Molecule ID: mol24202
SMILES: CC(CNc1c([N+](=O)[O-])cc(F)cc1[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1S/C9H8FN5O8/c1-9(14(20)21,15(22)23)4-11-8-6(12(16)17)2-5(10)3-7(8)13(18)19/h2-3,11H,4H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -6.29 | AttenGpKa training set | 1 » 0 |