Molecule ID: mol35454

SMILES: CCCOc1cccc(C(=O)OCCN(CC)CC)c1

InChI: InChI=1S/C16H25NO3/c1-4-11-19-15-9-7-8-14(13-15)16(18)20-12-10-17(5-2)6-3/h7-9,13H,4-6,10-12H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization