Interaction Scheme
Molecule
Doxylamine
c = 0.0 — 25.0 µM
Host
Acyclic sodium 3,3'-(naphthalene-1,4-diylbis(ox...
c = 3.0 µM
Indicator
Europium trinitrate hexahydrate
c = 300.0 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 1.10⋅105 | ± 1980.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -28.78 | ± 0.04 | -6.88 | ± 0.01 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Competitive | |||
| Assay Type: | Competitive Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 301.0 nm | ||
| 𝛌em | = | 370.0 nm | ||
Detailed information about the solvation.
| Solvent System | Complex Mixture | |
| Solvents | water | 100.0 % |
| Additives | hydrochloric acid | |
| pH | 3.0 |
Please find here information about the dataset this interaction is part of.
| Citation: |
T. Minami, N. A. Esipenko, B. Zhang, L. Isaacs, P. Anzenbacher, A. Akdeniz, SupraBank 2024, Multianalyte Sensing of Addictive Over-the-Counter (OTC) Drugs (dataset). https://doi.org/10.34804/supra.2021092860 |
| Link: | https://doi.org/10.34804/supra.2021092860 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
T. Minami, N. A. Esipenko, A. Akdeniz, B. Zhang, L. Isaacs, P. Anzenbacher Jr., J. Am. Chem. Soc. 2013, 135, 15238–15243. |
| Link: | https://doi.org/10.1021/ja407722a |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of Doxylamine (0.0001818181818181818 M) and Acyclic sodium 3,3'-(naphthalene-1,4-diylbis(oxy))bis(propane-1-sulfonate) Cucurbituril (0 — 0.0003636363636363636 M).
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