Molecule ID: mol7868

SMILES: CCc1cccc2c(N)nc(N)nc12

InChI: InChI=1S/C10H12N4/c1-2-6-4-3-5-7-8(6)13-10(12)14-9(7)11/h3-5H,2H2,1H3,(H4,11,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization