smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc2c(c(C)c1C(=O)[O-])C(=O)c1c(O)cc([O-])cc1C2=O ZINC000014814445 571724407 /nfs/dbraw/zinc/72/44/07/571724407.db2.gz QEHCRDXGPIFLOF-UHFFFAOYSA-N -2 1 328.276 1.888 1 10 endogenous,in-man EDCFML O=C([O-])c1cc(O)c(O)cc1-c1cc2ccc([O-])c(O)c2oc1=O ZINC000169309748 226240597 /nfs/dbraw/zinc/24/05/97/226240597.db2.gz YBXYOZNWSFRCDQ-UHFFFAOYSA-N -2 1 330.248 1.981 1 10 EDCFML