Molecule ID: mol14948
SMILES: O=C(CCCCN1CCOCC1)c1ccccc1
InChI: InChI=1S/C15H21NO2/c17-15(14-6-2-1-3-7-14)8-4-5-9-16-10-12-18-13-11-16/h1-3,6-7H,4-5,8-13H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.50 | Datawarrior | 1 » 0 |
| 7.50 | OCHEM | 1 » 0 |
| 7.50 | QSARToolbox | 1 » 0 |