smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc(=O)c2c([O-])c3cc(CC=C(C)C)c([O-])c(O)c3oc-2c1CC=C(C)C ZINC000014727618 291294133 /nfs/dbraw/zinc/29/41/33/291294133.db2.gz RATPZJKZEAONEQ-UHFFFAOYSA-N -2 0 410.466 5.089 1 10 HKCFRL COc1cc2oc3cc([O-])c(O)c(CC=C(C)C)c3c([O-])c-2c(=O)c1CC=C(C)C ZINC000014727627 291295147 /nfs/dbraw/zinc/29/51/47/291295147.db2.gz ZKLPJPFTGPFGBI-UHFFFAOYSA-N -2 0 410.466 5.089 1 10 biogenic,in-vitro HKCFRL