Molecule ID: mol15346
SMILES: Nc1ccc(S(=O)(=O)Nc2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1
InChI: InChI=1S/C15H13N5O4S/c16-11-5-7-12(8-6-11)25(23,24)18-15-9-10-19(17-15)13-3-1-2-4-14(13)20(21)22/h1-10H,16H2,(H,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.00 | Datawarrior | 0 » -1 |
| 7.00 | OCHEM | 0 » -1 |
| 7.00 | QSARToolbox | 0 » -1 |