smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1coc2c1c([O-])c1c(c2[O-])[C@@]2(C)CCC(C)=C(C)C2=CC1=O ZINC000013309465 290937140 /nfs/dbraw/zinc/93/71/40/290937140.db2.gz VGDAVGPDHBMHBW-FQEVSTJZSA-N -2 3 324.376 4.663 1 30 biogenic,in-vitro DJEFHL