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=C/C=C(C)/C=C/C(=O)[O-])=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C(=O)[O-] ZINC000004097711 204025967 /nfs/dbraw/zinc/02/59/67/204025967.db2.gz ZVKOASAVGLETCT-UOGKPENDSA-N -2 0 380.484 5.722 10 5 endogenous,in-man GKBERL