Molecule ID: mol24822

SMILES: CC(C)(C)/C=N/NC(=O)C(F)(F)F

InChI: InChI=1S/C7H11F3N2O/c1-6(2,3)4-11-12-5(13)7(8,9)10/h4H,1-3H3,(H,12,13)/b11-4+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization