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-])c1c(O)cc(=O)oc1-c1ccc(Cl)cc1Cl	ZINC000001720845	304217795	/nfs/dbraw/zinc/21/77/95/304217795.db2.gz	WQCPXZBCEZGHGH-UHFFFAOYSA-N	-1	2	301.081	3.017	40	0		DGABLM
O=C([O-])C(CCc1ccccc1)(CCc1ccccc1)C(=O)O	ZINC000001748083	431239001	/nfs/dbraw/zinc/23/90/01/431239001.db2.gz	LKYFYQXPFFFDCD-UHFFFAOYSA-N	-1	2	312.365	3.408	40	0		DGABLM
O=S(=O)(c1ccc([O-])c(Cl)c1)c1ccc(O)c(Cl)c1	ZINC000001603592	431233869	/nfs/dbraw/zinc/23/38/69/431233869.db2.gz	PWDGALQKQJSBKU-UHFFFAOYSA-N	-1	2	319.165	3.237	40	0		DGABLM
O=[P@@]([O-])(O)c1cc(-c2ccccc2)oc1-c1ccccc1	ZINC000001676057	431235241	/nfs/dbraw/zinc/23/52/41/431235241.db2.gz	CIRRLLGWMFAUJB-UHFFFAOYSA-N	-1	2	300.250	3.417	40	0		DGABLM
O=[P@]([O-])(O)c1cc(-c2ccccc2)oc1-c1ccccc1	ZINC000001676057	431235248	/nfs/dbraw/zinc/23/52/48/431235248.db2.gz	CIRRLLGWMFAUJB-UHFFFAOYSA-N	-1	2	300.250	3.417	40	0		DGABLM
CC(=O)N1CCC[C@@H](c2cccc(-c3cccc(C(=O)[O-])c3)n2)C1	ZINC000257229880	202962781	/nfs/dbraw/zinc/96/27/81/202962781.db2.gz	FZVRULQDCNJKHP-MRXNPFEDSA-N	-1	2	324.380	3.173	40	0		DGABLM