Molecule ID: mol14144
SMILES: CCc1c(C)nnc(C)c1C
InChI: InChI=1S/C9H14N2/c1-5-9-6(2)7(3)10-11-8(9)4/h5H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.17 | Datawarrior | 1 » 0 |
| 5.17 | OCHEM | 1 » 0 |
| 5.17 | QSARToolbox | 1 » 0 |
| 5.17 | QSARToolbox | 1 » 0 |
| 5.17 | OCHEM | 1 » 0 |