Molecule ID: mol21699
SMILES: CS(=O)(=O)c1cccc(O)c1
InChI: InChI=1S/C7H8O3S/c1-11(9,10)7-4-2-3-6(8)5-7/h2-5,8H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.40 | QSARToolbox | 0 » -1 |
| 8.40 | QSARToolbox | 0 » -1 |
| 8.40 | QSARToolbox | 0 » -1 |
| 8.40 | AttenGpKa training set | 0 » -1 |
| 9.00 | OCHEM | 0 » -1 |
| 9.33 | QSARToolbox | 0 » -1 |
| 9.33 | QSARToolbox | 0 » -1 |
| 9.33 | QSARToolbox | 0 » -1 |
| 9.33 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 9.33 | OCHEM | 0 » -1 |
| 9.33 | OCHEM | 0 » -1 |