Compound Detail
CHEMBL4582170
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Basic Information
| ChEMBL ID | CHEMBL4582170 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VOIMUUBLILODJY-MDZDMXLPSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
284.3
MW (Da)
2.90
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase CHEMBL215 | IC50 | 6.05 | 6.05 | 890.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase | IC50 | = | 890.0 | nM | 6.05 | Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene form... | 31260889 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31260889 | 10.1016/j.ejmech.2019.06.060 | Polyunsaturated fatty acid 5-lipoxygenase | 3 |
Data from ChEMBL 36 via Core Engine