Molecule ID: mol15399
SMILES: Cc1ccc(S(=O)(=O)NC(=O)OCc2ccccc2)cc1
InChI: InChI=1S/C15H15NO4S/c1-12-7-9-14(10-8-12)21(18,19)16-15(17)20-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.21 | Datawarrior | 0 » -1 |
| 4.21 | OCHEM | 0 » -1 |
| 4.21 | AttenGpKa training set | 0 » -1 |
| 4.21 | QSARToolbox | 0 » -1 |