Molecule ID: mol15192
SMILES: CC(=O)C1(c2cccc(O)c2)CCN(C)CC1
InChI: InChI=1S/C14H19NO2/c1-11(16)14(6-8-15(2)9-7-14)12-4-3-5-13(17)10-12/h3-5,10,17H,6-9H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.61 | QSARToolbox | 1 » 0 |
| 8.61 | OCHEM | 1 » 0 |
| 8.61 | Datawarrior | 1 » 0 |