Molecule ID: mol2396

SMILES: Cc1c(Br)cc(N)cc1Br

InChI: InChI=1S/C7H7Br2N/c1-4-6(8)2-5(10)3-7(4)9/h2-3H,10H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.87 OCHEM 1 » 0
2.87 IUPAC digitized pKa 1 » 0
2.87 Datawarrior 1 » 0
2.87 OCHEM 1 » 0
2.87 Hunt 1 » 0
2.87 OCHEM 1 » 0
2.87 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization