smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1csc(=Nc2ccc([N+](=O)[O-])cc2)n1CCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-]	ZINC000009183423	554955827	/nfs/dbraw/zinc/95/58/27/554955827.db2.gz	IQEVLWNEEWOXDQ-UHFFFAOYSA-O	-4	3	454.314	1.387	50	5		JDBAHL
CN1CCN(c2ccc(S(=O)(=O)[N-]c3cc(C(=O)[O-])cc(C(=O)[O-])c3)cc2[N+](=O)[O-])CC1	ZINC000015799182	556007396	/nfs/dbraw/zinc/00/73/96/556007396.db2.gz	MWSJSUKXPHCRBB-UHFFFAOYSA-N	-3	3	464.456	1.544	50	5		JDBAHL
O=C(COC(=O)CCC[N-]S(=O)(=O)c1cccs1)[N-]C(=O)c1cccc([N+](=O)[O-])c1	ZINC000008754830	554656384	/nfs/dbraw/zinc/65/63/84/554656384.db2.gz	FERMTYUPGRWMOH-UHFFFAOYSA-N	-2	3	455.470	1.215	50	5		JDBAHL