smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)c1ccc2c(c1[O-])[C@@H](c1ccccc1)CC(=O)O2 ZINC000217766458 275506170 /nfs/dbraw/zinc/50/61/70/275506170.db2.gz HIUTUMGESXTECA-CYBMUJFWSA-N -1 3 282.295 3.036 50 70 biogenic CGIAHM CC(=O)c1ccc2c(c1[O-])[C@H](c1ccccc1)CC(=O)O2 ZINC000217766378 275506125 /nfs/dbraw/zinc/50/61/25/275506125.db2.gz HIUTUMGESXTECA-ZDUSSCGKSA-N -1 3 282.295 3.036 50 70 biogenic CGIAHM