Compound Detail
CHEMBL2115108
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL2115108 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJBINGOMISUGEU-IBGZPJMESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
334.4
MW (Da)
3.94
ALogP
4
HBA
0
HBD
51.7
PSA (Ų)
0.73
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase CHEMBL215 | IC50 | 4.71 | 4.71 | 19600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase | IC50 | = | 19600.0 | nM | 4.71 | Ability to inhibit 5-lipoxygenase in guinea pig | 3669017 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3669017 | 10.1021/jm00394a026 | Cavia porcellus | 11 |
| 3669017 | 10.1021/jm00394a026 | Cysteinyl leukotriene receptor | 3 |
| 3669017 | 10.1021/jm00394a026 | Polyunsaturated fatty acid 5-lipoxygenase | 1 |
| 3669017 | 10.1021/jm00394a026 | Cyclooxygenase | 1 |
Data from ChEMBL 36 via Core Engine