Molecule ID: mol9914
SMILES: CN1C(=O)C(C)(C)NC1=S
InChI: InChI=1S/C6H10N2OS/c1-6(2)4(9)8(3)5(10)7-6/h1-3H3,(H,7,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.80 | IUPAC digitized pKa | 0 » -1 |
| 10.80 | Datawarrior | 0 » -1 |
| 10.80 | OCHEM | 0 » -1 |
| 10.80 | AttenGpKa training set | 0 » -1 |
| 10.80 | QSARToolbox | 0 » -1 |