Molecule ID: mol7011
SMILES: Cc1ncc(C(N)=O)c(N)n1
InChI: InChI=1S/C6H8N4O/c1-3-9-2-4(6(8)11)5(7)10-3/h2H,1H3,(H2,8,11)(H2,7,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.97 | QSARToolbox | 1 » 0 |
| 4.97 | IUPAC digitized pKa | 1 » 0 |
| 4.97 | OCHEM | 1 » 0 |