0.03	1.352	0.00357	0.05	0.0126	0.2189	1459681	Bionet1_004441	COc1ccc(CNC(=O)c2csc(Cc3ccc(OC)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K04	compound treatment	1.249	0.00571	0.08	1.322	-0.0264	-0.36	-0.2003	-0.5436	1292538	Bionet1_004442	OC1(CN2CCCCCC2)CCN(CC1)S(=O)(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K05	compound treatment	1.261	0.0177	0.24	1.336	-0.0124	-0.17	0.0491	0.1677	1204526	Bionet1_004443	Clc1ccc(Cc2nc(cs2)C(=O)Nc3cc(Cl)cc(Cl)c3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K06	compound treatment	1.246	0.00271	0.04	1.361	0.0126	0.17	0.1471	0.8391	1910821	Bionet1_004444	Cc1ccc(cc1)S(=O)(=O)NNC(=O)/C=C/c2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K07	compound treatment	1.225	-0.0183	-0.25	1.331	-0.0174	-0.24	-0.3425	-0.9998	1710874	Bionet1_004445	Clc1ccc(CNC(=O)c2csc(Cc3ccc(Cl)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K08	compound treatment	1.295	0.0517	0.7	1.32	-0.0284	-0.39	0.2192	0.2747	1232613	Bionet1_004446	Clc1ccc(Cn2nc-3c(CCc4ccccc43)cc2=O)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K09	compound treatment	1.289	0.0457	0.62	1.312	-0.0364	-0.5	0.0848	0.1071	1187522	Bionet1_004447	COc1ccc(CNC(=O)c2csc(Cc3ccc(Cl)cc3)n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K10	compound treatment	1.275	0.0317	0.43	1.37	0.0216	0.29	0.5105	0.9833	1222253	Bionet1_004448	Clc1ccc(Cn2nc-3c(CCc4ccccc43)cc2=O)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K11	compound treatment	1.273	0.0297	0.4	1.369	0.0206	0.28	0.4818	0.9848	1333888	Bionet1_004449	COc1ccccc1CNC(=O)c2csc(Cc3ccc(Cl)cc3)n2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K12	compound treatment	1.293	0.0497	0.67	1.324	-0.0244	-0.33	0.2387	0.3188	1910822	Bionet1_004450	CCSC/1=Nc2ccccc2\C1=N\Nc3c(Cl)cc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K13	compound treatment	1.221	-0.0223	-0.3	1.334	-0.0144	-0.2	-0.3517	-0.9788	1633414	Bionet1_004451	COc1ccc(Cc2nc(cs2)C(=O)NCc3ccccc3OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K14	compound treatment	1.294	0.0507	0.68	1.383	0.0346	0.47	0.8171	0.9835	1910823	Bionet1_004452	CCCSC/1=Nc2ccccc2\C1=N\Nc3c(Cl)cc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K15	compound treatment	1.229	-0.0143	-0.19	1.373	0.0246	0.34	0.1006	0.2604	1910824	Bionet1_004453	COc1ccc(NC(=O)Cc2nc(no2)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K16	compound treatment	1.238	-0.00529	-0.07	1.379	0.0306	0.42	0.2444	0.5777	1910825	Bionet1_004454	CC(C)SC/1=Nc2ccccc2\C1=N\Nc3c(Cl)cc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K17	compound treatment	1.275	0.0317	0.43	1.385	0.0366	0.5	0.6552	0.9971	1243839	Bionet1_004455	O=C(C1CCN(CC1)S(=O)(=O)c2ccccc2)N3CCC4(CC3)OCCO4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K18	compound treatment	1.301	0.0577	0.78	1.376	0.0276	0.38	0.8164	0.9443	1910826	Bionet1_004456	CCOc1ccc(NC(=O)Cn2c(nc3ccccc23)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K19	compound treatment	1.205	-0.0383	-0.52	1.366	0.0176	0.24	-0.1958	-0.3438	1644095	Bionet1_004457	O=C(C1CCN(CC1)S(=O)(=O)c2ccccc2)N3CCCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K20	compound treatment	1.238	-0.00529	-0.07	1.37	0.0216	0.29	0.1576	0.5205	1910827	Bionet1_004458	CCOc1ccccc1NC(=O)Cn2c(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K21	compound treatment	1.258	0.0147	0.2	1.377	0.0286	0.39	0.4159	0.951	1660753	Bionet1_004459	CC1CN(CC(C)O1)C(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	K22	compound treatment	1.272	0.0287	0.39	1.406	0.0576	0.79	0.829	0.947	1910828	Bionet1_004460	FC(F)(F)c1nc2ccccc2n1CC(=O)Nc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L03	compound treatment	1.252	0.00871	0.12	1.325	-0.0234	-0.32	-0.1428	-0.4195	1210262	Bionet1_004461	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L04	compound treatment	1.236	-0.00729	-0.1	1.334	-0.0144	-0.2	-0.2086	-0.9486	1910829	Bionet1_004462	Clc1ccc(/C=C/2\S/C(=N\n3cnnc3)/N(C2=O)c4ccccc4)cn1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L05	compound treatment	1.243	-2.88E-4	0.0	1.299	-0.0494	-0.67	-0.4793	-0.7112	1623157	Bionet1_004463	COc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L06	compound treatment	1.247	0.00371	0.05	1.315	-0.0334	-0.46	-0.2869	-0.6257	1910830	Bionet1_004464	Cc1ccc(C)n1c2ccsc2c3cc4ncc(C#N)c(n4n3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L07	compound treatment	1.253	0.00971	0.13	1.314	-0.0344	-0.47	-0.2393	-0.491	1220611	Bionet1_004465	COc1ccc(cc1)S(=O)(=O)N2CCC(CC2)NC(=O)NC(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L08	compound treatment	1.202	-0.0413	-0.56	1.275	-0.0734	-1.0	-1.1019	-0.9617	1910831	Bionet1_004466	CCN/1C(=O)/C(=C/c2ccc(NC(=O)C)cc2)/S\C1=N/n3cnnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L09	compound treatment	1.29	0.0467	0.63	1.346	-0.00243	-0.03	0.4222	0.6691	1910832	Bionet1_004467	CCOC(=O)c1cnc(SC)nc1Oc2cc(Cl)ccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L10	compound treatment	1.261	0.0177	0.24	1.297	-0.0514	-0.7	-0.3269	-0.4413	1910833	Bionet1_004468	COc1ccc(cc1)S(=O)(=O)NNC(=O)C2CC(=NO2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L11	compound treatment	1.245	0.00171	0.02	1.315	-0.0334	-0.46	-0.306	-0.6704	1910834	Bionet1_004469	COc1cc(nc(Oc2ccc(Cl)c3cccnc23)n1)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L12	compound treatment	1.219	-0.0243	-0.33	1.34	-0.00843	-0.11	-0.3129	-0.9013	1910835	Bionet1_004470	O=C(NC1(CC2CC3CC(C2)C1)C3)/C(=C/c4cccs4)/c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L13	compound treatment	1.203	-0.0403	-0.54	1.374	0.0256	0.35	-0.1377	-0.2133	1910836	Bionet1_004471	CCOC(=O)c1cnc(SC)nc1Oc2cc(Cl)c(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L14	compound treatment	1.275	0.0317	0.43	1.29	-0.0584	-0.8	-0.2609	-0.2885	1910837	Bionet1_004472	Cc1onc(c1C(=O)N2CCN=C(C=C2)C(F)(F)F)c3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L15	compound treatment	1.197	-0.0463	-0.62	1.341	-0.00743	-0.1	-0.5132	-0.8112	1910838	Bionet1_004473	CCOC(=O)c1cnc(SC)nc1Oc2ccc(Cl)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L16	compound treatment	1.269	0.0257	0.35	1.331	-0.0174	-0.24	0.0772	0.1837	1910839	Bionet1_004474	O=C(NCCCN1CCOCC1)/C(=C/c2cccs2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L17	compound treatment	1.27	0.0267	0.36	1.334	-0.0144	-0.2	0.1157	0.2818	1910840	Bionet1_004475	CSc1nc2ccccc2cc1/C=N/OC(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L18	compound treatment	1.171	-0.0723	-0.98	1.302	-0.0464	-0.63	-1.1372	-0.9781	1910841	Bionet1_004476	Fc1cccc(CN2CCC(CC2)C(=O)NNC(=O)c3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L19	compound treatment	1.262	0.0187	0.25	1.365	0.0166	0.23	0.3383	0.9985	1910842	Bionet1_004477	Cc1cc(C)c2c(c(NC(=O)OCc3ccccc3)sc2n1)n4cccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L20	compound treatment	1.221	-0.0223	-0.3	1.289	-0.0594	-0.81	-0.7856	-0.9089	1910843	Bionet1_004478	COc1cccc(c1)C(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L21	compound treatment	1.205	-0.0383	-0.52	1.344	-0.00443	-0.06	-0.4079	-0.7844	1328320	Bionet1_004479	COc1ccc(NC(=O)C(NC(=O)C)C(=O)NCc2ccccc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	L22	compound treatment	1.225	-0.0183	-0.25	1.324	-0.0244	-0.33	-0.41	-0.9891	1910844	Bionet1_004480	Cc1ccc(C)n1c2sccc2c3cc4nccc(c5ccc(F)cc5)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M03	compound treatment	1.283	0.0397	0.54	1.341	-0.00743	-0.1	0.3072	0.5635	1716501	Bionet1_004481	Clc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M04	compound treatment	1.265	0.0217	0.29	1.363	0.0146	0.2	0.3476	0.9821	1910845	Bionet1_004482	FC(F)(F)c1nc2ccccc2n1CC(=O)Nc3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M05	compound treatment	1.271	0.0277	0.37	1.353	0.00457	0.06	0.3085	0.8138	1594406	Bionet1_004483	COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M06	compound treatment	1.366	0.123	1.66	1.319	-0.0294	-0.4	0.8868	0.5206	1910846	Bionet1_004484	FC(F)(F)c1nc2ccccc2n1CC(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M07	compound treatment	1.23	-0.0133	-0.18	1.324	-0.0244	-0.33	-0.3623	-0.9578	1428687	Bionet1_004485	O=C(C1CCN(CC1)S(=O)(=O)c2ccccc2)C3C(=O)CCCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M08	compound treatment	1.301	0.0577	0.78	1.352	0.00357	0.05	0.585	0.7499	1910847	Bionet1_004486	FC(F)(F)c1nc2ccccc2n1CC(=O)Nc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M09	compound treatment	1.219	-0.0243	-0.33	1.338	-0.0104	-0.14	-0.3322	-0.9301	1316439	Bionet1_004487	CC1(C)CC(=O)C(C(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3)C(=O)C1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M10	compound treatment	1.24	-0.00329	-0.04	1.314	-0.0344	-0.47	-0.3633	-0.7705	1910848	Bionet1_004488	FC(F)(F)c1nc2ccccc2n1CC(=O)Nc3ccccc3C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M11	compound treatment	1.262	0.0187	0.25	1.33	-0.0184	-0.25	8.0E-4	0.0023	1910849	Bionet1_004489	Clc1ccc(NC(=O)c2cnn(c2c3ccccc3)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M12	compound treatment	1.264	0.0207	0.28	1.358	0.00957	0.13	0.2899	0.94	1910850	Bionet1_004490	Cc1nc(sc1C(=O)CSc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M13	compound treatment	1.248	0.00471	0.06	1.361	0.0126	0.17	0.1662	0.9088	1225671	Bionet1_004491	Cc1cccc(NC(=O)c2cnn(c2c3ccccc3)c4ccccc4)c1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M14	compound treatment	1.26	0.0167	0.23	1.345	-0.00343	-0.05	0.1264	0.5489	1910851	Bionet1_004492	Cc1nc(sc1C(=O)CSc2ccc(Cl)cc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M15	compound treatment	1.326	0.0827	1.12	1.318	-0.0304	-0.41	0.4956	0.4163	1174308	Bionet1_004493	Cc1nc2cc(C)ccn2c1C(=O)CSc3ccc(Br)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M16	compound treatment	1.191	-0.0523	-0.71	1.323	-0.0254	-0.35	-0.744	-0.9465	1910852	Bionet1_004494	Cc1nc(sc1C(=O)CSc2cccc(Cl)c2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M17	compound treatment	1.213	-0.0303	-0.41	1.33	-0.0184	-0.25	-0.4666	-0.9727	1641329	Bionet1_004495	Cc1nc2cc(C)ccn2c1C(=O)CSc3cccc(Cl)c3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M18	compound treatment	1.291	0.0477	0.64	1.372	0.0236	0.32	0.6824	0.9485	1910853	Bionet1_004496	COC(=O)c1ccccc1SCC(=O)c2sc(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M19	compound treatment	1.253	0.00971	0.13	1.335	-0.0134	-0.18	-0.0368	-0.1635	1325357	Bionet1_004497	Cc1nc2cc(C)ccn2c1C(=O)CSc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M20	compound treatment	1.268	0.0247	0.33	1.395	0.0466	0.64	0.6848	0.9547	1910854	Bionet1_004498	COc1cccc(SCC(=O)c2sc(nc2C)c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M21	compound treatment	1.281	0.0377	0.51	1.393	0.0446	0.61	0.7895	0.9961	1910855	Bionet1_004499	Cc1nc2cc(C)ccn2c1C(=O)CSc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	M22	compound treatment	1.293	0.0497	0.67	1.401	0.0526	0.72	0.9812	0.9994	1910856	Bionet1_004500	Cc1nc(sc1C(=O)CS(=O)(=O)c2ccccc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N03	compound treatment	1.227	-0.0163	-0.22	1.308	-0.0404	-0.55	-0.5452	-0.9187	1910857	Bionet1_004501	FC(F)(F)c1nnc(nc1Oc2ccc(Cl)cc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N04	compound treatment	1.206	-0.0373	-0.5	1.275	-0.0734	-1.0	-1.0637	-0.9493	1910858	Bionet1_004502	COc1ccc(/C=C/2\S/C(=N\n3cnnc3)/N(C2=O)c4ccccc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N05	compound treatment	1.258	0.0147	0.2	1.312	-0.0364	-0.5	-0.2109	-0.3943	1910859	Bionet1_004503	CN(NC(=O)c1ccc(C)cc1)c2nc(nnc2C(F)(F)F)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N06	compound treatment	1.227	-0.0163	-0.22	1.309	-0.0394	-0.54	-0.5355	-0.9221	1910860	Bionet1_004504	Fc1cccc(CN2CCC(CC2)C(=O)NNC(=O)c3cccc(Cl)c3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N07	compound treatment	1.26	0.0167	0.23	1.3	-0.0484	-0.66	-0.3075	-0.4407	1910861	Bionet1_004505	COC(=O)c1ccccc1OC(=O)Cn2c(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N08	compound treatment	1.201	-0.0423	-0.57	1.267	-0.0814	-1.11	-1.1885	-0.9521	1910862	Bionet1_004506	COc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N09	compound treatment	1.27	0.0267	0.36	1.335	-0.0134	-0.18	0.1253	0.3101	1263862	Bionet1_004507	COc1ccc(CNC(=O)C(NC(=O)C)C(=O)Nc2ccc(OC)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N10	compound treatment	1.241	-0.00229	-0.03	1.32	-0.0284	-0.39	-0.2959	-0.761	1370698	Bionet1_004508	COc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N11	compound treatment	1.216	-0.0273	-0.37	1.334	-0.0144	-0.2	-0.3994	-0.9569	1173583	Bionet1_004509	COc1ccc(NC(=O)C(NC(=O)C)C(=O)NCc2ccccc2Cl)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N12	compound treatment	1.253	0.00971	0.13	1.267	-0.0814	-1.11	-0.6925	-0.6194	1910863	Bionet1_004510	Cc1nc(sc1C(=O)/C=C/c2ccc(Oc3ccccc3)cc2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N13	compound treatment	1.192	-0.0513	-0.69	1.304	-0.0444	-0.61	-0.9176	-0.9978	1151772	Bionet1_004511	COc1ccc(NC(=O)C(NC(=O)C)C(=O)NCc2ccccc2OC)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N14	compound treatment	1.269	0.0257	0.35	1.32	-0.0284	-0.39	-0.0288	-0.0554	1910864	Bionet1_004512	Cc1nc(sc1C(=O)/C=C/c2c(F)cccc2Cl)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N15	compound treatment	1.267	0.0237	0.32	1.323	-0.0254	-0.35	-0.019	-0.0402	1476122	Bionet1_004513	COc1ccc(NC(=O)C(NC(=O)C)C(=O)NCc2ccc(F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N16	compound treatment	1.18	-0.0633	-0.85	1.342	-0.00643	-0.09	-0.6657	-0.7756	1910865	Bionet1_004514	COc1ccc(/C=C/C(=O)c2sc(nc2C)c3ccccc3)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N17	compound treatment	1.29	0.0467	0.63	1.365	0.0166	0.23	0.6054	0.9043	1910866	Bionet1_004515	CC(=O)Nc1ccc(OC(=O)Cn2c(nc3ccccc23)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N18	compound treatment	1.228	-0.0153	-0.21	1.317	-0.0314	-0.43	-0.4489	-0.9438	1910867	Bionet1_004516	CCCNC(=O)C(=O)c1cccn1c2c(cnn2c3ccccc3)C(=O)OCC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N19	compound treatment	1.212	-0.0313	-0.42	1.341	-0.00743	-0.1	-0.3701	-0.8526	1910868	Bionet1_004517	CC(C)(C)c1ccc(OC(=O)Cn2c(nc3ccccc23)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N20	compound treatment	1.217	-0.0263	-0.35	1.339	-0.00943	-0.13	-0.3417	-0.9057	1910869	Bionet1_004518	COC(=O)c1sccc1n2cccc2C(=O)C(=O)Nc3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N21	compound treatment	1.281	0.0377	0.51	1.358	0.00957	0.13	0.4521	0.8607	1910870	Bionet1_004519	CC(C)CC(=O)NN(C)c1nc(nnc1C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	N22	compound treatment	1.169	-0.0743	-1.0	1.337	-0.0114	-0.16	-0.8188	-0.8073	1910871	Bionet1_004520	COc1ccc(NC(=O)c2ccc(CNC(=O)OCC(F)(F)F)cc2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O03	compound treatment	1.232	-0.0113	-0.15	1.358	0.00957	0.13	-0.0154	-0.0766	1910872	Bionet1_004521	Cc1ccc(NC(=O)Cc2nc(no2)c3cccc(c3)C(F)(F)F)c(C)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O04	compound treatment	1.231	-0.0123	-0.17	1.367	0.0186	0.25	0.0619	0.2044	1591230	Bionet1_004522	Cc1nc(sc1C(=O)CSc2nc3ccccc3o2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O05	compound treatment	1.248	0.00471	0.06	1.345	-0.00343	-0.05	0.0119	0.1509	1257867	Bionet1_004523	Clc1ccc(NC(=O)c2csc(Cc3ccccc3)n2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O06	compound treatment	1.238	-0.00529	-0.07	1.37	0.0216	0.29	0.1576	0.5205	1910873	Bionet1_004524	Clc1ccc(CSc2nnc(/C=C/c3ccccc3)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O07	compound treatment	1.189	-0.0543	-0.73	1.339	-0.00943	-0.13	-0.6088	-0.8187	1291488	Bionet1_004525	Clc1ccc(NC(=O)c2csc(Cc3ccccc3)n2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O08	compound treatment	1.236	-0.00729	-0.1	1.352	0.00357	0.05	-0.0351	-0.3196	1910874	Bionet1_004526	Clc1ccc(CSc2nnc(/C=C/c3ccccc3)o2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O09	compound treatment	1.3	0.0567	0.77	1.392	0.0436	0.59	0.9611	0.9922	1185400	Bionet1_004527	Clc1cc(Cl)cc(NC(=O)c2csc(Cc3ccccc3)n2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O10	compound treatment	1.225	-0.0183	-0.25	1.34	-0.00843	-0.11	-0.2557	-0.9395	1910875	Bionet1_004528	Clc1ccc(CSc2cc3CCc4ccccc4-c3nn2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O11	compound treatment	1.207	-0.0363	-0.49	1.354	0.00557	0.08	-0.2924	-0.5903	1733781	Bionet1_004529	COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c3ccc(C)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O12	compound treatment	1.271	0.0277	0.37	1.376	0.0276	0.38	0.5302	1.0	1910876	Bionet1_004530	Clc1ccc(CSc2cc3CCc4ccccc4-c3nn2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O13	compound treatment	1.23	-0.0133	-0.18	1.335	-0.0134	-0.18	-0.2562	-0.9999	1460748	Bionet1_004531	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)Nc3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O14	compound treatment	1.225	-0.0183	-0.25	1.347	-0.00143	-0.02	-0.1882	-0.7605	1910877	Bionet1_004532	Brc1ccc(cc1)S(=O)(=O)O/N=C\2/CCCc3occc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O15	compound treatment	1.258	0.0147	0.2	1.366	0.0176	0.24	0.3098	0.9956	1701733	Bionet1_004533	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)C3C(=O)CCCC3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O16	compound treatment	1.242	-0.00129	-0.02	1.367	0.0186	0.25	0.1668	0.657	1910878	Bionet1_004534	FC(F)(F)c1nc2ccccc2n1CC(=O)NCc3ccccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O17	compound treatment	1.275	0.0317	0.43	1.337	-0.0114	-0.16	0.1923	0.4224	1647370	Bionet1_004535	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O18	compound treatment	1.245	0.00171	0.02	1.415	0.0666	0.91	0.6583	0.7249	1910879	Bionet1_004536	COc1ccc(CNC(=O)Cn2c(nc3ccccc23)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O19	