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-])CCSC(=S)Nc1ccccc1 ZINC000006095666 385058726 /nfs/dbraw/zinc/05/87/26/385058726.db2.gz SQMXIYKGSSMYER-UHFFFAOYSA-N -1 2 241.337 2.812 40 30 BFEBLM