smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCOc1c2cccc1Cc1cc([N+](=O)[O-])cc(c1O)Cc1cccc(c1OCCC)Cc1cc([N+](=O)[O-])cc(c1[O-])C2	ZINC000139645624	571453183	/nfs/dbraw/zinc/45/31/83/571453183.db2.gz	JWEYAVPNARESTR-UHFFFAOYSA-N	-1	1	598.652	7.168	10	5		KKBEMM
C=Cc1c(C)c2cc3nc(cc4[nH]c(cc5nc(cc1[nH]2)c(C)c5CCC(=O)OC)c(CCC(=O)[O-])c4C)[C@@]1(C)C3=CC=C(C(=O)OC)[C@@H]1C(=O)OC	ZINC000045329780	562661267	/nfs/dbraw/zinc/66/12/67/562661267.db2.gz	CABKTHJNHVBKCC-XQUWYEIYSA-N	-1	1	718.807	6.527	10	5		KKBEMM
C=Cc1c(C)c2cc3nc(cc4[nH]c(cc5nc(cc1[nH]2)c(C)c5CCC(=O)OC)c(CCC(=O)[O-])c4C)[C@]1(C)C3=CC=C(C(=O)OC)[C@@H]1C(=O)OC	ZINC000161410991	562849192	/nfs/dbraw/zinc/84/91/92/562849192.db2.gz	CABKTHJNHVBKCC-UMBAWLCISA-N	-1	1	718.807	6.527	10	5		KKBEMM