Molecule ID: mol20221
SMILES: CC(C)(C)c1ccccc1Nc1c2ccccc2nc2ccccc12
InChI: InChI=1S/C23H22N2/c1-23(2,3)18-12-6-9-15-21(18)25-22-16-10-4-7-13-19(16)24-20-14-8-5-11-17(20)22/h4-15H,1-3H3,(H,24,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.62 | Baltruschat ChEMBL | 1 » 0 |