smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(NC(=O)[C@H]2CCCN(C)C2)cc1S(=O)(=O)N1CCCCC1	ZINC000216911429	570309149	/nfs/dbraw/zinc/30/91/49/570309149.db2.gz	UVHWQHLKTLAQHJ-HNNXBMFYSA-N	0	3	395.525	2.150	40	70		GEIBHN
Cc1ccc(C(=O)NC2CCN(C)CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000216942768	570309991	/nfs/dbraw/zinc/30/99/91/570309991.db2.gz	CQBPQJFJBIAGTA-UHFFFAOYSA-N	0	3	393.553	2.384	40	70		GEIBHN
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@@H]1CCCN(C)C1	ZINC000216911555	570309201	/nfs/dbraw/zinc/30/92/01/570309201.db2.gz	LTZFJVMCQZKGPH-OAHLLOKOSA-N	0	3	395.525	2.150	40	70		GEIBHN
COc1ccc(NC(=O)[C@@H]2CCCN(C)C2)cc1S(=O)(=O)N1CCCCC1	ZINC000216911400	570309092	/nfs/dbraw/zinc/30/90/92/570309092.db2.gz	UVHWQHLKTLAQHJ-OAHLLOKOSA-N	0	3	395.525	2.150	40	70		GEIBHN
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@H]1CCCN(C)C1	ZINC000216911584	570309008	/nfs/dbraw/zinc/30/90/08/570309008.db2.gz	LTZFJVMCQZKGPH-HNNXBMFYSA-N	0	3	395.525	2.150	40	70		GEIBHN
Cc1ccc(NC(=O)CC2CCN(C)CC2)cc1S(=O)(=O)N1CCCC1	ZINC000216900931	570308967	/nfs/dbraw/zinc/30/89/67/570308967.db2.gz	BCHALLWUPGJZHN-UHFFFAOYSA-N	0	3	379.526	2.450	40	70		GEIBHN
COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)CC1CCN(C)CC1	ZINC000216902530	570309160	/nfs/dbraw/zinc/30/91/60/570309160.db2.gz	BAEDIIUSWQJIGR-UHFFFAOYSA-N	0	3	395.525	2.150	40	70		GEIBHN
CN(c1ccccc1C(=O)NC1CCN(C)CC1)S(=O)(=O)c1ccccc1	ZINC000216938823	570309894	/nfs/dbraw/zinc/30/98/94/570309894.db2.gz	OCVXOKKAZNYCEC-UHFFFAOYSA-N	0	3	387.505	2.336	40	70		GEIBHN
O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cc2cc(=O)n3cc(Cl)ccc3n2)C1	ZINC000217563226	570318058	/nfs/dbraw/zinc/31/80/58/570318058.db2.gz	NCIJXIRMWSDSKD-UONOGXRCSA-N	0	3	382.851	2.129	40	70		GEIBHN
COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)CC1CCN(C)CC1	ZINC000216902580	570308906	/nfs/dbraw/zinc/30/89/06/570308906.db2.gz	IQDYVCQJIMCWLR-UHFFFAOYSA-N	0	3	383.514	2.052	40	70		GEIBHN
CCc1ccc(OCC(=O)NCCCN2CCN(C)CC2)c(Br)c1	ZINC000217009738	570311250	/nfs/dbraw/zinc/31/12/50/570311250.db2.gz	QVTREBHLXSPFDT-UHFFFAOYSA-N	0	3	398.345	2.144	40	70		GEIBHN
CN1CCC(NC(=O)CN(C2CCCCC2)S(=O)(=O)c2ccccc2)CC1	ZINC000216797348	570307217	/nfs/dbraw/zinc/30/72/17/570307217.db2.gz	ZJKLITSTBMMRPB-UHFFFAOYSA-N	0	3	393.553	2.220	40	70		GEIBHN