Molecule ID: mol4851
SMILES: Nc1nc(C(F)(F)F)c2[nH]c(C(F)(F)F)nc2n1
InChI: InChI=1S/C7H3F6N5/c8-6(9,10)2-1-3(18-5(14)16-2)17-4(15-1)7(11,12)13/h(H3,14,15,16,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.30 | IUPAC digitized pKa | 1 » 0 |
| 5.02 | IUPAC digitized pKa | 0 » -1 |