Molecule ID: mol18838
SMILES: O=S(=O)(Nc1ccc(Cl)cc1)c1ccc(Cl)cc1
InChI: InChI=1S/C12H9Cl2NO2S/c13-9-1-5-11(6-2-9)15-18(16,17)12-7-3-10(14)4-8-12/h1-8,15H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.30 | OCHEM | 0 » -1 |
| 8.30 | OCHEM | 0 » -1 |
| 8.30 | Baltruschat ChEMBL | 0 » -1 |