Interaction Scheme
Molecule
2,7-bis(2-(trimethyl-azaneyl)ethyl)pyrene-1,3,6...
c = 5.0 µM
Host
CB7
c = 0.0 — 15.0 µM
Cofactor
2,7-bis(2-(trimethyl-azaneyl)ethyl)pyrene-1,3,6...
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 1.06⋅105 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -28.68 | -6.85 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Associative Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 391.0 nm | ||
Detailed information about the solvation.
| Solvent System | Single Solvent |
| Solvent | water |
Please find here information about the dataset this interaction is part of.
| Citation: |
X. Zhao, F. Liu, Z. Zhao, H. Karoui, D. Bardelang, O. Ouari, S. Liu, SupraBank 2024, Effects of cucurbit[n]uril (n = 7, 8, 10) hosts on the formation and stabilization of a naphthalenediimide (NDI) radical anion (dataset). https://doi.org/10.34804/supra.20210928149 |
| Link: | https://doi.org/10.34804/supra.20210928149 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
X. Zhao, F. Liu, Z. Zhao, H. Karoui, D. Bardelang, O. Ouari, S. Liu, Org. Biomol. Chem. 2018, 16, 3809–3815. |
| Link: | https://doi.org/10.1039/C8OB00664D |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 2,7-bis(2-(trimethyl-azaneyl)ethyl)pyrene-1,3,6,8(2H,7H)-tetraone (0.00018867924528301886 M) and CB7 (0 — 0.0003773584905660377 M).
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