smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(c1cc(Cl)c(Cl)n1-c1c(Cl)c(Cl)[nH]c1C(=O)c1ccc(OS(=O)(=O)C(F)(F)F)cc1O)c1ccccc1O	ZINC000299860442	562892951	/nfs/dbraw/zinc/89/29/51/562892951.db2.gz	GQRFAQYFZLJLHW-UHFFFAOYSA-N	0	2	658.221	6.521	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2cc(F)cc3scnc32)cc1)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217613973	562877616	/nfs/dbraw/zinc/87/76/16/562877616.db2.gz	DHTGICJLUKRUTH-UHFFFAOYSA-N	0	2	546.045	5.013	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc32)c2ccccc12)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217634116	562877632	/nfs/dbraw/zinc/87/76/32/562877632.db2.gz	SRMNIIIDLJFFTM-UHFFFAOYSA-N	0	2	572.086	5.966	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c3scnc32)cc1)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217624939	562877640	/nfs/dbraw/zinc/87/76/40/562877640.db2.gz	RHLGUWKUKCYLIF-UHFFFAOYSA-N	0	2	546.045	5.013	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc32)c(OC(F)F)c1)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217762708	562877736	/nfs/dbraw/zinc/87/77/36/562877736.db2.gz	AFHUCXFHWDETHB-UHFFFAOYSA-N	0	2	588.032	5.414	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc32)cc1OC(F)F)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217626078	562877655	/nfs/dbraw/zinc/87/76/55/562877655.db2.gz	VMUCWWDHVOQUAX-UHFFFAOYSA-N	0	2	588.032	5.414	1	70		KKIFLN
O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc32)cc1OC(F)(F)F)N1CCC(O)(c2ccccc2Cl)CC1	ZINC000217628150	562877636	/nfs/dbraw/zinc/87/76/36/562877636.db2.gz	BFSCUKOYZWXUEV-UHFFFAOYSA-N	0	2	606.022	5.711	1	70		KKIFLN
CC(F)(F)CCC1(O)CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4scnc43)cc2OC(F)F)CC1	ZINC000217749811	562877723	/nfs/dbraw/zinc/87/77/23/562877723.db2.gz	HRGYHKREXOOFJA-UHFFFAOYSA-N	0	2	575.606	5.101	1	70		KKIFLN