compound treatment	1.218	-0.0253	-0.34	1.344	-0.00443	-0.06	-0.2839	-0.8195	1235812	Bionet1_004537	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O20	compound treatment	1.242	-0.00129	-0.02	1.393	0.0446	0.61	0.4175	0.6866	1910880	Bionet1_004538	FC(F)(F)c1nc2ccccc2n1CC(=O)N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O21	compound treatment	1.235	-0.00829	-0.11	1.372	0.0236	0.32	0.1482	0.4356	1910881	Bionet1_004539	Fc1ccc(Sc2nc(nnc2C(F)(F)F)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	O22	compound treatment	1.28	0.0367	0.5	1.364	0.0156	0.21	0.5004	0.9285	1910882	Bionet1_004540	Cc1ccc(C)n1c2ccsc2c3cc4nc(C)cc(n4n3)C(F)(F)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P03	compound treatment	1.189	-0.0543	-0.73	1.332	-0.0164	-0.22	-0.6763	-0.883	1910883	Bionet1_004541	CN(NC(=O)C(C)(C)C)c1nc(nnc1C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P04	compound treatment	1.25	0.00671	0.09	1.295	-0.0534	-0.73	-0.4511	-0.6145	1910884	Bionet1_004542	C/C(=N\OC(=O)Nc1cccc(Cl)c1)/c2sc(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P05	compound treatment	1.234	-0.00929	-0.13	1.316	-0.0324	-0.44	-0.4013	-0.8731	1910885	Bionet1_004543	FC(F)(F)c1nc2ccccc2n1CC(=O)Oc3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P06	compound treatment	1.185	-0.0583	-0.79	1.274	-0.0744	-1.01	-1.2737	-0.992	1910886	Bionet1_004544	C/C(=N\OC(=O)c1ccc(F)cc1)/c2sc(nc2C)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P07	compound treatment	1.216	-0.0273	-0.37	1.295	-0.0534	-0.73	-0.7755	-0.95	1910887	Bionet1_004545	FC(F)(F)c1nc2ccccc2n1CC(=O)Oc3cc(Cl)ccc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P08	compound treatment	1.231	-0.0123	-0.17	1.257	-0.0914	-1.25	-0.9988	-0.7941	1516902	Bionet1_004546	Clc1ccc(Cn2cc(ccc2=O)c3nc(no3)c4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P09	compound treatment	1.129	-0.114	-1.54	1.23	-0.118	-1.61	-2.2321	-0.9997	1910888	Bionet1_004547	CCCCC(=O)NN(C)c1nc(nnc1C(F)(F)F)c2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P10	compound treatment	0.103	-1.14	-15.38	0.347	-1.0	-13.66	-20.5337	-0.9982	1656008	Bionet1_004548	Clc1ccc(Cn2cc(ccc2=O)c3nc(no3)c4ccncc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P11	compound treatment	1.22	-0.0233	-0.31	1.331	-0.0174	-0.24	-0.3902	-0.9905	1910889	Bionet1_004549	FC(F)(F)c1nc2ccccc2n1CC(=O)Oc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P12	compound treatment	1.222	-0.0213	-0.29	1.258	-0.0904	-1.23	-1.075	-0.8491	1910890	Bionet1_004550	COC(=O)c1sc2ccccc2c1n3cccc3C(=O)C(=O)NCC=C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P13	compound treatment	1.226	-0.0173	-0.23	1.343	-0.00543	-0.07	-0.2172	-0.8878	1529643	Bionet1_004551	COc1ccc(cc1)c2ccnc(n2)c3ccc(OC(=O)c4ccc(F)cc4)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P14	compound treatment	1.195	-0.0483	-0.65	1.312	-0.0364	-0.5	-0.8119	-0.991	1910891	Bionet1_004552	COC(=O)c1sc2ccccc2c1n3cccc3C(=O)C(=O)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P15	compound treatment	1.253	0.00971	0.13	1.322	-0.0264	-0.36	-0.1622	-0.4229	1910892	Bionet1_004553	Fc1cccc(Cl)c1/C=C\2/C(OC(=O)Nc3ccccc3)C4CCN2CC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P16	compound treatment	1.175	-0.0683	-0.92	1.319	-0.0294	-0.4	-0.9352	-0.9307	1245946	Bionet1_004554	Fc1ccc(cc1)N2CCN(CC2)c3cc(=O)[nH]nc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P17	compound treatment	1.207	-0.0363	-0.49	1.298	-0.0504	-0.69	-0.8324	-0.9861	1098329	Bionet1_004555	COc1ccc(cc1)C2C(=C(N)Oc3c2c(C)nn3c4ccccc4)C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P18	compound treatment	1.175	-0.0683	-0.92	1.336	-0.0124	-0.17	-0.7712	-0.8234	1538132	Bionet1_004556	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3cc(=O)[nH]nc3c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P19	compound treatment	1.287	0.0437	0.59	1.334	-0.0144	-0.2	0.2779	0.447	1910893	Bionet1_004557	Fc1cccc(Cl)c1COc2ccc(/C=C\3/SC(=O)NC3=O)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P20	compound treatment	1.173	-0.0703	-0.95	1.319	-0.0294	-0.4	-0.9542	-0.9268	1910894	Bionet1_004558	Cc1ccc(CSc2nc(Cl)c3sc4nc(C)cc(C)c4c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P21	compound treatment	1.171	-0.0723	-0.98	1.4	0.0516	0.7	-0.1923	-0.1599	1910895	Bionet1_004559	CN1C(=O)N(C)C(=O)C(=Cc2ccc(OCc3cccc(Cl)c3)cc2)C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.581	P22	compound treatment	1.297	0.0537	0.72	1.336	-0.0124	-0.17	0.3926	0.5275	1486405	Bionet1_004560	COC(=O)C1CSC(N1C(=O)c2ccccc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A03	compound treatment	1.219	-0.0344	-0.46	1.322	-0.0334	-0.45	-0.6496	-1.0	1326034	Bionet1_004561	COC(=O)C1CSC(N1C(=O)c2ccc(OC)cc2)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A04	compound treatment	1.274	0.0206	0.28	1.358	0.00264	0.04	0.2222	0.7919	1231839	Bionet1_004562	Cc1ccccc1Cn2nc(c3ccccc3)c(cc2=O)N4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A05	compound treatment	1.216	-0.0374	-0.5	1.365	0.00964	0.13	-0.2636	-0.5059	1167778	Bionet1_004563	Cc1cc(C)c2c(n1)sc3c(nc(SCC=C)nc32)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A06	compound treatment	1.246	-0.00738	-0.1	1.357	0.00164	0.02	-0.0546	-0.5353	1594179	Bionet1_004564	O=C(ON1C(=O)C2C(C3c4ccccc4C2c5ccccc35)C1=O)C6CC6
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A07	compound treatment	1.222	-0.0314	-0.42	1.319	-0.0364	-0.5	-0.6499	-0.9969	1910896	Bionet1_004565	Cc1ccc(cc1)S(=O)(=O)CC(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A08	compound treatment	1.251	-0.00238	-0.03	1.398	0.0426	0.58	0.3885	0.6671	1910897	Bionet1_004566	Cc1ccc(cc1)C(=O)NNC(=O)C(=O)c2c([nH]c3ccccc23)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A09	compound treatment	1.178	-0.0754	-1.02	1.304	-0.0514	-0.7	-1.2143	-0.9834	1910898	Bionet1_004567	O=C(CS(=O)(=O)c1ccccc1)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A10	compound treatment	1.275	0.0216	0.29	1.348	-0.00736	-0.1	0.1353	0.4385	1910899	Bionet1_004568	Fc1ccc(CON2C(=O)C3C(C4c5ccccc5C3c6ccccc46)C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A11	compound treatment	1.254	6.24E-4	0.01	1.312	-0.0434	-0.59	-0.4122	-0.697	1910900	Bionet1_004569	COC(=O)c1ccccc1SCC(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A12	compound treatment	1.311	0.0576	0.78	1.353	-0.00236	-0.03	0.5269	0.6772	1514147	Bionet1_004570	C(Sc1nc(N2CCCC2)c3sc4ccccc4c3n1)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A13	compound treatment	1.21	-0.0434	-0.59	1.343	-0.0124	-0.17	-0.533	-0.8752	1675788	Bionet1_004571	Clc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A14	compound treatment	1.246	-0.00738	-0.1	1.366	0.0106	0.15	0.0322	0.183	1197433	Bionet1_004572	Cc1ccc(CSc2nc(NCC=C)c3sc4ccccc4c3n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A15	compound treatment	1.208	-0.0454	-0.61	1.378	0.0226	0.31	-0.2146	-0.313	1910901	Bionet1_004573	CSc1nc2ccccc2cc1/C=C(\C#N)/c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A16	compound treatment	1.226	-0.0274	-0.37	1.39	0.0346	0.47	0.0728	0.1215	1506850	Bionet1_004574	Cc1ccc(CSc2nc(NC3CC3)c4sc5ccccc5c4n2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A17	compound treatment	1.231	-0.0224	-0.3	1.392	0.0366	0.5	0.1398	0.2395	1910902	Bionet1_004575	CSc1nc2ccccc2cc1/C=C(\C#N)/c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A18	compound treatment	1.285	0.0316	0.43	1.359	0.00364	0.05	0.3367	0.784	1910903	Bionet1_004576	COC(=O)c1ccccc1Sc2nc(SC)nc3c4ccccc4sc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A19	compound treatment	1.24	-0.0134	-0.18	1.321	-0.0344	-0.47	-0.4589	-0.914	1910904	Bionet1_004577	CSc1nc2ccccc2cc1/C=C(\C#N)/c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A20	compound treatment	1.239	-0.0144	-0.19	1.322	-0.0334	-0.45	-0.4588	-0.9278	1910905	Bionet1_004578	CSc1nc(Sc2ccc(F)cc2)c3sc4ccccc4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A21	compound treatment	1.175	-0.0784	-1.06	1.333	-0.0224	-0.3	-0.9633	-0.8754	1910906	Bionet1_004579	COc1ccc(cc1OC)/C(=C/c2cc3ccccc3nc2SC)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	A22	compound treatment	1.232	-0.0214	-0.29	1.324	-0.0314	-0.43	-0.5063	-0.9816	1910907	Bionet1_004580	CSc1nc(Oc2ccc3ccccc3c2)c4sc5ccccc5c4n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B03	compound treatment	1.263	0.00962	0.13	1.35	-0.00536	-0.07	0.0401	0.269	1910908	Bionet1_004581	CCCc1c(C)nc2cc(nn2c1C)c3sccc3n4c(C)ccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B04	compound treatment	1.213	-0.0404	-0.54	1.365	0.00964	0.13	-0.2922	-0.5216	1237533	Bionet1_004582	Cc1cccc(c1)c2nc(SCc3cccc(F)c3)c(C#N)c4CCCCc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B05	compound treatment	1.273	0.0196	0.26	1.33	-0.0254	-0.35	-0.0574	-0.1317	1910909	Bionet1_004583	COCc1cc(O)n2nc(cc2n1)c3sccc3n4c(C)ccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B06	compound treatment	1.257	0.00362	0.05	1.367	0.0116	0.16	0.1468	0.884	1699363	Bionet1_004584	COC(=O)CSc1nc(c2cccc(C)c2)c3CCCCc3c1C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B07	compound treatment	1.273	0.0196	0.26	1.372	0.0166	0.23	0.3476	0.997	1910910	Bionet1_004585	COCCNC(=O)C1CCC(=O)N(C2CCCCC2)C1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B08	compound treatment	1.244	-0.00938	-0.13	1.371	0.0156	0.21	0.0613	0.2474	1910911	Bionet1_004586	COC(=O)C1CCN(CC1)C(=O)CC(NC(=O)C(F)(F)F)c2cccs2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B09	compound treatment	1.214	-0.0394	-0.53	1.346	-0.00936	-0.13	-0.4659	-0.8528	1311118	Bionet1_004587	CCOC(=O)NC(C1COc2ccccc2C1=O)c3cccc(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B10	compound treatment	1.231	-0.0224	-0.3	1.331	-0.0244	-0.33	-0.4484	-0.9989	1143750	Bionet1_004588	Cc1nc2c(cnn2c(N)c1c3ccc(F)cc3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B11	compound treatment	1.257	0.00362	0.05	1.36	0.00464	0.06	0.0793	0.9919	1910912	Bionet1_004589	Cc1ccc(C)n1c2ccsc2c3cc4nccc(c5ccc(F)cc5)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B12	compound treatment	1.224	-0.0294	-0.4	1.36	0.00464	0.06	-0.2355	-0.5869	1304964	Bionet1_004590	COc1ccc(cc1)c2cnn(c2N)c3nc(cs3)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B13	compound treatment	1.252	-0.00138	-0.02	1.378	0.0226	0.31	0.2051	0.6634	1910913	Bionet1_004591	COc1cc2NC(=S)N3C(CC4CCCCC4)C(=O)N=C3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B14	compound treatment	1.228	-0.0254	-0.34	1.308	-0.0474	-0.65	-0.6988	-0.9559	1910914	Bionet1_004592	COC(=O)C(/C=N/Nc1ncc(cc1Cl)C(F)(F)F)n2cncn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B15	compound treatment	1.274	0.0206	0.28	1.317	-0.0384	-0.52	-0.1732	-0.2923	1193808	Bionet1_004593	Fc1ccccc1N2CCN(CC2)C(=O)C3Cc4c(O3)ccc5ccccc45
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B16	compound treatment	1.201	-0.0524	-0.71	1.394	0.0386	0.53	-0.1271	-0.1442	1910915	Bionet1_004594	Cc1ccc(C)n1c2ccsc2c3cc4ncc(cn4n3)c5ccc(C)cc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B17	compound treatment	1.216	-0.0374	-0.5	1.321	-0.0344	-0.47	-0.6879	-0.9993	1910916	Bionet1_004595	FC(F)(F)c1cnc(CC(=O)Nc2cccnc2Cl)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B18	compound treatment	1.245	-0.00838	-0.11	1.305	-0.0504	-0.69	-0.5655	-0.8125	1910917	Bionet1_004596	FC(F)(F)c1cnc(CC(=O)Nc2cccc(Br)c2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B19	compound treatment	1.21	-0.0434	-0.59	1.375	0.0196	0.27	-0.2244	-0.3488	1910918	Bionet1_004597	[O-][N+](=O)c1ccc(C/2CCCC\C2=N/OC(=O)C3CCCC3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B20	compound treatment	1.243	-0.0104	-0.14	1.339	-0.0164	-0.22	-0.2568	-0.9748	1910919	Bionet1_004598	FC(F)(F)C(=O)C/C(=N\Nc1nc(cs1)c2ccccc2)/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B21	compound treatment	1.204	-0.0494	-0.67	1.395	0.0396	0.54	-0.0888	-0.1035	1910920	Bionet1_004599	[O-][N+](=O)c1ccc(C/2CCCC\C2=N/OC(=O)C3CCCCC3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	B22	compound treatment	1.22	-0.0334	-0.45	1.364	0.00864	0.12	-0.2351	-0.5052	1279709	Bionet1_004600	Cc1c(C)c(OCC(=O)c2ccc(Cl)cc2)ccc1Br
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C03	compound treatment	1.228	-0.0254	-0.34	1.305	-0.0504	-0.69	-0.7277	-0.9483	1577911	Bionet1_004601	Cc1cc(C)c2c(n1)sc3c(Oc4ccccc4)nc(SCC=C)nc32
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C04	compound treatment	1.276	0.0226	0.31	1.354	-0.00136	-0.02	0.2027	0.6628	1910921	Bionet1_004602	Cc1ccc(cc1)C(=O)NNC(=O)c2cc3cc4ccccc4nc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C05	compound treatment	1.245	-0.00838	-0.11	1.339	-0.0164	-0.22	-0.2377	-0.9503	1514812	Bionet1_004603	Cc1cccc(Oc2nc(SCC=C)nc3c2sc4nc(C)cc(C)c43)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C06	compound treatment	1.262	0.00862	0.12	1.328	-0.0274	-0.37	-0.1816	-0.4646	1910922	Bionet1_004604	Clc1cccc(c1)C(=O)NNC(=O)c2cc3cc4ccccc4nc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C07	compound treatment	1.268	0.0146	0.2	1.304	-0.0514	-0.7	-0.3558	-0.4889	1910923	Bionet1_004605	CCSc1nc(Sc2ccccc2)c3sc4nc(C)cc(C)c4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C08	compound treatment	1.297	0.0436	0.59	1.374	0.0186	0.25	0.5958	0.9295	1910924	Bionet1_004606	Cn1nc(c(/C=C(\C#N)/c2ccc(Cl)c(Cl)c2)c1Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C09	compound treatment	1.252	-0.00138	-0.02	1.34	-0.0154	-0.21	-0.1613	-0.7668	1910925	Bionet1_004607	Clc1cccc(Cl)c1CSc2nnc(/C=C/c3ccccc3)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C10	compound treatment	1.244	-0.00938	-0.13	1.37	0.0146	0.2	0.0517	0.2187	1910926	Bionet1_004608	Fc1ccc(cc1)C(=O)NNC(=O)c2cc3cc4ccccc4nc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C11	compound treatment	1.237	-0.0164	-0.22	1.41	0.0546	0.75	0.3706	0.4769	1910927	Bionet1_004609	COC(=O)c1ccc(CSc2nnc(/C=C/c3ccccc3)o2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C12	compound treatment	1.3	0.0466	0.63	1.36	0.00464	0.06	0.4895	0.7743	1910928	Bionet1_004610	Cc1cccc(c1)C(=O)NNC(=O)c2cc3cc4ccccc4nc3s2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C13	compound treatment	1.323	0.0696	0.94	1.379	0.0236	0.32	0.8921	0.8983	1910929	Bionet1_004611	CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C14	compound treatment	1.316	0.0626	0.84	1.395	0.0396	0.54	0.9796	0.9767	1910930	Bionet1_004612	COc1ccc(cc1OC)/C(=C/c2c(Cl)n(C)nc2C(F)(F)F)/C#N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C15	compound treatment	1.229	-0.0244	-0.33	1.329	-0.0264	-0.36	-0.4867	-0.999	1605754	Bionet1_004613	Cc1ccc(cc1)C(=O)Nc2ccc(N3CCN(CC3)c4ccccc4)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C16	compound treatment	1.25	-0.00338	-0.05	1.373	0.0176	0.24	0.1379	0.5632	1910931	Bionet1_004614	CC(C(=O)Nc1cc(C)cc(C)n1)n2c(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C17	compound treatment	1.2	-0.0534	-0.72	1.41	0.0546	0.75	0.0177	0.017	1477371	Bionet1_004615	Fc1ccc(cc1)C(=O)Nc2ccc(N3CCN(CC3)c4ccccc4)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C18	compound treatment	1.248	-0.00538	-0.07	1.392	0.0366	0.5	0.302	0.5982	1910932	Bionet1_004616	CC(C(=O)Nc1ccc(F)cc1F)n2c(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C19	compound treatment	1.2	-0.0534	-0.72	1.383	0.0276	0.38	-0.2427	-0.2986	1637918	Bionet1_004617	Cc1cccc(c1)C(=O)Nc2ccc(N3CCN(CC3)c4ccccc4)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C20	compound treatment	1.237	-0.0164	-0.22	1.334	-0.0214	-0.29	-0.3622	-0.9907	1550909	Bionet1_004618	CS(=O)(=O)N1CCN(CC1)c2ccc(NC(=O)c3cccs3)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C21	compound treatment	1.281	0.0276	0.37	1.382	0.0266	0.36	0.5204	0.9999	1480987	Bionet1_004619	Fc1cc(NC(=O)Cc2ccccc2)ccc1N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	C22	compound treatment	1.298	0.0446	0.6	1.392	0.0366	0.5	0.7789	0.9957	1476598	Bionet1_004620	Cc1ccc(cc1)C(=O)Nc2ccc(N3CCN(CC3)S(=O)(=O)C)c(F)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D03	compound treatment	1.231	-0.0224	-0.3	1.339	-0.0164	-0.22	-0.3712	-0.9889	1910933	Bionet1_004621	[O-][N+](=O)c1ccc(C/2CCCC\C2=N/OC(=O)c3ccco3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D04	compound treatment	1.23	-0.0234	-0.32	1.368	0.0126	0.17	-0.1011	-0.2815	1910934	Bionet1_004622	Fc1ccc(cc1)c2cnn3c(cc(nc23)c4cccc(Cl)c4)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D05	compound treatment	1.266	0.0126	0.17	1.395	0.0396	0.54	0.5026	0.8869	1910935	Bionet1_004623	COc1cccc(c1)c2onc3ccc(cc23)C(=O)/C=C/c4ccc(C)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D06	compound treatment	1.202	-0.0514	-0.69	1.338	-0.0174	-0.24	-0.6575	-0.8977	1910936	Bionet1_004624	Nc1c(cnn1c2nc(cs2)c3ccccc3F)c4ccc(Cl)cc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D07	compound treatment	1.284	0.0306	0.41	1.323	-0.0324	-0.44	-0.0199	-0.033	1910937	Bionet1_004625	CC(Oc1ccc(Cl)cc1Cl)c2ccnc3c(Cl)c(C)nn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D08	compound treatment	1.208	-0.0454	-0.61	1.342	-0.0134	-0.18	-0.5617	-0.8795	1558024	Bionet1_004626	O=C(NCc1ccccc1)c2ccccc2C(=O)c3ccc4OCC(=O)Nc4c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D09	compound treatment	1.241	-0.0124	-0.17	1.368	0.0126	0.17	0.0038	0.0158	1910938	Bionet1_004627	Cc1cc(C)n(n1)c2nc(c(Sc3ccc(Cl)cc3)s2)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D10	compound treatment	1.223	-0.0304	-0.41	1.346	-0.00936	-0.13	-0.3801	-0.8854	1910939	Bionet1_004628	Cc1ccccc1CSc2nc(c3CCCc3c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D11	compound treatment	1.236	-0.0174	-0.23	1.35	-0.00536	-0.07	-0.2175	-0.8856	1910940	Bionet1_004629	Cc1ccccc1C(=O)O/N=C/2\CCCCC2c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D12	compound treatment	1.262	0.00862	0.12	1.34	-0.0154	-0.21	-0.0659	-0.2749	1910941	Bionet1_004630	Fc1cccc(Cl)c1CSc2nc(c3CCCc3c2C#N)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D13	compound treatment	1.289	0.0356	0.48	1.337	-0.0184	-0.25	0.1628	0.3003	1910942	Bionet1_004631	[O-][N+](=O)c1ccc(C/2CCCC\C2=N/OC(=O)c3ccccc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D14	compound treatment	1.275	0.0216	0.29	1.284	-0.0714	-0.97	-0.4818	-0.4743	1910943	Bionet1_004632	Clc1cccc(CSc2nc(c3CCCc3c2C#N)c4ccccc4)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D15	compound treatment	1.213	-0.0404	-0.54	1.362	0.00664	0.09	-0.3212	-0.5817	1120862	Bionet1_004633	O=C(COc1cccc2c(OCC(=O)c3ccccc3)cccc12)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D16	compound treatment	1.259	0.00562	0.08	1.336	-0.0194	-0.26	-0.1331	-0.4843	1910944	Bionet1_004634	COC(=O)CC1COc2ccccc2N1C(=O)c3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D17	compound treatment	1.278	0.0246	0.33	1.339	-0.0164	-0.22	0.0771	0.1927	1374274	Bionet1_004635	CC(N1C(C(C)N(C)C1=O)c2ccccc2)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D18	compound treatment	1.27	0.0166	0.22	1.37	0.0146	0.2	0.2997	0.9983	1910945	Bionet1_004636	Cc1ccc(cc1)c2nc(SCc3cccc(C)c3)c(C#N)c4CCCCc24
