Molecule ID: mol8124
SMILES: Nc1nc(N)c2nc(C(=O)O)cnc2n1
InChI: InChI=1S/C7H6N6O2/c8-4-3-5(13-7(9)12-4)10-1-2(11-3)6(14)15/h1H,(H,14,15)(H4,8,9,10,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.40 | IUPAC digitized pKa | 0 » -1 |
| 1.94 | IUPAC digitized pKa | 0 » -1 |
| 5.00 | IUPAC digitized pKa | 1 » 0 |
| 5.17 | IUPAC digitized pKa | 1 » 0 |