Molecule ID: mol11740
SMILES: C=C(C)CC1(CC(C)C)C(=O)NC(=O)NC1=O
InChI: InChI=1S/C12H18N2O3/c1-7(2)5-12(6-8(3)4)9(15)13-11(17)14-10(12)16/h8H,1,5-6H2,2-4H3,(H2,13,14,15,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.79 | QSARToolbox | 0 » -1 |
| 7.79 | QSARToolbox | 0 » -1 |
| 7.79 | IUPAC digitized pKa | 0 » -1 |