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([O-])[C@@H]1O[C@H](Oc2ccc(N3CC[NH+](CCCn4nc5ccccn5c4=O)CC3)cc2Cl)[C@@H](O)[C@H](O)[C@H]1O	ZINC000077301064	553660984	/nfs/dbraw/zinc/66/09/84/553660984.db2.gz	PBJJYMNCIXXWKR-AREVGRJGSA-N	0	1	563.995	-0.367	10	10	in-vitro	KBCEMN