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(C[C@H]1SC(=O)NC1=O)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000016899477	436097953	/nfs/dbraw/zinc/09/79/53/436097953.db2.gz	JXYINNKRAOELDC-MRVPVSSYSA-N	-2	2	338.297	0.763	40	0		ECABLL
O=C(C[C@@H]1SC(=O)NC1=O)Nc1cc(C(=O)[O-])ccc1C(=O)[O-]	ZINC000016905454	436098119	/nfs/dbraw/zinc/09/81/19/436098119.db2.gz	RYYMKIWAKQSNPG-QMMMGPOBSA-N	-2	2	338.297	0.763	40	0		ECABLL
O=C(C[C@@H]1SC(=O)NC1=O)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000016899476	436096814	/nfs/dbraw/zinc/09/68/14/436096814.db2.gz	JXYINNKRAOELDC-QMMMGPOBSA-N	-2	2	338.297	0.763	40	0		ECABLL
O=C(C[C@H]1SC(=O)NC1=O)Nc1cc(C(=O)[O-])ccc1C(=O)[O-]	ZINC000016905456	436098454	/nfs/dbraw/zinc/09/84/54/436098454.db2.gz	RYYMKIWAKQSNPG-MRVPVSSYSA-N	-2	2	338.297	0.763	40	0		ECABLL