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D19	compound treatment	1.27	0.0166	0.22	1.415	0.0596	0.81	0.7336	0.8696	1910946	Bionet1_004637	COC(=O)CC(NC(=O)c1ccccc1F)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D20	compound treatment	1.245	-0.00838	-0.11	1.355	-3.64E-4	0.0	-0.0834	-0.7374	1910947	Bionet1_004638	CC(C)(C)c1ccc(cc1)c2nc(SCc3ccccc3)c(C#N)c4CCCc42
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D21	compound treatment	1.25	-0.00338	-0.05	1.349	-0.00636	-0.09	-0.0936	-0.9547	1910948	Bionet1_004639	COC(=O)CC(NC(=O)c1ccco1)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	D22	compound treatment	1.191	-0.0624	-0.84	1.339	-0.0164	-0.22	-0.7528	-0.8647	1443206	Bionet1_004640	Cc1cc(C)cc(NC(=O)Cc2ccc(OC(=O)c3ccccc3C)cc2)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E03	compound treatment	1.223	-0.0304	-0.41	1.347	-0.00836	-0.11	-0.3704	-0.8708	1910949	Bionet1_004641	Fc1ccc(CSc2nnc(/C=C/c3ccccc3)n2CC=C)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E04	compound treatment	1.25	-0.00338	-0.05	1.361	0.00564	0.08	0.0221	0.2478	1207756	Bionet1_004642	CS(=O)(=O)N1CCN(CC1)c2ccccc2NC(=O)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E05	compound treatment	1.211	-0.0424	-0.57	1.337	-0.0184	-0.25	-0.5813	-0.9314	1910950	Bionet1_004643	CCn1c(SCc2cccc(c2)[N+](=O)[O-])nnc1/C=C/c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E06	compound treatment	1.259	0.00562	0.08	1.345	-0.0104	-0.14	-0.0463	-0.2885	1281345	Bionet1_004644	CS(=O)(=O)N1CCN(CC1)c2ccccc2NC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E07	compound treatment	1.228	-0.0254	-0.34	1.375	0.0196	0.27	-0.0527	-0.1213	1667059	Bionet1_004645	OC(COc1ccccc1C#N)CS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E08	compound treatment	1.29	0.0366	0.49	1.392	0.0366	0.5	0.7026	1.0	1418904	Bionet1_004646	Cc1cccc(c1)C(=O)Nc2ccccc2N3CCN(CC3)S(=O)(=O)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E09	compound treatment	1.28	0.0266	0.36	1.376	0.0206	0.28	0.453	0.9927	1306452	Bionet1_004647	OC(COc1ccc(F)cc1Cl)CS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E10	compound treatment	1.283	0.0296	0.4	1.374	0.0186	0.25	0.4623	0.9761	1180995	Bionet1_004648	CS(=O)(=O)N1CCN(CC1)c2ccccc2NC(=O)c3cccs3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E11	compound treatment	1.258	0.00462	0.06	1.371	0.0156	0.21	0.1949	0.8772	1729255	Bionet1_004649	OC(COc1ccc(C#N)cc1)CS(=O)(=O)c2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E12	compound treatment	1.249	-0.00438	-0.06	1.395	0.0396	0.54	0.3404	0.6261	1910951	Bionet1_004650	Clc1ccc(C(=O)c2cc3cc4ccccc4nc3s2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E13	compound treatment	1.248	-0.00538	-0.07	1.431	0.0756	1.03	0.678	0.6558	1522784	Bionet1_004651	Cc1ccc(cc1)S(=O)(=O)CC(O)COc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E14	compound treatment	1.248	-0.00538	-0.07	1.375	0.0196	0.27	0.1381	0.4976	1329072	Bionet1_004652	CN1CCN(CC1)c2ccc(NC(=O)CSc3ccc(Cl)cc3)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E15	compound treatment	1.304	0.0506	0.68	1.369	0.0136	0.19	0.6144	0.868	1400891	Bionet1_004653	Cc1ccc(c(C)c1)S(=O)(=O)CC(O)COc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E16	compound treatment	1.273	0.0196	0.26	1.341	-0.0144	-0.2	0.0487	0.1479	1273257	Bionet1_004654	COc1ccc(SCC(=O)Nc2ccc(N3CCN(C)CC3)c(F)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E17	compound treatment	1.27	0.0166	0.22	1.421	0.0656	0.9	0.7915	0.8578	1140815	Bionet1_004655	COc1ccccc1S(=O)(=O)CC(O)COc2ccc(F)cc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E18	compound treatment	1.27	0.0166	0.22	1.411	0.0556	0.76	0.695	0.8785	1719581	Bionet1_004656	CN1CCN(CC1)c2ccc(NC(=O)CSc3ccc(C)cc3C)cc2F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E19	compound treatment	1.272	0.0186	0.25	1.397	0.0416	0.57	0.5791	0.9328	1662007	Bionet1_004657	COc1ccccc1S(=O)(=O)CC(O)COc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E20	compound treatment	1.308	0.0546	0.74	1.385	0.0296	0.4	0.8068	0.96	1910952	Bionet1_004658	Cc1ccc(SCC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E21	compound treatment	1.293	0.0396	0.53	1.412	0.0566	0.77	0.9241	0.9838	1910953	Bionet1_004659	CC(=O)N1C(C)(C)CC(=NOC(=O)c2cccc(c2)C(F)(F)F)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	E22	compound treatment	1.288	0.0346	0.47	1.344	-0.0114	-0.15	0.2207	0.4485	1910954	Bionet1_004660	COc1ccccc1N2CCN(CC2)/C(=C/C(=O)Nc3ccccc3C)/C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F03	compound treatment	1.244	-0.00938	-0.13	1.337	-0.0184	-0.25	-0.2665	-0.95	1623599	Bionet1_004661	COC(=O)c1ccc(NS(=O)(=O)c2ccc(OC)cc2)cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F04	compound treatment	1.237	-0.0164	-0.22	1.327	-0.0284	-0.39	-0.4297	-0.9647	1910955	Bionet1_004662	COC(=O)/C(=C\Nc1ccc(OCc2ccccc2)cc1)/n3cncn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F05	compound treatment	1.253	-3.76E-4	-0.01	1.345	-0.0104	-0.14	-0.1035	-0.732	1910956	Bionet1_004663	Cc1ccc2SCC/C(=N\OC(=O)c3cccc(c3)C(F)(F)F)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F06	compound treatment	1.215	-0.0384	-0.52	1.327	-0.0284	-0.39	-0.6396	-0.9897	1910957	Bionet1_004664	Cc1cc(n(n1)c2nc(c(CC(=O)NN)s2)c3ccccc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F07	compound treatment	1.253	-3.76E-4	-0.01	1.333	-0.0224	-0.3	-0.2192	-0.7188	1649261	Bionet1_004665	Clc1ccc(cc1Cl)C(=O)Nc2cccc(Cl)c2N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F08	compound treatment	1.251	-0.00238	-0.03	1.376	0.0206	0.28	0.1763	0.6225	1910958	Bionet1_004666	Cc1cc2nc(cc(n2n1)C(F)(F)Cl)c3ccc(cc3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F09	compound treatment	1.221	-0.0324	-0.44	1.343	-0.0124	-0.17	-0.4281	-0.9143	1910959	Bionet1_004667	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cccc(Cl)c2N3CCCCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F10	compound treatment	1.214	-0.0394	-0.53	1.29	-0.0654	-0.89	-1.0059	-0.9694	1910960	Bionet1_004668	Cc1nn2c(cc(nc2c1Cl)c3ccc(cc3)C(F)(F)F)C(F)(F)Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F11	compound treatment	1.297	0.0436	0.59	1.336	-0.0194	-0.26	0.2294	0.3557	1910961	Bionet1_004669	FC(F)(F)c1cccc(OCc2nnc(S)n2c3ccccc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F12	compound treatment	1.277	0.0236	0.32	1.301	-0.0544	-0.74	-0.2988	-0.3703	1345982	Bionet1_004670	COC(=O)c1sccc1n2cc(nn2)C(=O)c3ccc(cc3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F13	compound treatment	1.299	0.0456	0.62	1.356	6.36E-4	0.01	0.4414	0.717	1910962	Bionet1_004671	CSc1nnc(COc2cccc(c2)C(F)(F)F)n1c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F14	compound treatment	1.205	-0.0484	-0.65	1.281	-0.0744	-1.01	-1.1785	-0.9773	1910963	Bionet1_004672	COC(=O)C/1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)\C1=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F15	compound treatment	1.264	0.0106	0.14	1.395	0.0396	0.54	0.4835	0.8647	1910964	Bionet1_004673	NC(=O)CSc1nnc(COc2cccc3ccccc23)n1c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F16	compound treatment	1.269	0.0156	0.21	1.329	-0.0264	-0.36	-0.1052	-0.2524	1319443	Bionet1_004674	Cc1ccc(C)n1c2ccsc2c3cc4nccc(c5cccnc5)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F17	compound treatment	1.305	0.0516	0.7	1.379	0.0236	0.32	0.7204	0.9387	1280661	Bionet1_004675	OC(COc1ccc(C#N)cc1)CN2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F18	compound treatment	1.269	0.0156	0.21	1.33	-0.0254	-0.35	-0.0955	-0.2358	1910965	Bionet1_004676	Cc1nn(c(C)c1Cl)c2nc(c(Cl)s2)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F19	compound treatment	1.19	-0.0634	-0.85	1.333	-0.0224	-0.3	-0.8202	-0.9036	1910966	Bionet1_004677	FC(F)(F)c1ccc(cc1)C(=O)Nc2ccc(nc2)N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F20	compound