smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [CH2]CCCCCCCCCCCCC ZINC000112932338 572635432 /nfs/dbraw/zinc/63/54/32/572635432.db2.gz GHYJHZQFXONUDK-UHFFFAOYSA-N -1 0 197.386 5.522 10 30 AKEERM