Molecule ID: mol14590
SMILES: O=[N+]([O-])c1cc([N+](=O)[O-])c2nnn(O)c2c1
InChI: InChI=1S/C6H3N5O5/c12-9-4-1-3(10(13)14)2-5(11(15)16)6(4)7-8-9/h1-2,12H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.60 | Datawarrior | 0 » -1 |
| 1.60 | OCHEM | 0 » -1 |
| 1.60 | QSARToolbox | 0 » -1 |