Molecule ID: mol14343
SMILES: CC(=O)NS(=O)(=O)c1ccsc1C(=O)O
InChI: InChI=1S/C7H7NO5S2/c1-4(9)8-15(12,13)5-2-3-14-6(5)7(10)11/h2-3H,1H3,(H,8,9)(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.10 | OCHEM | 0 » -1 |
| 3.10 | QSARToolbox | 0 » -1 |
| 3.10 | Datawarrior | 0 » -1 |