Molecule ID: mol24701

SMILES: C1COCCN2CCOCCOCCOCCN(CCOCCO1)CCOCCOCC2

InChI: InChI=1S/C22H44N2O8/c1-7-25-13-14-26-8-2-24-5-11-29-17-21-31-19-15-27-9-3-23(1)4-10-28-16-20-32-22-18-30-12-6-24/h1-22H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization