Molecule ID: mol33163
SMILES: CCNCCOC(c1ccccc1)c1ccccc1
InChI: InChI=1S/C17H21NO/c1-2-18-13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18H,2,13-14H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.64 | OCHEM | 1 » 0 |
| 8.64 | QSARToolbox | 1 » 0 |