Molecule ID: mol32234
SMILES: c1ccc([C@H]2CN3CCC[C@H]3c3ccccc32)cc1
InChI: InChI=1S/C18H19N/c1-2-7-14(8-3-1)17-13-19-12-6-11-18(19)16-10-5-4-9-15(16)17/h1-5,7-10,17-18H,6,11-13H2/t17-,18+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.12 | QSARToolbox | 1 » 0 |
| 9.12 | OCHEM | 1 » 0 |