Molecule ID: mol11620
SMILES: CCc1cccc(CN(C)C)c1O
InChI: InChI=1S/C11H17NO/c1-4-9-6-5-7-10(11(9)13)8-12(2)3/h5-7,13H,4,8H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.02 | IUPAC digitized pKa | 1 » 0 |
| 8.02 | Datawarrior | 1 » 0 |
| 8.02 | AttenGpKa training set | 1 » 0 |
| 8.02 | QSARToolbox | 1 » 0 |
| 8.02 | OCHEM | 1 » 0 |