smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1ccc(O)c(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000295917722	308374592	/nfs/dbraw/zinc/37/45/92/308374592.db2.gz	JLGMRLOLEHNFOY-KRWDZBQOSA-N	-2	2	335.425	3.084	20	0		EGADLL
Cc1cccc(C)c1S(=O)(=O)Nc1nc2c(cccc2O)s1	ZINC001194602648	1368294287	/nfs/dbraw/zinc/29/42/87/1368294287.db2.gz	IRCSCPNNRIUILM-UHFFFAOYSA-N	-2	2	334.422	3.420	20	0		EGADLL
CCCN(Cc1nc(=O)c2sccc2[nH]1)C(=O)c1ccccc1O	ZINC001317756161	1385446463	/nfs/dbraw/zinc/44/64/63/1385446463.db2.gz	HWTWSNZRJORZOG-UHFFFAOYSA-N	-2	2	343.408	3.155	20	0		EGADLL
CC(C)(C)c1cc[nH+]c(NC2([P@@](=O)([O-])O)Cc3ccccc3C2)c1	ZINC001167938240	1383773224	/nfs/dbraw/zinc/77/32/24/1383773224.db2.gz	HIQPUKRJMOIMQK-UHFFFAOYSA-N	-2	2	346.367	3.464	20	0		EGADLL
CCc1ccc(O)c(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000295917725	308374603	/nfs/dbraw/zinc/37/46/03/308374603.db2.gz	JLGMRLOLEHNFOY-QGZVFWFLSA-N	-2	2	335.425	3.084	20	0		EGADLL
Cc1ccc(-c2n[nH]c(NC(=O)c3c(F)ccc(O)c3F)n2)cc1	ZINC000566941850	459023723	/nfs/dbraw/zinc/02/37/23/459023723.db2.gz	XYDUXYCSLOQKHF-UHFFFAOYSA-N	-2	2	330.294	3.016	20	0		EGADLL
Cc1ccc(S(=O)(=O)Nc2cc[nH+]c(C(C)(C)C)c2)cc1C(=O)[O-]	ZINC001184664853	1387506030	/nfs/dbraw/zinc/50/60/30/1387506030.db2.gz	VSBOEMYYQJMRBU-UHFFFAOYSA-N	-2	2	348.424	3.187	20	0		EGADLL
O=S(=O)(Cc1ccc(Cl)cc1F)Nc1cc(F)ccc1O	ZINC001191898428	1367630330	/nfs/dbraw/zinc/63/03/30/1367630330.db2.gz	TXXMRFBXQZJQOQ-UHFFFAOYSA-N	-2	2	333.743	3.266	20	0		EGADLL
O=C(Nc1cc(Br)cc(Cl)c1O)c1cncc(O)c1	ZINC000339941630	155043192	/nfs/dbraw/zinc/04/31/92/155043192.db2.gz	KCLCBAYCMKDMSR-UHFFFAOYSA-N	-2	2	343.564	3.161	20	0		EGADLL