Molecule ID: mol19276
SMILES: Oc1c(Cl)cc(Cl)cc1Sc1cc(Cl)cc(Cl)c1O
InChI: InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.82 | QSARToolbox | 0 » -1 |
| 4.82 | QSARToolbox | 0 » -1 |
| 6.30 | Baltruschat ChEMBL | -1 » -2 |