Molecule ID: mol7021

SMILES: CNc1cc(Cl)nc(N)n1

InChI: InChI=1S/C5H7ClN4/c1-8-4-2-3(6)9-5(7)10-4/h2H,1H3,(H3,7,8,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization