Molecule ID: mol7380

SMILES: Cc1nc(O)cc(O)n1

InChI: InChI=1S/C5H6N2O2/c1-3-6-4(8)2-5(9)7-3/h2H,1H3,(H2,6,7,8,9)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
0.21 QSARToolbox 1 » 0
6.35 QSARToolbox 0 » -1
6.35 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization