smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1c(Cl)c2ccccc2c2ccccc12 ZINC000001683335 188273917 /nfs/dbraw/zinc/27/39/17/188273917.db2.gz FESDGGYDNJWQPR-UHFFFAOYSA-N -1 1 228.678 4.352 40 5 BIBBMM