treatment	1.288	0.0346	0.47	1.355	-3.64E-4	0.0	0.3268	0.6996	1910967	Bionet1_004678	FC(F)(F)C1=NCCN(C=C1)S(=O)(=O)c2ccc3ccccc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F21	compound treatment	1.226	-0.0274	-0.37	1.37	0.0146	0.2	-0.12	-0.2859	1678897	Bionet1_004679	Cc1ccc2SCC(NC(=O)c3ccc(Cl)cc3Cl)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	F22	compound treatment	1.208	-0.0454	-0.61	1.336	-0.0194	-0.26	-0.6196	-0.9293	1910968	Bionet1_004680	CCC(CC)C(=O)c1c[nH]c(c1)C(=O)NCc2cccc(c2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G03	compound treatment	1.231	-0.0224	-0.3	1.336	-0.0194	-0.26	-0.4002	-0.9978	1910969	Bionet1_004681	CC(=O)N1C(C)(C)CC(=NOS(=O)(=O)c2ccccc2)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G04	compound treatment	1.276	0.0226	0.31	1.362	0.00664	0.09	0.2798	0.8789	1910970	Bionet1_004682	COC(=O)C(CSC1=NCCS1)NC(=O)OCc2ccccc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G05	compound treatment	1.23	-0.0234	-0.32	1.32	-0.0354	-0.48	-0.564	-0.9788	1910971	Bionet1_004683	COc1ccc(cc1)S(=O)(=O)ON=C2CC(C)(C)N(C(=O)C)C(C)(C)C2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G06	compound treatment	1.306	0.0526	0.71	1.369	0.0136	0.19	0.6335	0.8632	1307047	Bionet1_004684	Clc1ccc(COc2ccc(cc2)c3ccnc4ncnn34)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G07	compound treatment	1.215	-0.0384	-0.52	1.362	0.00664	0.09	-0.3021	-0.5748	1910972	Bionet1_004685	CC(=O)N1C(C)(C)CC(=NOS(=O)(=O)c2ccc(Cl)cc2)CC1(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G08	compound treatment	1.246	-0.00738	-0.1	1.348	-0.00736	-0.1	-0.1414	-1.0	1488121	Bionet1_004686	Cc1cc2nccc(c3ccc(OCc4ccc(Cl)cc4Cl)cc3)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G09	compound treatment	1.233	-0.0204	-0.27	1.32	-0.0354	-0.48	-0.5354	-0.9645	1186461	Bionet1_004687	OC(COc1ccccc1Cl)CS(=O)(=O)Cc2ccc(Cl)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G10	compound treatment	1.272	0.0186	0.25	1.377	0.0216	0.3	0.3863	0.9968	1497423	Bionet1_004688	O=C(COc1ccc(cc1)c2nccc(n2)c3cccs3)N4CCCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G11	compound treatment	1.251	-0.00238	-0.03	1.346	-0.00936	-0.13	-0.113	-0.858	1480218	Bionet1_004689	OC(COc1ccccc1Cl)CS(=O)(=O)Cc2ccccc2Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G12	compound treatment	1.311	0.0576	0.78	1.391	0.0356	0.49	0.8933	0.9744	1426075	Bionet1_004690	COc1ccc(NC(=O)C(CC(C)C)N2Cc3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G13	compound treatment	1.273	0.0196	0.26	1.373	0.0176	0.24	0.3573	0.9989	1567341	Bionet1_004691	Cc1ccc(SCC2(O)CCN(CC2)C(=O)c3ccc(Cl)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G14	compound treatment	1.31	0.0566	0.76	1.361	0.00564	0.08	0.5945	0.7743	1569471	Bionet1_004692	COc1cccc(c1)C(=O)Nc2ccc(I)cn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G15	compound treatment	1.309	0.0556	0.75	1.347	-0.00836	-0.11	0.45	0.5928	1556473	Bionet1_004693	COc1cccc(SCC2(O)CCN(CC2)C(=O)c3ccc(Cl)cc3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G16	compound treatment	1.274	0.0206	0.28	1.353	-0.00236	-0.03	0.1739	0.621	1315474	Bionet1_004694	COc1cccc(c1)C(=O)Nc2ncc(I)cc2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G17	compound treatment	1.228	-0.0254	-0.34	1.366	0.0106	0.15	-0.1395	-0.3752	1910973	Bionet1_004695	COC(=O)C/1=C(C)N(CCc2c[nH]c3ccccc23)C(=O)\C1=C/N(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G18	compound treatment	1.264	0.0106	0.14	1.361	0.00564	0.08	0.1557	0.9573	1910974	Bionet1_004696	Cc1ccc(NC(=O)C(Cc2ccccc2)N3CCS(=O)(=O)CC3)cc1C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G19	compound treatment	1.234	-0.0194	-0.26	1.351	-0.00436	-0.06	-0.2269	-0.8464	1910975	Bionet1_004697	FC(F)(F)c1cccc(c1)N2CCN(CC2)C3CCc4[nH]ccc4C3=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G20	compound treatment	1.28	0.0266	0.36	1.375	0.0196	0.27	0.4433	0.9895	1910976	Bionet1_004698	CCCCCC1CCC(CC1)c2ccc(NC(=O)c3ccc(cc3)[N+](=O)[O-])cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G21	compound treatment	1.258	0.00462	0.06	1.453	0.0976	1.33	0.9856	0.7394	1910977	Bionet1_004699	FC(F)(F)c1ccc(COc2ccc(cc2)c3ncc4C(=O)CCCc4n3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	G22	compound treatment	1.275	0.0216	0.29	1.419	0.0636	0.87	0.8199	0.8956	1268980	Bionet1_004700	O=C(COc1ccc(cc1)c2nccc(n2)c3ccccn3)NC4CCCCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H03	compound treatment	1.216	-0.0374	-0.5	1.344	-0.0114	-0.15	-0.4661	-0.8836	1910978	Bionet1_004701	COc1ccc(cc1)S(=O)(=O)O/N=C/2\CCSc3ccc(C)cc23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H04	compound treatment	1.179	-0.0744	-1.0	1.327	-0.0284	-0.39	-0.983	-0.9141	1910979	Bionet1_004702	COC(=O)c1sccc1n2nnc(C(=O)c3ccc(Cl)cc3Cl)c2C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H05	compound treatment	1.271	0.0176	0.24	1.36	0.00464	0.06	0.2128	0.8651	1910980	Bionet1_004703	Cc1ccc2SCC/C(=N\OS(=O)(=O)c3ccc(Cl)cc3)/c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H06	compound treatment	1.228	-0.0254	-0.34	1.327	-0.0284	-0.39	-0.5156	-0.9981	1910981	Bionet1_004704	CSc1nc2nc(C)c(Cc3cccc(c3)C(F)(F)F)c(C)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H07	compound treatment	1.276	0.0226	0.31	1.345	-0.0104	-0.14	0.1159	0.3445	1411497	Bionet1_004705	Cc1ccc2SCC(NC(=O)c3ccc(Cl)c(Cl)c3)C(=O)c2c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H08	compound treatment	1.267	0.0136	0.18	1.323	-0.0324	-0.44	-0.1821	-0.3809	1910982	Bionet1_004706	COC(=O)c1sccc1n2cc(nn2)C(=O)C(C)Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H09	compound treatment	1.276	0.0226	0.31	1.36	0.00464	0.06	0.2605	0.8358	1910983	Bionet1_004707	[O-][N+](=O)c1cccc(c1)C(=O)Nc2cc(Cl)ccc2N3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H10	compound treatment	1.286	0.0326	0.44	1.349	-0.00636	-0.09	0.2498	0.557	1613707	Bionet1_004708	O=C1CC(C(C(=O)C1C2NCCc3ccccc23)n4cncn4)c5ccco5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H11	compound treatment	1.244	-0.00938	-0.13	1.403	0.0476	0.65	0.3699	0.5589	1508254	Bionet1_004709	CN1CCN(CC1)c2ccc(Cl)cc2NC(=O)c3ccc(Cl)c(Cl)c3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H12	compound treatment	1.285	0.0316	0.43	1.388	0.0326	0.45	0.6164	0.9998	1910984	Bionet1_004710	Cc1ccc(C)n1c2ccsc2c3cc4nccc(n4n3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H13	compound treatment	1.229	-0.0244	-0.33	1.365	0.00964	0.13	-0.1396	-0.3942	1910985	Bionet1_004711	CN1CCN(CC1)c2ccc(Cl)cc2NC(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H14	compound treatment	1.242	-0.0114	-0.15	1.393	0.0376	0.51	0.2544	0.4749	1670767	Bionet1_004712	CCC(CC)C(=O)c1c[nH]c(c1)C(=O)N2CCN(CC2)c3ccc(OC)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H15	compound treatment	1.27	0.0166	0.22	1.407	0.0516	0.7	0.6565	0.8883	1181310	Bionet1_004713	CN1CCN(CC1)c2ccc(Cl)cc2NC(=O)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H16	compound treatment	1.228	-0.0254	-0.34	1.37	0.0146	0.2	-0.1009	-0.2547	1910986	Bionet1_004714	Cc1ccccc1C(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H17	compound treatment	1.267	0.0136	0.18	1.376	0.0206	0.28	0.3289	0.9787	1638690	Bionet1_004715	Clc1ccc(C(=O)Nc2cc(Cl)ccc2N3CCCCCC3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H18	compound treatment	1.284	0.0306	0.41	1.352	-0.00336	-0.05	0.2597	0.6248	1271631	Bionet1_004716	CCC(CC)C(=O)c1c[nH]c(c1)C(=O)N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H19	compound treatment	1.299	0.0456	0.62	1.379	0.0236	0.32	0.6631	0.9544	1910987	Bionet1_004717	CCn1c(COc2cccc(c2)C(F)(F)F)nnc1SCC(=O)N
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H20	compound treatment	1.24	-0.0134	-0.18	1.317	-0.0384	-0.52	-0.4975	-0.899	1910988	Bionet1_004718	Cc1ccccc1C(=O)c2c[nH]c(c2)C(=O)NCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H21	compound treatment	1.299	0.0456	0.62	1.39	0.0346	0.47	0.7692	0.9914	1692808	Bionet1_004719	OC(COc1ccc(C#N)cc1)CN2CCN(CC2)c3ccc(F)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	H22	compound treatment	1.225	-0.0284	-0.38	1.378	0.0226	0.31	-0.0524	-0.1066	1910989	Bionet1_004720	O=C(Cc1ccccc1)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I03	compound treatment	1.274	0.0206	0.28	1.412	0.0566	0.77	0.7428	0.9049	1407517	Bionet1_004721	Fc1cccc(Cl)c1COc2ccc(cc2)c3ccnc4ncnn34
