Molecule ID: mol9646

SMILES: O=C(O)c1ccc(O)nc1

InChI: InChI=1S/C6H5NO3/c8-5-2-1-4(3-7-5)6(9)10/h1-3H,(H,7,8)(H,9,10)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
-0.64 AttenGpKa training set 1 » 0
3.82 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization