Molecule ID: mol36013

SMILES: Cc1ncc(CNc2ccccc2)c(N)n1

InChI: InChI=1S/C12H14N4/c1-9-14-7-10(12(13)16-9)8-15-11-5-3-2-4-6-11/h2-7,15H,8H2,1H3,(H2,13,14,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization