Molecule ID: mol34016

SMILES: Cc1[nH]c(=O)[nH]c(=O)c1Br

InChI: InChI=1S/C5H5BrN2O2/c1-2-3(6)4(9)8-5(10)7-2/h1H3,(H2,7,8,9,10)

Experimental Macro pKa Values

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