Molecule ID: mol12781

SMILES: O=C(O)c1nc2ccccc2[nH]1

InChI: InChI=1S/C8H6N2O2/c11-8(12)7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10)(H,11,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
0.40 Datawarrior 1 » 0
0.40 OCHEM 1 » 0
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Charge States and Microspecies Visualization