Molecule ID: mol14305

SMILES: CCN(CC)S(=O)(=O)c1ccc(N)cc1

InChI: InChI=1S/C10H16N2O2S/c1-3-12(4-2)15(13,14)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.75 Datawarrior 1 » 0
1.75 OCHEM 1 » 0
1.75 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization