Molecule ID: mol8275

SMILES: Clc1ncc2[nH]cnc2n1

InChI: InChI=1S/C5H3ClN4/c6-5-7-1-3-4(10-5)9-2-8-3/h1-2H,(H,7,8,9,10)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
0.69 IUPAC digitized pKa 1 » 0
8.21 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization