Molecule ID: mol7264

SMILES: Nc1ncc(-c2cccc(Cl)c2)c(N)n1

InChI: InChI=1S/C10H9ClN4/c11-7-3-1-2-6(4-7)8-5-14-10(13)15-9(8)12/h1-5H,(H4,12,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.70 QSARToolbox 1 » 0
6.70 IUPAC digitized pKa 1 » 0
6.70 OCHEM 1 » 0
6.70 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization