Molecule ID: mol11926
SMILES: COc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1
InChI: InChI=1S/C13H14N2O3S/c1-18-12-6-4-11(5-7-12)15-19(16,17)13-8-2-10(14)3-9-13/h2-9,15H,14H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.34 | IUPAC digitized pKa | 0 » -1 |
| 9.34 | AttenGpKa training set | 0 » -1 |