Molecule ID: mol5292
SMILES: Nc1ccc2cc(S(=O)(=O)O)ccc2c1
InChI: InChI=1S/C10H9NO3S/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9/h1-6H,11H2,(H,12,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.74 | AttenGpKa training set | 0 » -1 |
| 3.74 | QSARToolbox | 0 » -1 |
| 3.74 | QSARToolbox | 0 » -1 |
| 3.79 | OCHEM | 0 » -1 |
| 3.79 | OCHEM | 0 » -1 |