Molecule ID: mol20342
SMILES: Cc1cc([N+](=O)[O-])ccc1N(C)c1nn[nH]n1
InChI: InChI=1S/C9H10N6O2/c1-6-5-7(15(16)17)3-4-8(6)14(2)9-10-12-13-11-9/h3-5H,1-2H3,(H,10,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.02 | OCHEM | 0 » -1 |
| 5.02 | Baltruschat ChEMBL | 0 » -1 |