Molecule ID: mol31471

SMILES: CC(=O)N(O)c1ccc(I)cc1

InChI: InChI=1S/C8H8INO2/c1-6(11)10(12)8-4-2-7(9)3-5-8/h2-5,12H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization