Compound Detail
CHEMBL488855
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Basic Information
| ChEMBL ID | CHEMBL488855 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MZMSTOZENSISQX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
525.1
MW (Da)
5.04
ALogP
8
HBA
1
HBD
66.0
PSA (Ų)
0.44
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C-C chemokine receptor type 4 CHEMBL2414 | IC50 | 6.89 | 6.89 | 130.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C-C chemokine receptor type 4 | IC50 | = | 130.0 | nM | 6.89 | 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