Compound Detail
CHEMBL2269821
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Basic Information
| ChEMBL ID | CHEMBL2269821 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RUXHRNZZERQELK-WQLSENKSSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
258.8
MW (Da)
2.18
ALogP
5
HBA
0
HBD
52.3
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.25 | 7.25 | 56.0 | 1 |
| Acetylcholine receptor subunit beta-like 2 CHEMBL2366470 | IC50 | 7.03 | 7.03 | 94.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 56.0 | nM | 7.25 | Displacement of [3H]IMI from nicotinic acetylcholine receptor in Myzus persicae ... | 10936213 |
| Acetylcholine receptor subunit beta-like 2 | IC50 | = | 94.0 | nM | 7.03 | Displacement of [3H]IMI from nicotinic acetylcholine receptor in Drosophila mela... | 10936213 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10936213 | 10.1046/j.1471-4159.2000.751294.x | Acetylcholine receptor subunit beta-like 2 | 1 |
| 10936213 | 10.1046/j.1471-4159.2000.751294.x | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine