Molecule ID: mol13234

SMILES: CN(C)C(=O)/C=C(\O)c1ccncc1

InChI: InChI=1S/C10H12N2O2/c1-12(2)10(14)7-9(13)8-3-5-11-6-4-8/h3-7,13H,1-2H3/b9-7-

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization