Molecule ID: mol14976
SMILES: CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
InChI: InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.18 | Datawarrior | 1 » 0 |
| 0.18 | QSARToolbox | 1 » 0 |
| 0.18 | OCHEM | 1 » 0 |