Molecule ID: mol9797
SMILES: CN(C)N=Cc1[nH]nnc1NC(N)=O
InChI: InChI=1S/C6H11N7O/c1-13(2)8-3-4-5(9-6(7)14)11-12-10-4/h3H,1-2H3,(H4,7,9,10,11,12,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.49 | IUPAC digitized pKa | 1 » 0 |
| 7.75 | IUPAC digitized pKa | 0 » -1 |