Molecule ID: mol15299
SMILES: O=[N+]([O-])c1ccc2[nH]c(-c3ccco3)nc2c1
InChI: InChI=1S/C11H7N3O3/c15-14(16)7-3-4-8-9(6-7)13-11(12-8)10-2-1-5-17-10/h1-6H,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.64 | Datawarrior | 1 » 0 |
| 2.64 | OCHEM | 1 » 0 |
| 2.64 | QSARToolbox | 1 » 0 |