Molecule ID: mol14670
SMILES: COCc1nc2c(n1C)C(=O)c1ncnc(O)c1C2=O
InChI: InChI=1S/C12H10N4O4/c1-16-5(3-20-2)15-8-9(16)11(18)7-6(10(8)17)12(19)14-4-13-7/h4H,3H2,1-2H3,(H,13,14,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.17 | Datawarrior | 0 » -1 |
| 6.17 | OCHEM | 0 » -1 |