Molecule ID: mol2877

SMILES: CS(=O)(=O)Nn1c(=O)[nH]c2cc(C(F)(F)F)c(N)cc2c1=O

InChI: InChI=1S/C10H9F3N4O4S/c1-22(20,21)16-17-8(18)4-2-6(14)5(10(11,12)13)3-7(4)15-9(17)19/h2-3,16H,14H2,1H3,(H,15,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.60 Novartis -1 » -2
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Charge States and Microspecies Visualization