smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CS(=O)(=O)CC[C@H](N)C(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000064390688	205188740	/nfs/dbraw/zinc/18/87/40/205188740.db2.gz	VTQQKZOMGKELNV-AVGNSLFASA-N	0	1	375.403	-1.133	1	5		GABFMN
CS(=O)(=O)CC[C@H](N)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000064448689	222070958	/nfs/dbraw/zinc/07/09/58/222070958.db2.gz	VTQQKZOMGKELNV-YNEHKIRRSA-N	0	1	375.403	-1.133	1	5		GABFMN
CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO[P@](=O)([O-])OCC[N+](C)(C)C)O[C@@H]1O	ZINC000064633728	717132636	/nfs/dbraw/zinc/13/26/36/717132636.db2.gz	VGSHXNQBJVLXRV-LBELIVKGSA-O	0	1	387.346	-2.230	1	5	in-vitro	GABFMN
CC(=O)N[C@H]1[C@H](O)O[C@H](CO[P@](=O)([O-])OCC[N+](C)(C)C)[C@H](O)[C@@H]1O	ZINC000064633730	717132278	/nfs/dbraw/zinc/13/22/78/717132278.db2.gz	VGSHXNQBJVLXRV-UJPOAAIJSA-O	0	1	387.346	-2.230	1	5	in-vitro	GABFMN