Molecule ID: mol24402

SMILES: CNC(O)C(C)C

InChI: InChI=1S/C5H13NO/c1-4(2)5(7)6-3/h4-7H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization