Molecule ID: mol19507
SMILES: O=C(O)C(=O)CC(=O)c1ccc(Cc2ccc(Cl)c(Cl)c2)cc1
InChI: InChI=1S/C17H12Cl2O4/c18-13-6-3-11(8-14(13)19)7-10-1-4-12(5-2-10)15(20)9-16(21)17(22)23/h1-6,8H,7,9H2,(H,22,23)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.38 | Baltruschat ChEMBL | 0 » -1 |
| 9.22 | Baltruschat ChEMBL | -1 » -2 |