Compound Detail
CHEMBL340295
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
CN(CCc1ccccc1)C(=O)Cn1cc(C(=O)c2cccc(C(=O)O)c2)c2cc(OCc3ccccc3)ccc21
Basic Information
| ChEMBL ID | CHEMBL340295 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LULYDPFHEYWAJZ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
546.6
MW (Da)
5.85
ALogP
5
HBA
1
HBD
88.8
PSA (Ų)
0.21
QED
2
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leukotriene B4 receptor CHEMBL2095160 | IC50 | 8.07 | 7.995 | 8.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leukotriene B4 receptor | IC50 | = | 8.5 | nM | 8.07 | LTB4 receptor binding from radioligand binding assay using human intact neutroph... | 8809164 |
| Leukotriene B4 receptor | IC50 | = | 12.0 | nM | 7.92 | LTB4 receptor binding from radioligand binding assay using guinea pig spleen cel... | 8809164 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8809164 | 10.1021/jm950699x | Leukotriene B4 receptor | 2 |
Data from ChEMBL 36 via Core Engine