Compound Detail
CHEMBL2251976
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Basic Information
| ChEMBL ID | CHEMBL2251976 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QNSLBNMSETUZJN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
4
Publications
0
Known Names
Molecular Properties
235.7
MW (Da)
0.98
ALogP
3
HBA
1
HBD
64.3
PSA (Ų)
0.61
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nicotinic acetylcholine receptor alpha 5 subunit CHEMBL2366408 | Ki | 7.77 | 7.77 | 17.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 24.0 | hr | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nicotinic acetylcholine receptor alpha 5 subunit | Ki | = | 17.0 | nM | 7.77 | Displacement of [3H]imidacloprid from nicotinic acetylcholine receptor in Musca ... | 12720388 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12720388 | 10.1021/jf021185r | Aphis gossypii | 3 |
| 20718435 | 10.1021/jf101824y | No relevant target | 1 |
| 20718435 | 10.1021/jf101824y | Nephotettix cincticeps | 1 |
| 12720388 | 10.1021/jf021185r | Nicotinic acetylcholine receptor alpha 5 subunit | 1 |
Data from ChEMBL 36 via Core Engine