Molecule ID: mol19038

SMILES: COC1CCN(S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)CC1

InChI: InChI=1S/C12H18N2O5S2/c1-19-10-6-8-14(9-7-10)21(17,18)12-4-2-11(3-5-12)20(13,15)16/h2-5,10H,6-9H2,1H3,(H2,13,15,16)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.42 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization