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(Nc1cc(F)cc(Cl)c1[O-])c1ccc([N+](=O)[O-])[n-]1 ZINC000353897269 380938267 /nfs/dbraw/zinc/93/82/67/380938267.db2.gz ZCRDGFNXLZBSAV-UHFFFAOYSA-N -2 1 299.645 2.673 20 5 CFBDML O=C(Nc1cc(Cl)c([O-])cc1F)c1ccc([N+](=O)[O-])[n-]1 ZINC000345698672 154244035 /nfs/dbraw/zinc/24/40/35/154244035.db2.gz GXSMOSCGAUBEOT-UHFFFAOYSA-N -2 1 299.645 2.673 20 5 CFBDML