Molecule ID: mol6822

SMILES: Clc1cc[nH]n1

InChI: InChI=1S/C3H3ClN2/c4-3-1-2-5-6-3/h1-2H,(H,5,6)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.48 AttenGpKa training set 1 » 0
-0.48 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization