smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=C(C)[C@H](O)Cc1c(O)c(C(=O)C(C)C)c([O-])c2c(-c3ccccc3)cc(=O)oc12 ZINC000014589304 291260790 /nfs/dbraw/zinc/26/07/90/291260790.db2.gz HUJQDILIRUAUFY-QGZVFWFLSA-N -2 1 408.450 4.189 1 30 biogenic,in-vitro HIEFML