smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCOc1cc([O-])cc2oc(-c3ccc([O-])c(O)c3)cc(=O)c12 ZINC000064447725 212037460 /nfs/dbraw/zinc/03/74/60/212037460.db2.gz LCDAQMVGRRZCQX-UHFFFAOYSA-N -2 3 370.401 4.536 1 10 FJCFHL [O-]c1c(O)cc(Cc2cc(O)c([O-])c(Cl)c2Cl)c(Cl)c1Cl ZINC000040935138 205085516 /nfs/dbraw/zinc/08/55/16/205085516.db2.gz VPAZGXKSWFSKBX-UHFFFAOYSA-N -2 3 370.015 4.713 1 10 FJCFHL