Molecule ID: mol16059
SMILES: O=C(O)C1CCCN(CCC=C(c2ccccc2)c2ccccc2)C1
InChI: InChI=1S/C22H25NO2/c24-22(25)20-13-7-15-23(17-20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.32 | Baltruschat ChEMBL | 1 » 0 |
| 9.36 | Baltruschat ChEMBL | 0 » -1 |