smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc2cc3cc(C)oc(=O)c3c([O-])c2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 ZINC000059585852 291313375 /nfs/dbraw/zinc/31/33/75/291313375.db2.gz MWEQUYGNDXCXGS-GUTCHGCDSA-N -1 3 434.397 0.148 1 5 biogenic,in-vitro ICBFHM