Molecule ID: mol17226

SMILES: CCC(C)CNC1=NS(=O)(=O)c2sc(Cl)cc2N1

InChI: InChI=1S/C10H14ClN3O2S2/c1-3-6(2)5-12-10-13-7-4-8(11)17-9(7)18(15,16)14-10/h4,6H,3,5H2,1-2H3,(H2,12,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.29 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization