Molecule ID: mol3046
SMILES: CN(C)CCN1C(=O)c2ccccc2N(C)c2ccccc21
InChI: InChI=1S/C18H21N3O/c1-19(2)12-13-21-17-11-7-6-10-16(17)20(3)15-9-5-4-8-14(15)18(21)22/h4-11H,12-13H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.45 | OCHEM | 2 » 1 |
| 3.45 | OCHEM | 2 » 1 |
| 8.28 | OCHEM | 1 » 0 |
| 8.28 | OCHEM | 1 » 0 |
| 8.28 | OCHEM | 1 » 0 |
| 8.28 | AvLiLuMoVe | 1 » 0 |