Molecule ID: mol894
SMILES: CCOC(=O)C(CCN(C)C)(c1ccccc1)c1ccccc1
InChI: InChI=1S/C20H25NO2/c1-4-23-19(22)20(15-16-21(2)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,4,15-16H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.96 | QSARToolbox | 1 » 0 |
| 9.07 | OCHEM | 1 » 0 |
| 9.18 | QSARToolbox | 1 » 0 |
| 9.87 | QSARToolbox | 1 » 0 |
| 9.87 | IUPAC digitized pKa | 1 » 0 |
| 9.87 | Hunt | 1 » 0 |