Molecule ID: mol30635
SMILES: Oc1cc(Cl)cc(Cl)c1Cl
InChI: InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.83 | AttenGpKa training set | 0 » -1 |
| 7.23 | OCHEM | 0 » -1 |
| 7.23 | QSARToolbox | 0 » -1 |
| 7.23 | QSARToolbox | 0 » -1 |