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)=CCC/C(C)=C/Cc1c([O-])ccc2c(=O)c3ccc([O-])c(O)c3oc21 ZINC000095913744 291144523 /nfs/dbraw/zinc/14/45/23/291144523.db2.gz IZCZDNUWRCMXGX-VGOFMYFVSA-N -2 3 380.440 5.298 1 10 biogenic,in-vitro GKCFHL CC(C)=CCC/C(C)=C/Cc1c([O-])ccc2c(=O)c3ccc(O)c([O-])c3oc21 ZINC000095913744 291144526 /nfs/dbraw/zinc/14/45/26/291144526.db2.gz IZCZDNUWRCMXGX-VGOFMYFVSA-N -2 3 380.440 5.298 1 10 biogenic,in-vitro GKCFHL