smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(C(=O)NNC(=O)CCCC(=O)[O-])cc1	ZINC000005007440	967492443	/nfs/dbraw/zinc/49/24/43/967492443.db2.gz	KRTMPFOTCVZMGV-UHFFFAOYSA-N	-1	0	280.280	0.711	40	50		CCGBRM
COc1ccc(C(=O)NNC(=O)CCC(=O)[O-])cc1	ZINC000016851338	948786628	/nfs/dbraw/zinc/78/66/28/948786628.db2.gz	PEPDBHIUMRNQJY-UHFFFAOYSA-N	-1	0	266.253	0.321	40	50		CCGBRM
O=C([O-])CCCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000006221354	956876245	/nfs/dbraw/zinc/87/62/45/956876245.db2.gz	CEVTXLUOXKQFLA-UHFFFAOYSA-N	-1	0	295.251	0.611	40	50		CCGBRM
COc1ccc(C(=O)NNC(=O)C[C@H](C)CC(=O)[O-])cc1	ZINC000026807928	957163966	/nfs/dbraw/zinc/16/39/66/957163966.db2.gz	JNDPNAQAKPTOGY-VIFPVBQESA-N	-1	0	294.307	0.957	40	50		CCGBRM
COc1ccc(C(=O)NNC(=O)C[C@@H](C)CC(=O)[O-])cc1	ZINC000026807921	957163990	/nfs/dbraw/zinc/16/39/90/957163990.db2.gz	JNDPNAQAKPTOGY-SECBINFHSA-N	-1	0	294.307	0.957	40	50		CCGBRM
O=C([O-])c1ccc(C(=O)NNC(=O)c2cccnc2)cc1	ZINC000026807523	948797710	/nfs/dbraw/zinc/79/77/10/948797710.db2.gz	BMKZDSDSPHJHSD-UHFFFAOYSA-N	-1	0	285.259	0.855	40	50		CCGBRM