Molecule ID: mol15153
SMILES: O=C(CN1CCOCC1)NCc1ccccc1
InChI: InChI=1S/C13H18N2O2/c16-13(11-15-6-8-17-9-7-15)14-10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,14,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.98 | Datawarrior | 1 » 0 |
| 4.98 | OCHEM | 1 » 0 |
| 4.98 | OCHEM | 1 » 0 |
| 4.98 | QSARToolbox | 1 » 0 |