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-])c1nn(-c2ccc([N+](=O)[O-])cc2)c(=O)[n-]1 ZINC000006536415 304283249 /nfs/dbraw/zinc/28/32/49/304283249.db2.gz OLHLUDVVQUCJEO-UHFFFAOYSA-N -2 0 250.170 0.167 30 5 CCBCRL O=C([O-])c1nn(-c2ccccc2[N+](=O)[O-])c(=O)[n-]1 ZINC000015444177 304283085 /nfs/dbraw/zinc/28/30/85/304283085.db2.gz WPQFRHJFTCYAEQ-UHFFFAOYSA-N -2 0 250.170 0.167 30 5 CCBCRL