smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)=CCc1c(O)ccc2c(=O)cc(-c3ccc(O)c(O)c3)oc21 ZINC000014819385 563982966 /nfs/dbraw/zinc/98/29/66/563982966.db2.gz MXLIDQIPMAHDLB-UHFFFAOYSA-N -2 2 338.359 4.086 40 10 biogenic EICBLL