smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1coc(CN(Cc2cccs2)Cc2cnc(-c3ccccn3)s2)c1 ZINC000160666325 568215156 /nfs/dbraw/zinc/21/51/56/568215156.db2.gz OEJWYNUNEUNHNS-UHFFFAOYSA-N 1 0 367.499 5.062 20 70 FKIDRO