Compound Detail
CHEMBL487836
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 | CHEMBL487836 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PZEJODHBRWCCMY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
472.0
MW (Da)
3.94
ALogP
8
HBA
2
HBD
83.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C-C chemokine receptor type 4 CHEMBL2414 | IC50 | 7.01 | 7.01 | 98.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C-C chemokine receptor type 4 | IC50 | = | 98.0 | nM | 7.01 | Antagonist activity at human CCR4 receptor by [35S]GTPgammaS binding assay | 18694645 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18694645 | 10.1016/j.bmc.2008.07.062 | C-C chemokine receptor type 4 | 4 |
Data from ChEMBL 36 via Core Engine