Molecule ID: mol32085
SMILES: O=C(CN1CCCC1)NCc1ccccc1
InChI: InChI=1S/C13H18N2O/c16-13(11-15-8-4-5-9-15)14-10-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,14,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.27 | OCHEM | 1 » 0 |
| 8.27 | QSARToolbox | 1 » 0 |