Molecule ID: mol11375

SMILES: CCOC(=O)c1ccc(C(=O)NN)cc1

InChI: InChI=1S/C10H12N2O3/c1-2-15-10(14)8-5-3-7(4-6-8)9(13)12-11/h3-6H,2,11H2,1H3,(H,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization