Molecule ID: mol19978
SMILES: CNCc1cc(-c2ccccc2)n(S(=O)(=O)c2ccc(C)cc2)c1
InChI: InChI=1S/C19H20N2O2S/c1-15-8-10-18(11-9-15)24(22,23)21-14-16(13-20-2)12-19(21)17-6-4-3-5-7-17/h3-12,14,20H,13H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.49 | OCHEM | 1 » 0 |
| 9.49 | Baltruschat ChEMBL | 1 » 0 |