smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCN(S(N)(=O)=O)CC2)c1	ZINC000266469799	530094470	/nfs/dbraw/zinc/09/44/70/530094470.db2.gz	SEIUILIUVLSAJL-UHFFFAOYSA-N	-1	3	378.432	-1.275	20	10		GACDHM
CN(C)S(=O)(=O)NCCNC(=O)c1cc(NS(C)(=O)=O)ccc1[O-]	ZINC000294815528	530100733	/nfs/dbraw/zinc/10/07/33/530100733.db2.gz	XDJGHJIYSITRBY-UHFFFAOYSA-N	-1	3	380.448	-1.111	20	10		GACDHM
CNS(=O)(=O)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2[O-])CC1	ZINC000774272175	637411932	/nfs/dbraw/zinc/41/19/32/637411932.db2.gz	IADMBHAJQRZYTJ-UHFFFAOYSA-N	-1	3	392.459	-1.014	20	10		GACDHM
CS(=O)(=O)Nc1ccc([O-])c(C(=O)NCCOCCS(N)(=O)=O)c1	ZINC000816594832	637438341	/nfs/dbraw/zinc/43/83/41/637438341.db2.gz	QAOJYEJFAABUOT-UHFFFAOYSA-N	-1	3	381.432	-1.201	20	10		GACDHM
CN(C)S(=O)(=O)N1CC(NC(=O)c2cc(NS(C)(=O)=O)ccc2[O-])C1	ZINC000863545125	637483200	/nfs/dbraw/zinc/48/32/00/637483200.db2.gz	IFFHUVIODBGEPD-UHFFFAOYSA-N	-1	3	392.459	-1.016	20	10		GACDHM
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)c1	ZINC001652501170	1076536029	/nfs/dbraw/zinc/53/60/29/1076536029.db2.gz	PBHOUEFCFFJVOZ-JTQLQIEISA-N	-1	3	390.443	-1.262	20	10		GACDHM
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCN3[C@H](CNS3(=O)=O)C2)c1	ZINC001652501181	1076535991	/nfs/dbraw/zinc/53/59/91/1076535991.db2.gz	PBHOUEFCFFJVOZ-SNVBAGLBSA-N	-1	3	390.443	-1.262	20	10		GACDHM