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I04	compound treatment	1.236	-0.0174	-0.23	1.348	-0.00736	-0.1	-0.2368	-0.9284	1133771	Bionet1_004722	O=C(COc1ccc(cc1)c2nccc(n2)c3ccccn3)NCc4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I05	compound treatment	1.262	0.00862	0.12	1.362	0.00664	0.09	0.1463	0.9923	1349838	Bionet1_004723	O=C(COc1ccc(cc1)c2nccc(n2)c3cccs3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I06	compound treatment	1.287	0.0336	0.45	1.351	-0.00436	-0.06	0.2787	0.6091	1910990	Bionet1_004724	Fc1cc(Oc2ccccc2C=C3C(=O)NC(=O)NC3=O)ccc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I07	compound treatment	1.253	-3.76E-4	-0.01	1.343	-0.0124	-0.17	-0.1228	-0.7281	1910991	Bionet1_004725	Cc1ccc(NC(=O)Cc2ncc(cc2Cl)C(F)(F)F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I08	compound treatment	1.313	0.0596	0.8	1.393	0.0376	0.51	0.9317	0.9764	1910992	Bionet1_004726	ClC1=C(NC(=O)OCCCc2ccccc2)C(=O)c3ccccc3C1=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I09	compound treatment	1.235	-0.0184	-0.25	1.356	6.36E-4	0.01	-0.1692	-0.6819	1655921	Bionet1_004727	Cc1cccc(n1)n2cnc(c2)C(=O)Nc3ccc(cc3)N4CCOCC4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I10	compound treatment	1.257	0.00362	0.05	1.399	0.0436	0.6	0.4553	0.7626	1910993	Bionet1_004728	[O-][N+](=O)c1ccc(C/2CCCC\C2=N\OCc3ccccc3F)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I11	compound treatment	1.278	0.0246	0.33	1.376	0.0206	0.28	0.4339	0.9966	1288077	Bionet1_004729	Cc1cccc(n1)n2cnc(c2)C(=O)N3CCN(CC3)c4cccc(Cl)c4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I12	compound treatment	1.232	-0.0214	-0.29	1.364	0.00864	0.12	-0.1206	-0.3873	1910994	Bionet1_004730	[O-][N+](=O)c1ccc(C/2CCCC\C2=N\OCc3ccc(F)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I13	compound treatment	1.287	0.0336	0.45	1.324	-0.0314	-0.43	0.0183	0.0294	1910995	Bionet1_004731	FC(F)(F)c1nc2cc(Cl)c(Cl)cc2nc1Oc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I14	compound treatment	1.272	0.0186	0.25	1.332	-0.0234	-0.32	-0.0476	-0.1174	1910996	Bionet1_004732	[O-][N+](=O)c1cc(cc([N+](=O)[O-])c1NCCN2CCNCC2)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I15	compound treatment	1.254	6.24E-4	0.01	1.393	0.0376	0.51	0.3689	0.7186	1910997	Bionet1_004733	Cc1ccc(C)n1c2ccsc2c3cc4nccc(c5ccccc5)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I16	compound treatment	1.308	0.0546	0.74	1.409	0.0536	0.73	1.0383	1.0	1910998	Bionet1_004734	[O-][N+](=O)c1ccc(COC(=O)NC2=C(Cl)C(=O)c3ccccc3C2=O)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I17	compound treatment	1.221	-0.0324	-0.44	1.384	0.0286	0.39	-0.0327	-0.0559	1910999	Bionet1_004735	COCc1cc(O)n2nc(cc2n1)c3ccsc3n4c(C)ccc4C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I18	compound treatment	1.297	0.0436	0.59	1.279	-0.0764	-1.04	-0.3202	-0.2677	1911000	Bionet1_004736	CC(=O)N1CCC(CC1)C(=O)NNc2ncc(cc2Cl)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I19	compound treatment	1.239	-0.0144	-0.19	1.455	0.0996	1.36	0.8236	0.6001	1911001	Bionet1_004737	CC(=O)C1=C(C)NC(=C(C1c2ccc(F)cc2)C(=O)OCc3ccccc3)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I20	compound treatment	1.318	0.0646	0.87	1.433	0.0776	1.06	1.3651	0.9953	1911002	Bionet1_004738	Fc1ccc(C/N=C/c2ccn(c2)c3ccc(Br)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I21	compound treatment	1.27	0.0166	0.22	1.436	0.0806	1.1	0.9361	0.8342	1911003	Bionet1_004739	Fc1ccc(OC(=O)/C=C/c2cc3OCOc3cc2Br)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	I22	compound treatment	1.294	0.0406	0.55	1.411	0.0556	0.76	0.924	0.9873	1911004	Bionet1_004740	Clc1ccc(/N=C/c2ccn(c2)c3ccc(Br)cc3)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J03	compound treatment	1.248	-0.00538	-0.07	1.374	0.0186	0.25	0.1284	0.4859	1911005	Bionet1_004741	CO/N=C/c1ccc(N2CCN(CC2)C(=O)c3ccc(F)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J04	compound treatment	1.226	-0.0274	-0.37	1.349	-0.00636	-0.09	-0.3225	-0.8501	1651261	Bionet1_004742	Cc1ccccc1C(=O)c2c[nH]c(c2)C(=O)N3CCN(CC3)c4ccccc4F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J05	compound treatment	1.223	-0.0304	-0.41	1.373	0.0176	0.24	-0.1197	-0.2519	1911006	Bionet1_004743	CO/N=C/c1ccc(N2CCN(CC2)C(=O)c3ccc(C)cc3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J06	compound treatment	1.235	-0.0184	-0.25	1.308	-0.0474	-0.65	-0.632	-0.9135	1298358	Bionet1_004744	CCn1cc(n(Cc2ccccc2C)c1=O)S(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J07	compound treatment	1.255	0.00162	0.02	1.325	-0.0304	-0.41	-0.2773	-0.6688	1911007	Bionet1_004745	CO/N=C/c1ccc(N2CCN(CC2)C(=O)c3cccs3)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J08	compound treatment	1.235	-0.0184	-0.25	1.322	-0.0334	-0.45	-0.497	-0.9592	1476365	Bionet1_004746	Fc1ccc(cc1)N2CCN(Cc3cnc(s3)N4CCOCC4)CC2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J09	compound treatment	1.254	6.24E-4	0.01	1.326	-0.0294	-0.4	-0.2772	-0.6921	1911008	Bionet1_004747	Clc1ccc(c(Cl)c1)S(=O)(=O)Nc2ccc(cc2)n3cccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J10	compound treatment	1.215	-0.0384	-0.52	1.317	-0.0384	-0.52	-0.736	-1.0	1911009	Bionet1_004748	FC(F)(F)c1cccc(NC(=O)Nc2nccc(n2)c3cccs3)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J11	compound treatment	1.271	0.0176	0.24	1.374	0.0186	0.25	0.3478	0.9994	1911010	Bionet1_004749	FC(F)(F)c1c(cnn1c2ccccc2)C(=O)N3CCN(CC3)c4ccccc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J12	compound treatment	1.258	0.00462	0.06	1.295	-0.0604	-0.82	-0.5379	-0.6517	1911011	Bionet1_004750	Cc1cc(n(n1)c2nc(cs2)c3ccc(cc3)[N+](=O)[O-])C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J13	compound treatment	1.272	0.0186	0.25	1.386	0.0306	0.42	0.4731	0.9704	1911012	Bionet1_004751	COc1ccc(NC(=O)c2cnn(c2C(F)(F)F)c3ccccc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J14	compound treatment	1.278	0.0246	0.33	1.329	-0.0264	-0.36	-0.0193	-0.0395	1372053	Bionet1_004752	CCOC(=O)c1cnc(SC)nc1Oc2cccc(NS(=O)(=O)C)c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J15	compound treatment	1.249	-0.00438	-0.06	1.372	0.0166	0.23	0.1187	0.5062	1911013	Bionet1_004753	CO/N=C\c1ccc(Sc2c(Cl)cccc2Cl)c(c1)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J16	compound treatment	1.257	0.00362	0.05	1.325	-0.0304	-0.41	-0.2582	-0.6193	1911014	Bionet1_004754	CC(OC(=O)Nc1ccccc1)c2sc(nc2C)c3ccc(Cl)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J17	compound treatment	1.28	0.0266	0.36	1.364	0.00864	0.12	0.3372	0.8922	1911015	Bionet1_004755	CO/N=C/c1cc(ccc1Sc2c(Cl)cccc2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J18	compound treatment	1.195	-0.0584	-0.79	1.343	-0.0124	-0.17	-0.6761	-0.8395	1190390	Bionet1_004756	CCSc1nc(Oc2ccc(C)cc2)c3sc4nc(C)cc(C)c4c3n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J19	compound treatment	1.317	0.0636	0.86	1.37	0.0146	0.2	0.7481	0.8489	1911016	Bionet1_004757	CO/N=C/c1cc(ccc1Sc2cccc(Cl)c2Cl)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J20	compound treatment	1.249	-0.00438	-0.06	1.328	-0.0274	-0.37	-0.3056	-0.8089	1911017	Bionet1_004758	Clc1ccc(CSc2nc3ccccc3cc2/C=N/OC(=O)C4CC4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J21	compound treatment	1.285	0.0316	0.43	1.456	0.101	1.37	1.272	0.8851	1637414	Bionet1_004759	Cc1ccc(C)n1c2ccccc2CNS(=O)(=O)Cc3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	J22	compound treatment	1.223	-0.0304	-0.41	1.35	-0.00536	-0.07	-0.3415	-0.8203	1911018	Bionet1_004760	Fc1ccc(CNC(=O)c2cc(c[nH]2)C(=O)c3cccc(c3)C(F)(F)F)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K03	compound treatment	1.24	-0.0134	-0.18	1.346	-0.00936	-0.13	-0.2179	-0.9857	1911019	Bionet1_004761	Fc1ccc(OC(=O)/C=C/c2cc3OCOc3cc2Br)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K04	compound treatment	1.256	0.00262	0.04	1.362	0.00664	0.09	0.089	0.9161	1911020	Bionet1_004762	CCc1ccc(CSC2=Nc3cc(OC)c(OC)cc3C4=NC(=O)CN42)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K05	compound treatment	1.239	-0.0144	-0.19	1.373	0.0176	0.24	0.0329	0.1065	1911021	Bionet1_004763	Fc1cccc(OC(=O)/C=C/c2cc3OCOc3cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K06	compound treatment	1.255	0.00162	0.02	1.368	0.0126	0.17	0.1373	0.7906	1911022	Bionet1_004764	COc1cc2N=C(SCc3ccccc3F)N4CC(=O)N=C4c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K07	compound treatment	1.253	-3.76E-4	-0.01	1.378	0.0226	0.31	0.2147	0.6954	1911023	Bionet1_004765	Clc1ccc(NC(=O)NNC(=O)C2CC(=NO2)c3cccs3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K08	compound treatment	1.286	0.0326	0.44	1.37	0.0146	0.2	0.4523	0.936	1911024	Bionet1_004766	COc1cc2N=C(SCCC(=C(F)F)F)N3CC(=O)N=C3c2cc1OC
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K09	compound treatment	1.277	0.0236	0.32	1.338	-0.0174	-0.24	0.0579	0.1459	1911025	Bionet1_004767	Clc1cccc(OC(=O)/C=C/c2cc3OCOc3cc2Br)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K10	compound treatment	1.276	0.0226	0.31	1.385	0.0296	0.4	0.5016	0.9904	1341233	Bionet1_004768	O=C(C1CCC(=O)N(C2CCCCC2)C1c3ccccc3)n4ccnc4
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K11	compound treatment	1.282	0.0286	0.39	1.388	0.0326	0.45	0.5877	0.9975	1676386	Bionet1_004769	COc1ccc(CNC(=O)c2c(C)onc2c3ccccc3Cl)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K12	compound treatment	1.322	0.0686	0.93	1.357	0.00164	0.02	0.6704	0.7239	1458254	Bionet1_004770	Cc1cc2nccc(c3ccccc3OCc4ccc(Cl)cc4)n2n1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K13	compound treatment	1.207	-0.0464	-0.63	1.346	-0.00936	-0.13	-0.5327	-0.8342	1911026	Bionet1_004771	FC(F)(F)C1=NCCN(C=C1)S(=O)(=O)c2ccc(Br)cc2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K14	compound treatment	1.32	0.0666	0.9	1.378	0.0226	0.31	0.8538	0.8984	1125401	Bionet1_004772	Clc1ccc(COc2ccccc2c3ccn(n3)C(=O)c4cccs4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K15	compound treatment	1.247	-0.00638	-0.09	1.387	0.0316	0.43	0.2442	0.5552	1911027	Bionet1_004773	Clc1cccc(c1)C(=O)NNC(=O)c2cc3c(ccc4ccccc34)o2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K16	compound treatment	1.319	0.0656	0.89	1.371	0.0156	0.21	0.7768	0.853	1440171	Bionet1_004774	Clc1ccc(COc2ccccc2c3ccnc4c(C#N)cnn34)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K17	compound treatment	1.268	0.0146	0.2	1.384	0.0286	0.39	0.4156	0.95	1911028	Bionet1_004775	COc1ccc(CNc2ccc(cc2[N+](=O)[O-])C(F)(F)F)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K18	compound treatment	1.282	0.0286	0.39	1.352	-0.00336	-0.05	0.2406	0.6188	1191209	Bionet1_004776	Cc1ccc(Cn2ccc(n2)c3ccccc3OCc4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K19	compound treatment	1.236	-0.0174	-0.23	1.387	0.0316	0.43	0.1393	0.2837	1394166	Bionet1_004777	Clc1ccc(cc1Cl)S(=O)(=O)Nc2ccc3nccnc3c2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K20	compound treatment	1.295	0.0416	0.56	1.405	0.0496	0.68	0.8757	0.9957	1265290	Bionet1_004778	Fc1ccc(Cn2ccc(n2)c3ccccc3OCc4ccc(Cl)cc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K21	compound treatment	1.289	0.0356	0.48	1.405	0.0496	0.68	0.8184	0.9859	1911029	Bionet1_004779	COC(=O)CC(NC(=O)Nc1ccc(C)cc1)c2cccc(c2)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	K22	compound treatment	1.31	0.0566	0.76	1.424	0.0686	0.94	1.202	0.9949	1472238	Bionet1_004780	Clc1ccc(COc2ccccc2c3ccnc(n3)c4ccncc4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L03	compound treatment	1.281	0.0276	0.37	1.347	-0.00836	-0.11	0.1829	0.4692	1204451	Bionet1_004781	Cc1ccc(C)n1c2ccccc2CNS(=O)(=O)c3ccc(C)cc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L04	compound treatment	1.243	-0.0104	-0.14	1.324	-0.0314	-0.43	-0.4014	-0.892	1911030	Bionet1_004782	FC(F)(F)c1cccc(c1)C(=O)c2c[nH]c(c2)C(=O)NCC3CCCO3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L05	compound treatment	1.247	-0.00638	-0.09	1.32	-0.0354	-0.48	-0.4018	-0.8203	1911031	Bionet1_004783	Fc1ccc(NC(=O)c2cnn(c2C(F)(F)F)c3ccccc3)c(F)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L06	compound treatment	1.244	-0.00938	-0.13	1.324	-0.0314	-0.43	-0.3919	-0.8786	1911032	Bionet1_004784	FC(F)(F)c1cccc(c1)C(=O)c2c[nH]c(c2)C(=O)NCCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L07	compound treatment	1.253	-3.76E-4	-0.01	1.325	-0.0304	-0.41	-0.2964	-0.7157	1183297	Bionet1_004785	Clc1ccc(CSc2nnc3c4ccccc4[nH]c3n2)cc1Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L08	compound treatment	1.188	-0.0654	-0.88	1.283	-0.0724	-0.99	-1.3214	-0.9984	1118867	Bionet1_004786	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L09	compound treatment	1.31	0.0566	0.76	1.367	0.0116	0.16	0.6524	0.8361	1911033	Bionet1_004787	Clc1ccc(cc1)c2nc3sc4CCCCc4n3c2/C=N/OC(=O)C5CC5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L10	compound treatment	1.276	0.0226	0.31	1.325	-0.0304	-0.41	-0.077	-0.1496	1123564	Bionet1_004788	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCc3ccccn3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L11	compound treatment	1.259	0.00562	0.08	1.392	0.0366	0.5	0.4069	0.8053	1670271	Bionet1_004789	Clc1cccc(Cl)c1Cn2nc-3c(CCc4ccccc43)cc2=O
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L12	compound treatment	1.214	-0.0394	-0.53	1.354	-0.00136	-0.02	-0.3888	-0.7314	1911034	Bionet1_004790	FC(F)(F)c1cccc(c1)C(=O)c2c[nH]c(c2)C(=O)NCc3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L13	compound treatment	1.227	-0.0264	-0.36	1.384	0.0286	0.39	0.0245	0.0464	1911035	Bionet1_004791	Clc1ccc(/C=C/c2nnc(SCc3ccccc3)o2)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L14	compound treatment	1.28	0.0266	0.36	1.315	-0.0404	-0.55	-0.1352	-0.2058	1911036	Bionet1_004792	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCn3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L15	compound treatment	1.214	-0.0394	-0.53	1.356	6.36E-4	0.01	-0.3695	-0.6955	1911037	Bionet1_004793	CO/N=C(\CSc1ccc(Cl)cc1)/c2c(C)nc3cc(C)ccn23
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L16	compound treatment	1.25	-0.00338	-0.05	1.329	-0.0264	-0.36	-0.2864	-0.7904	1911038	Bionet1_004794	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L17	compound treatment	1.28	0.0266	0.36	1.332	-0.0234	-0.32	0.0287	0.0598	1911039	Bionet1_004795	Clc1cccc(Cl)c1CSc2cc3CCc4ccccc4-c3nn2
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L18	compound treatment	1.184	-0.0694	-0.94	1.336	-0.0194	-0.26	-0.8485	-0.8725	1911040	Bionet1_004796	Fc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCN3CCOCC3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L19	compound treatment	1.276	0.0226	0.31	1.358	0.00264	0.04	0.2412	0.785	1911041	Bionet1_004797	FC(F)(F)c1nnc(nc1Sc2ccc(Cl)cc2)c3ccccc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L20	compound treatment	1.249	-0.00438	-0.06	1.308	-0.0474	-0.65	-0.4984	-0.7685	1256599	Bionet1_004798	COc1ccc(CNC(=O)c2cc(c[nH]2)C(=O)c3ccc(F)cc3)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L21	compound treatment	1.224	-0.0294	-0.4	1.363	0.00764	0.1	-0.2066	-0.5042	1911042	Bionet1_004799	COC(=O)c1ccccc1NC(=O)Cn2c(nc3ccccc23)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	L22	compound treatment	1.213	-0.0404	-0.54	1.333	-0.0224	-0.3	-0.6008	-0.9624	1911043	Bionet1_004800	CN(C)CCCNC(=O)c1cc(c[nH]1)C(=O)c2ccc(cc2)C(C)(C)C
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M03	compound treatment	1.265	0.0116	0.16	1.373	0.0176	0.24	0.2809	0.9785	1911044	Bionet1_004801	Fc1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCc3cccc(c3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M04	compound treatment	1.295	0.0416	0.56	1.407	0.0516	0.7	0.895	0.9937	1142783	Bionet1_004802	Clc1ccc(COc2ccccc2c3ccnc(n3)c4ccccn4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M05	compound treatment	1.255	0.00162	0.02	1.355	-3.64E-4	0.0	0.012	0.5335	1911045	Bionet1_004803	Cc1ccc(C)n1c2sccc2c3cc4nc(C)c(Cl)c(C)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M06	compound treatment	1.311	0.0576	0.78	1.324	-0.0314	-0.43	0.2473	0.2787	1911046	Bionet1_004804	FC(F)(F)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCn3ccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M07	compound treatment	1.242	-0.0114	-0.15	1.341	-0.0144	-0.2	-0.247	-0.9927	1911047	Bionet1_004805	CCOC(=O)CC1COc2ccccc2N1C(=O)c3cccc(c3)[N+](=O)[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M08	compound treatment	1.33	0.0766	1.03	1.351	-0.00436	-0.06	0.6889	0.6653	1487961	Bionet1_004806	Clc1ccc(C(=O)c2c[nH]c(c2)C(=O)NCCc3ccccc3)c(Cl)c1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M09	compound treatment	1.22	-0.0334	-0.45	1.31	-0.0454	-0.62	-0.7558	-0.9878	1911048	Bionet1_004807	COC(=O)C1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)C1/C=[N+](\C)/[O-]
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M10	compound treatment	1.283	0.0296	0.4	1.348	-0.00736	-0.1	0.2116	0.5135	1911049	Bionet1_004808	Fc1ccc(COc2ccccc2c3ccn(n3)C(=O)c4ccco4)cc1
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M11	compound treatment	1.237	-0.0164	-0.22	1.349	-0.00636	-0.09	-0.2176	-0.9167	1911050	Bionet1_004809	Cc1nn2c(cc(nc2c1Br)c3cccs3)C(F)(F)F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M12	compound treatment	1.394	0.141	1.9	1.377	0.0216	0.3	1.5501	0.8074	1186956	Bionet1_004810	Cc1ccc(C)n1c2ccsc2c3cc4nc(C)c(Cl)c(C)n4n3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M13	compound treatment	1.281	0.0276	0.37	1.391	0.0356	0.49	0.6071	0.9914	1563971	Bionet1_004811	Cc1ccc(C)n1c2ccsc2c3cc4nc(cc(O)n4n3)c5ccccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M14	compound treatment	1.316	0.0626	0.84	1.384	0.0286	0.39	0.8735	0.9385	1468464	Bionet1_004812	Cc1nc2cc(nn2c(O)c1Cc3ccccc3)c4sccc4n5cccc5
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M15	compound treatment	1.348	0.0946	1.28	1.346	-0.00936	-0.13	0.8124	0.6332	1911051	Bionet1_004813	Cc1nn2c(ccnc2c1Br)c3ccc(Cl)cc3Cl
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M16	compound treatment	1.232	-0.0214	-0.29	1.329	-0.0264	-0.36	-0.4581	-0.994	1291201	Bionet1_004814	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2ccnc(n2)c3cccnc3
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M17	compound treatment	1.206	-0.0474	-0.64	1.363	0.00764	0.1	-0.3783	-0.5842	1911052	Bionet1_004815	[O-][N+](=O)c1ccc(Cl)cc1C(=O)N2CCN(CC2)c3ccccc3F
228.0124	raw{Abs()}(228.0124)	PseudomonasCellWallSynthesis	228.0124.582	M18	compound treatment	1.321	0.0676	0.91	1.393	0.0376	0.51	1.008	0.963	1437790	Bionet1_004816	CCOc1ccc(Oc2nc3ccccc3nc2Cc4ccccc4)cc1
228.0124	raw{Abs()}(228.