Molecule ID: mol15605
SMILES: COc1cccc2c1CN(C1CC3CCC(C1)N3Cc1ccccc1)C2=O
InChI: InChI=1S/C23H26N2O2/c1-27-22-9-5-8-20-21(22)15-25(23(20)26)19-12-17-10-11-18(13-19)24(17)14-16-6-3-2-4-7-16/h2-9,17-19H,10-15H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.68 | Datawarrior | 1 » 0 |
| 8.68 | OCHEM | 1 » 0 |
| 8.68 | QSARToolbox | 1 » 0 |