Interaction Scheme
Molecule
Neutral Red protonated
c = 3.0 µM
Host
sCx4
c = 0.0 — 310.0 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 6.60⋅105 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -33.22 | -7.94 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Direct Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 520.0 nm | ||
| 𝛌em | = | 637.0 nm | ||
Detailed information about the solvation.
| Solvent System | Complex Mixture |
| Solvents | water |
| Additives | hydrochloric acid |
| Perchloric acid | |
| pH | 5.0 |
Please find here information about the dataset this interaction is part of.
| Citation: |
J. Mohanty, A. C. Bhasikuttan, R. Khurana, N. Barooah, M. N. Shinde, SupraBank 2024, Metal ion-induced supramolecular pKa tuning and fluorescence regeneration of a p-sulfonatocalixarene encapsulated neutral red dye (dataset). https://doi.org/10.34804/supra.20210928367 |
| Link: | https://doi.org/10.34804/supra.20210928367 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
M. N. Shinde, R. Khurana, N. Barooah, A. C. Bhasikuttan, J. Mohanty, Org. Biomol. Chem. 2017, 15, 3975–3984. |
| Link: | https://doi.org/10.1039/c7ob00506g |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of Neutral Red protonated (3.0303030303030302e-05 M) and sCx4 (0 — 6.0606060606060605e-05 M).
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