Molecule ID: mol28705
SMILES: CC(C)c1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1
InChI: InChI=1S/C16H18N2O3S/c1-11(2)12-3-5-13(6-4-12)16(19)18-22(20,21)15-9-7-14(17)8-10-15/h3-11H,17H2,1-2H3,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.70 | AttenGpKa training set | 0 » -1 |