Molecule ID: mol14819
SMILES: c1cc(N2CCOCC2)ccc1N1CCOCC1
InChI: InChI=1S/C14H20N2O2/c1-2-14(16-7-11-18-12-8-16)4-3-13(1)15-5-9-17-10-6-15/h1-4H,5-12H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.20 | OCHEM | 1 » 0 |
| 4.20 | QSARToolbox | 1 » 0 |
| 4.20 | Datawarrior | 1 » 0 |
| 4.20 | AttenGpKa training set | 1 » 0 |