Molecule ID: mol7416

SMILES: CNc1ncc(-c2ccc(N(C)C)cc2)cn1

InChI: InChI=1S/C13H16N4/c1-14-13-15-8-11(9-16-13)10-4-6-12(7-5-10)17(2)3/h4-9H,1-3H3,(H,14,15,16)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.82 IUPAC digitized pKa 2 » 1
4.72 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization