smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc2c(c1)[nH]c1c2ccc2cc(CC(=O)[O-])c([O-])cc12 ZINC000040421381 183064345 /nfs/dbraw/zinc/06/43/45/183064345.db2.gz RIVUNEBMYQCJSY-UHFFFAOYSA-N -2 3 305.333 4.115 1 5 DIBFHL