Molecule ID: mol28645

SMILES: CC(C)(C)NC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C11H15N3O5S/c1-11(2,3)12-10(15)13-20(18,19)9-6-4-8(5-7-9)14(16)17/h4-7H,1-3H3,(H2,12,13,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization