Molecule ID: mol35047

SMILES: CC(C)(NCCNCCNC(C)(C)P(=O)(O)O)P(=O)(O)O

InChI: InChI=1S/C10H27N3O6P2/c1-9(2,20(14,15)16)12-7-5-11-6-8-13-10(3,4)21(17,18)19/h11-13H,5-8H2,1-4H3,(H2,14,15,16)(H2,17,18,19)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization