Molecule ID: mol25058

SMILES: ClCc1cccnc1

InChI: InChI=1S/C6H6ClN/c7-4-6-2-1-3-8-5-6/h1-3,5H,4H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.69 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization