Molecule ID: mol3347
SMILES: CCC(C)(CN(C)C)OC(=O)c1ccc(N)cc1
InChI: InChI=1S/C14H22N2O2/c1-5-14(2,10-16(3)4)18-13(17)11-6-8-12(15)9-7-11/h6-9H,5,10,15H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.07 | QSARToolbox | 2 » 1 |
| 8.91 | QSARToolbox | 1 » 0 |
| 8.91 | IUPAC digitized pKa | 1 » 0 |
| 8.91 | OCHEM | 1 » 0 |