Molecule ID: mol28047

SMILES: CC(=O)c1ccc(/N=C/N(C)C)cc1

InChI: InChI=1S/C11H14N2O/c1-9(14)10-4-6-11(7-5-10)12-8-13(2)3/h4-8H,1-3H3/b12-8+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization