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-])COc1ccccc1/C=C1/Oc2c(ccc([O-])c2O)C1=O ZINC000027421909 202154553 /nfs/dbraw/zinc/15/45/53/202154553.db2.gz IBLKBNQJQUCCMG-NTUHNPAUSA-N -2 1 328.276 2.177 1 30 EEEFML O=C([O-])[C@@H]1Cc2ccc([O-])c3c2C(=Cc2ccc(O)c(O)c2O3)C1=O ZINC000014690036 560100866 /nfs/dbraw/zinc/10/08/66/560100866.db2.gz AMPDZVASNOBSQZ-SNVBAGLBSA-N -2 1 340.287 2.276 1 30 endogenous,in-man EEEFML O=C([O-])C(O)=CC(=O)c1cccc(NC(=O)c2ccccc2[O-])c1 ZINC000101628596 204014767 /nfs/dbraw/zinc/01/47/67/204014767.db2.gz ZZIQWIGKZWJIBJ-DHDCSXOGSA-N -2 1 327.292 2.354 1 30 EEEFML