Molecule ID: mol35854

SMILES: CCOC(=O)C1Cc2c([nH]c3ccccc23)CCN(CC)C1

InChI: InChI=1S/C18H24N2O2/c1-3-20-10-9-17-15(11-13(12-20)18(21)22-4-2)14-7-5-6-8-16(14)19-17/h5-8,13,19H,3-4,9-12H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.25 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization