Molecule ID: mol28638

SMILES: CCCCNC(=O)NS(=O)(=O)c1ccc(N(C)C)cc1

InChI: InChI=1S/C13H21N3O3S/c1-4-5-10-14-13(17)15-20(18,19)12-8-6-11(7-9-12)16(2)3/h6-9H,4-5,10H2,1-3H3,(H2,14,15,17)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.85 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization