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([O-])CN(CC(=O)N1CCNC(=O)C1)Cc1cc(Cl)ccc1[O-]	ZINC000739783599	600144753	/nfs/dbraw/zinc/14/47/53/600144753.db2.gz	AXGKNHXZYLOIPX-UHFFFAOYSA-N	-2	3	355.778	-0.109	20	10		FBCDHL
CS(=O)(=O)Nc1ccc([O-])c(C(=O)NCCCc2n[nH]c(=O)[n-]2)c1	ZINC000748383961	660602930	/nfs/dbraw/zinc/60/29/30/660602930.db2.gz	ZDQOBKKPGFTEAX-UHFFFAOYSA-N	-2	3	355.376	-0.050	20	10		FBCDHL
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCNC(=O)[C@@H]2CC(=O)[O-])c1	ZINC000833738471	604704154	/nfs/dbraw/zinc/70/41/54/604704154.db2.gz	WUQMYYVAZODIEM-JTQLQIEISA-N	-2	3	371.371	-0.821	20	10		FBCDHL
CS(=O)(=O)Nc1ccc([O-])c(C(=O)N2CCNC(=O)[C@H]2CC(=O)[O-])c1	ZINC000833738472	604704324	/nfs/dbraw/zinc/70/43/24/604704324.db2.gz	WUQMYYVAZODIEM-SNVBAGLBSA-N	-2	3	371.371	-0.821	20	10		FBCDHL
NOCCNC(=O)[C@@H]1CC(=O)c2oc(=O)c3cc([O-])c(O)c([O-])c3c21	ZINC001185552030	840496395	/nfs/dbraw/zinc/49/63/95/840496395.db2.gz	AKSSBEXRAFLPEA-RXMQYKEDSA-N	-2	3	350.283	-0.414	20	10		FBCDHL
NOCCNC(=O)[C@H]1CC(=O)c2oc(=O)c3cc([O-])c(O)c([O-])c3c21	ZINC001185552031	840495940	/nfs/dbraw/zinc/49/59/40/840495940.db2.gz	AKSSBEXRAFLPEA-YFKPBYRVSA-N	-2	3	350.283	-0.414	20	10		FBCDHL
Cn1cc(S(=O)(=O)[N-]Cc2cccc(Cl)c2[O-])c(=O)n(C)c1=O	ZINC001309941567	848238721	/nfs/dbraw/zinc/23/87/21/848238721.db2.gz	UOWMLHZSEYAICH-UHFFFAOYSA-N	-2	3	359.791	-0.079	20	10		FBCDHL