Molecule ID: mol34586

SMILES: c1ccc(CN2CCNCCNCCNCC2)c(CN2CCNCCNCCNCC2)c1

InChI: InChI=1S/C24H46N8/c1-2-4-24(22-32-19-15-29-11-7-26-8-12-30-16-20-32)23(3-1)21-31-17-13-27-9-5-25-6-10-28-14-18-31/h1-4,25-30H,5-22H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.40 QSARToolbox 6 » 5
2.76 QSARToolbox 6 » 5
3.34 QSARToolbox 6 » 5
3.62 QSARToolbox 6 » 5
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization