Molecule ID: mol23722

SMILES: CNc1cccc(Cl)c1

InChI: InChI=1S/C7H8ClN/c1-9-7-4-2-3-6(8)5-7/h2-5,9H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization