Molecule ID: mol7222

SMILES: CNc1cc(Cl)n(C)c(=N)n1

InChI: InChI=1S/C6H9ClN4/c1-9-5-3-4(7)11(2)6(8)10-5/h3H,1-2H3,(H2,8,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization