smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1c2c([O-])c3cc4ccccc4cc3oc-2cc([O-])c1[N+](=O)[O-] ZINC000040918246 183148421 /nfs/dbraw/zinc/14/84/21/183148421.db2.gz HWONXTBCOAUQJP-UHFFFAOYSA-N -2 0 323.260 3.419 1 5 DGBFRL O=C([O-])C(=O)C=C([O-])c1ccc2ccc3c(F)cccc3c2c1 ZINC000096937948 185392874 /nfs/dbraw/zinc/39/28/74/185392874.db2.gz MSMBZQAJRFIEAP-UHFFFAOYSA-N -2 0 310.280 3.359 1 5 DGBFRL O=C([O-])C(=O)C=C([O-])c1ccc2c(ccc3c(F)cccc32)c1 ZINC000096937901 185393048 /nfs/dbraw/zinc/39/30/48/185393048.db2.gz LXEIIJISDVAKJV-UHFFFAOYSA-N -2 0 310.280 3.359 1 5 DGBFRL O=C([O-])C(=O)C=C([O-])c1ccc2ccc3ccccc3c2c1F ZINC000096937902 185392909 /nfs/dbraw/zinc/39/29/09/185392909.db2.gz AVOBDIZHTDYPFM-UHFFFAOYSA-N -2 0 310.280 3.359 1 5 DGBFRL