Molecule ID: mol25608

SMILES: FC(F)(c1nnn[nH]1)C(F)(F)C(F)(F)c1nnn[nH]1

InChI: InChI=1S/C5H2F6N8/c6-3(7,1-12-16-17-13-1)5(10,11)4(8,9)2-14-18-19-15-2/h(H,12,13,16,17)(H,14,15,18,19)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.70 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization