Molecule ID: mol16246

SMILES: NC1CCN(OCc2ccccc2)C1=O

InChI: InChI=1S/C11H14N2O2/c12-10-6-7-13(11(10)14)15-8-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.20 Baltruschat ChEMBL 1 » 0
6.60 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization