Molecule ID: mol6587

SMILES: Brc1ccc(Br)c(Br)n1

InChI: InChI=1S/C5H2Br3N/c6-3-1-2-4(7)9-5(3)8/h1-2H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-3.81 OCHEM 1 » 0
-3.81 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization