Molecule ID: mol36833

SMILES: CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)C(=O)C(CCCCN)NC(=O)CCCCC[N+](C)(C)C

InChI: InChI=1S/C47H96N4O2/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-36-42-50(43-37-31-29-27-25-23-21-19-17-15-13-11-9-7-2)47(53)45(39-34-35-41-48)49-46(52)40-33-32-38-44-51(3,4)5/h45H,6-44,48H2,1-5H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.30 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization