Molecule ID: mol29641

SMILES: NCc1sc2ccccc2c1Br

InChI: InChI=1S/C9H8BrNS/c10-9-6-3-1-2-4-7(6)12-8(9)5-11/h1-4H,5,11H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization