Compound Detail
CHEMBL97343
5-AZIDOIMIDACLOPRID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL97343 |
| Name | 5-AZIDOIMIDACLOPRID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NBUHPUCUZWZCRU-UHFFFAOYSA-N |
5
Targets
6
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
296.7
MW (Da)
1.63
ALogP
4
HBA
1
HBD
132.4
PSA (Ų)
0.23
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 6 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nicotinic acetylcholine receptor CHEMBL3350224 | Ki | 9.0 | 9.0 | 1.0 | 1 |
| Neuronal acetylcholine receptor subunit alpha-4 CHEMBL307 | Ki | 8.36 | 8.36 | 4.4 | 1 |
| Nicotinic acetylcholine receptor CHEMBL3350223 | Ki | 7.82 | 7.82 | 15.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 7.62 | 7.49 | 24.0 | 2 |
| Neuronal acetylcholine receptor; alpha4/beta2 CHEMBL1907589 | Ki | 6.47 | 6.47 | 340.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nicotinic acetylcholine receptor | Ki | = | 1.0 | nM | 9.0 | Binding affinity for nAChR with [3H]imidacloprid in Myzus persicae | 11150171 |
| Neuronal acetylcholine receptor subunit alpha-4 | Ki | = | 4.4 | nM | 8.36 | Binding affinity for nAChR with [3H]-nicotine in rat alpha4 beta2 membranes | 11150171 |
| Nicotinic acetylcholine receptor | Ki | = | 15.0 | nM | 7.82 | Binding affinity for nAChR with [3H]imidacloprid in Drosophila | 11150171 |
| Unchecked | Ki | = | 24.0 | nM | 7.62 | Potency to displace [3H]IMI binding to Nicotinic acetylcholine receptor from Dro... | 12061885 |
| Unchecked | Ki | = | 44.0 | nM | 7.36 | Binding affinity for nAChR with [3H]nicotine in rat brain | 11150171 |
| Neuronal acetylcholine receptor; alpha4/beta2 | Ki | = | 340.0 | nM | 6.47 | Potency to displace [3H]nicotine binding to Nicotinic acetylcholine receptor alp... | 12061885 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11150171 | 10.1021/jm000240p | Nicotinic acetylcholine receptor | 2 |
| 12061885 | 10.1021/jm010508s | Unchecked | 2 |
| 11150171 | 10.1021/jm000240p | Unchecked | 1 |
| 11150171 | 10.1021/jm000240p | Neuronal acetylcholine receptor subunit alpha-4 | 1 |
| 12061885 | 10.1021/jm010508s | Neuronal acetylcholine receptor; alpha4/beta2 | 1 |
| - | 10.1584/jpestics.31.110 | Periplaneta americana | 1 |
Data from ChEMBL 36 via Core Engine