Molecule ID: mol30972

SMILES: C#Cc1cc(I)c(O)c(I)c1

InChI: InChI=1S/C8H4I2O/c1-2-5-3-6(9)8(11)7(10)4-5/h1,3-4,11H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization