Molecule ID: mol20589
SMILES: COc1noc2c1CN(Cc1ccccc1)CC2
InChI: InChI=1S/C14H16N2O2/c1-17-14-12-10-16(8-7-13(12)18-15-14)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.00 | OCHEM | 1 » 0 |
| 6.00 | Baltruschat ChEMBL | 1 » 0 |
| 6.10 | QSARToolbox | 1 » 0 |