𝜈 | Molecule 1 : 1 Host | ||
Ka = | 4956.0 | M-1 | |
Kd = | |||
logKa = | |||
T | 25.0 °C | ||
Energy | kJ mol-1 | kcal mol-1 | |||
---|---|---|---|---|---|
ΔG | = | -21.09 | -5.04 |
Detection Method: | Direct | ||
Assay Type: | Direct Binding Assay | ||
Technique: | Nuclear Magnetic Resonance | ||
Nucleus | 1H |
Solvent System | Buffer System | 10 mM deuterated phosphate pD-11.3 |
Solvents | Deuterium Oxide | |
Additives | Disodium phosph... | 8.0 mM |
Trisodium phosp... | 2.0 mM | |
Source of Concentration | ||
Total concentration | 10.0 mM | |
pH | 11.3 |
Citation: |
M. R. Sullivan, P. Sokkalingam, T. Nguyen, J. P. Donahue, B. Gibb, SupraBank 2024, Binding of carboxylate and trimethylammonium salts to octa-acid and TEMOA deep-cavity cavitands (dataset). https://doi.org/10.34804/supra.2021092829 |
Link: | https://doi.org/10.34804/supra.2021092829 |
Export: | BibTex | RIS | EndNote |
Citation: |
M. R. Sullivan, P. Sokkalingam, T. Nguyen, J. P. Donahue, B. C. Gibb, J Comput Aided Mol Des 2016, 31, 21–28. |
Link: | https://doi.org/10.1007/s10822-016-9925-0 |
Export: | BibTex | RIS | EndNote | |
The plot depicts the binding isotherm simulation of a 1:1 interaction of 4-Cyanobenzoic acid (0.004035512510088781 M) and TEMOA (0 — 0.008071025020177562 M).