Compound Detail
CHEMBL110327
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Basic Information
| ChEMBL ID | CHEMBL110327 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | URUCGGAWDMUALV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
355.5
MW (Da)
3.60
ALogP
6
HBA
2
HBD
74.7
PSA (Ų)
0.34
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase CHEMBL215 | EC50 | 6.41 | 6.41 | 390.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase | EC50 | = | 390.0 | nM | 6.41 | In vitro inhibition of ionophore stimulated LTB4 release from human peripheral b... | 1324317 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1324317 | 10.1021/jm00095a012 | Polyunsaturated fatty acid 5-lipoxygenase | 1 |
| 1324317 | 10.1021/jm00095a012 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine