smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]1CCC(Oc2ccc(NC(=O)CSCc3c(Cl)cccc3Cl)cc2)CC1	ZINC000216930940	557162328	/nfs/dbraw/zinc/16/23/28/557162328.db2.gz	YXNVVEURHGWWQB-UHFFFAOYSA-N	1	0	439.408	5.338	40	70		IKIBRO
CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(OC2CC[NH+](C)CC2)cc1	ZINC000217028908	557167127	/nfs/dbraw/zinc/16/71/27/557167127.db2.gz	MOSVJBAYHRSTMR-QFIPXVFZSA-N	1	0	433.017	5.000	40	70		IKIBRO
CC(C)n1cc(CC(=O)N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@@H]45)[C@H]32)c2ccccc21	ZINC000217946425	557175197	/nfs/dbraw/zinc/17/51/97/557175197.db2.gz	HRHOVZHGSNEKQV-JWVZEJEHSA-N	1	0	431.624	5.186	40	70		IKIBRO
C[NH+]1CCC(Oc2ccc(NC(=O)c3ccc(CSc4ccccc4)cc3)cc2)CC1	ZINC000218004223	557175375	/nfs/dbraw/zinc/17/53/75/557175375.db2.gz	QBCXMIZDUSMIBV-UHFFFAOYSA-N	1	0	432.589	5.704	40	70		IKIBRO
CC(C)c1ccc(CCCNC(=O)c2ccc(C[N@@H+]3CCc4ccccc4C3)cc2)cc1	ZINC000218078880	557176717	/nfs/dbraw/zinc/17/67/17/557176717.db2.gz	CZEUZHQWBFENOK-UHFFFAOYSA-N	1	0	426.604	5.731	40	70		IKIBRO
C[NH+]1CCC(Oc2ccc(NC(=O)c3ccccc3SCc3ccccc3)cc2)CC1	ZINC000218610291	557210079	/nfs/dbraw/zinc/21/00/79/557210079.db2.gz	BGGPNWOIUCSTKB-UHFFFAOYSA-N	1	0	432.589	5.704	40	70		IKIBRO
CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(OC2CC[NH+](C)CC2)cc1	ZINC000217028871	557167336	/nfs/dbraw/zinc/16/73/36/557167336.db2.gz	MOSVJBAYHRSTMR-JOCHJYFZSA-N	1	0	433.017	5.000	40	70		IKIBRO
Cc1ccc(SCc2ccc(C(=O)Nc3ccc(N4CC[NH+](C)CC4)cc3)cc2)cc1	ZINC000218212590	557182520	/nfs/dbraw/zinc/18/25/20/557182520.db2.gz	PICAETDMPWNKKJ-UHFFFAOYSA-N	1	0	431.605	5.291	40	70		IKIBRO
CC(C)n1cc(CC(=O)N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@@H]45)[C@@H]32)c2ccccc21	ZINC000217946501	557175133	/nfs/dbraw/zinc/17/51/33/557175133.db2.gz	HRHOVZHGSNEKQV-XMQYJYNESA-N	1	0	431.624	5.186	40	70		IKIBRO
Cc1ccc(SCc2ccc(C(=O)Nc3ccc(OC4CC[NH+](C)CC4)cc3)cc2)cc1	ZINC000218212679	557182536	/nfs/dbraw/zinc/18/25/36/557182536.db2.gz	DWIFSDUVLLGCDW-UHFFFAOYSA-N	1	0	446.616	6.013	40	70		IKIBRO