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)[nH]1 ZINC000006536415 304283251 /nfs/dbraw/zinc/28/32/51/304283251.db2.gz OLHLUDVVQUCJEO-UHFFFAOYSA-N -1 1 250.170 0.167 30 5 CCBCMM O=C([O-])c1nn(-c2ccccc2[N+](=O)[O-])c(=O)[nH]1 ZINC000015444177 304283088 /nfs/dbraw/zinc/28/30/88/304283088.db2.gz WPQFRHJFTCYAEQ-UHFFFAOYSA-N -1 1 250.170 0.167 30 5 CCBCMM