Molecule ID: mol21096

SMILES: C1=CNC(c2ccncc2)N1

InChI: InChI=1S/C8H9N3/c1-3-9-4-2-7(1)8-10-5-6-11-8/h1-6,8,10-11H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.36 Baltruschat ChEMBL 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization