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-])CCC1=C([O-])c2c(O)c(O)c(O)c(O)c2C(=O)C1=O ZINC000027638761 182483944 /nfs/dbraw/zinc/48/39/44/182483944.db2.gz FSCYILFDWKPMGX-UHFFFAOYSA-N -2 2 310.214 0.565 1 30 DCEFLL