Molecule ID: mol33754

SMILES: CCN(CC)c1cccc(S(=O)(=O)O)c1

InChI: InChI=1S/C10H15NO3S/c1-3-11(4-2)9-6-5-7-10(8-9)15(12,13)14/h5-8H,3-4H2,1-2H3,(H,12,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.59 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization