Molecule ID: mol26599

SMILES: Nc1ccc2ccc3cccnc3c2n1

InChI: InChI=1S/C12H9N3/c13-10-6-5-9-4-3-8-2-1-7-14-11(8)12(9)15-10/h1-7H,(H2,13,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization