Molecule ID: mol16489
SMILES: CN1CCN(c2nc(NC3CCN(Cc4ccccc4)CC3)c3ccccc3n2)CC1
InChI: InChI=1S/C25H32N6/c1-29-15-17-31(18-16-29)25-27-23-10-6-5-9-22(23)24(28-25)26-21-11-13-30(14-12-21)19-20-7-3-2-4-8-20/h2-10,21H,11-19H2,1H3,(H,26,27,28)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.53 | Baltruschat ChEMBL | 3 » 2 |