Molecule ID: mol36206

SMILES: O=C(N/N=C/c1ccc(Cl)cc1)c1ccncc1

InChI: InChI=1S/C13H10ClN3O/c14-12-3-1-10(2-4-12)9-16-17-13(18)11-5-7-15-8-6-11/h1-9H,(H,17,18)/b16-9+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.67 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization