Molecule ID: mol12673
SMILES: NS(=O)(=O)c1ccc(Cl)c(Cl)c1
InChI: InChI=1S/C6H5Cl2NO2S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3H,(H2,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.94 | OCHEM | 0 » -1 |
| 8.94 | Datawarrior | 0 » -1 |
| 9.27 | AttenGpKa training set | 0 » -1 |