Molecule ID: mol21188
SMILES: NS(=O)(=O)c1cc(C(=O)c2ccc(O)cc2)cs1
InChI: InChI=1S/C11H9NO4S2/c12-18(15,16)10-5-8(6-17-10)11(14)7-1-3-9(13)4-2-7/h1-6,13H,(H2,12,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.90 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 7.90 | Baltruschat ChEMBL | 0 » -1 |
| 9.68 | Baltruschat ChEMBL | -1 » -2 |