smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC[C@H](NC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000085426362	553681625	/nfs/dbraw/zinc/68/16/25/553681625.db2.gz	BTBSGNCHEDEIJB-NICUNNCGSA-N	0	3	721.853	0.356	40	5		KCBBHN