Molecule ID: mol3446

SMILES: CNC(=N)Nc1ccc(Cl)cc1

InChI: InChI=1S/C8H10ClN3/c1-11-8(10)12-7-4-2-6(9)3-5-7/h2-5H,1H3,(H3,10,11,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.85 IUPAC digitized pKa 1 » 0
11.15 OCHEM 1 » 0
11.15 OCHEM 1 » 0
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Charge States and Microspecies Visualization