Molecule ID: mol15494
SMILES: COc1ccc(S(=O)(=O)NCc2ccccc2)cc1
InChI: InChI=1S/C14H15NO3S/c1-18-13-7-9-14(10-8-13)19(16,17)15-11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.53 | QSARToolbox | 0 » -1 |
| 11.53 | Datawarrior | 0 » -1 |
| 11.53 | OCHEM | 0 » -1 |
| 11.55 | AttenGpKa training set | 0 » -1 |