Molecule ID: mol1167
SMILES: c1ccc(CNCC(c2ccccc2)c2ccccc2)cc1
InChI: InChI=1S/C21H21N/c1-4-10-18(11-5-1)16-22-17-21(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22H,16-17H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.60 | IUPAC digitized pKa | 1 » 0 |
| 7.60 | Hunt | 1 » 0 |