Molecule ID: mol6298
SMILES: CN(C)c1cccc2cccc(N(C)C)c12
InChI: InChI=1S/C14H18N2/c1-15(2)12-9-5-7-11-8-6-10-13(14(11)12)16(3)4/h5-10H,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.66 | QSARToolbox | 2 » 1 |
| 12.00 | QSARToolbox | 1 » 0 |
| 12.10 | AttenGpKa training set | 1 » 0 |
| 12.10 | QSARToolbox | 1 » 0 |
| 12.10 | QSARToolbox | 1 » 0 |
| 12.13 | Datawarrior | 1 » 0 |
| 12.13 | OCHEM | 1 » 0 |