smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N[C@@H](Cc1cc2ccccc2c2ccccc12)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O	ZINC000003842916	561683985	/nfs/dbraw/zinc/68/39/85/561683985.db2.gz	BVBOTGUEHKBYQQ-QLRKKRFESA-N	-1	1	534.525	-0.398	1	5		KBBFMM
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nn[n-]n1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000029127889	562000353	/nfs/dbraw/zinc/00/03/53/562000353.db2.gz	RMWYNAVZNJDNNE-WBAQKLHDSA-N	-1	1	709.765	-0.436	1	5		KBBFMM
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nn[n-]n1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000095607764	562783092	/nfs/dbraw/zinc/78/30/92/562783092.db2.gz	FWESMVVJULJCLI-WBAQKLHDSA-N	-1	1	754.762	-0.528	1	5		KBBFMM