Molecule ID: mol25491

SMILES: Cc1nnnn1-c1cccc(Cl)c1

InChI: InChI=1S/C8H7ClN4/c1-6-10-11-12-13(6)8-4-2-3-7(9)5-8/h2-5H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-2.49 AttenGpKa training set 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization