Molecule ID: mol34223
SMILES: O=C(O)c1ccc(CS(=O)(=O)C(F)(F)F)cc1
InChI: InChI=1S/C9H7F3O4S/c10-9(11,12)17(15,16)5-6-1-3-7(4-2-6)8(13)14/h1-4H,5H2,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.23 | QSARToolbox | 0 » -1 |
| 5.23 | QSARToolbox | 0 » -1 |