smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc2ccc3ccc(CNc4ccc5c(c4)CN([C@H](CCC(=O)[O-])C(=O)[O-])C5=O)cc3c2c(=O)[nH]1	ZINC000003871821	561684306	/nfs/dbraw/zinc/68/43/06/561684306.db2.gz	BRVFNEZMTRVUGW-JOCHJYFZSA-N	-2	0	500.511	3.271	10	5		KGBERL
O=C([O-])CN(CC(=O)[O-])[C@@H](CCCCNC(=S)Nc1ccc(-c2c3ccc([O-])cc3oc3cc(=O)ccc2-3)c(C(=O)[O-])c1)C(=O)[O-]	ZINC000072132411	553643372	/nfs/dbraw/zinc/64/33/72/553643372.db2.gz	IFLIYYOLIRSPCH-QHCPKHFHSA-N	-5	0	651.650	3.350	10	5	in-vitro	KGBERL
O=C([O-])CN(CC(=O)[O-])[C@H](CCCCNC(=S)Nc1ccc(-c2c3ccc([O-])cc3oc3cc(=O)ccc2-3)c(C(=O)[O-])c1)C(=O)[O-]	ZINC000072132412	553643381	/nfs/dbraw/zinc/64/33/81/553643381.db2.gz	IFLIYYOLIRSPCH-HSZRJFAPSA-N	-5	0	651.650	3.350	10	5	in-vitro	KGBERL