smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@@H](C)[C@@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCC[NH3+])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004556583	552466946	/nfs/dbraw/zinc/46/69/46/552466946.db2.gz	GPVLFJQPHXESFM-IBURTVSXSA-N	1	3	526.638	2.248	40	5		KEBBHO