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-])cc([O-])c2c(=O)c(O)c(-c3ccccc3)oc12 ZINC000005854426 201361460 /nfs/dbraw/zinc/36/14/60/201361460.db2.gz WCSHKPNHOSDFGK-UHFFFAOYSA-N -2 1 338.359 4.086 10 0 biogenic,in-vitro EIAEML CCCC1CCC(Nc2ccc(OCC)cc2)(P(=O)([O-])[O-])CC1 ZINC000012523586 211397750 /nfs/dbraw/zinc/39/77/50/211397750.db2.gz NZODQMOVYNIJKP-UHFFFAOYSA-N -2 1 341.388 4.362 10 0 EIAEML