smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc([O-])c(O)c(O)c1C(=O)O[C@@H]1C[C@@]2(C)C1=C(CO)[C@@H](O)[C@@H]1CC(C)(C)C[C@@H]12 ZINC000006069746 571691020 /nfs/dbraw/zinc/69/10/20/571691020.db2.gz PTVABGVMGJFKGM-GHEGTYFOSA-N -1 3 418.486 2.763 1 10 endogenous,in-man HFCFHM