Molecule ID: mol35360

SMILES: Cc1cc(O)n2nc(N)c(N=Nc3ccc(Cl)cc3)c2n1

InChI: InChI=1S/C13H11ClN6O/c1-7-6-10(21)20-13(16-7)11(12(15)19-20)18-17-9-4-2-8(14)3-5-9/h2-6,21H,1H3,(H2,15,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.13 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization