Compound Detail
CHEMBL506908
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 | CHEMBL506908 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HZBVRTIFGBGPJJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
333.4
MW (Da)
1.13
ALogP
6
HBA
1
HBD
77.1
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosine receptor A3 CHEMBL256 | Ki | 7.82 | 7.82 | 15.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosine receptor A3 | Ki | = | 15.0 | nM | 7.82 | Displacement of [3H]MRE3008F20 from human cloned adenosine A3 receptor expressed... | 19006671 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19006671 | 10.1016/j.bmc.2008.10.049 | Adenosine receptor A1 | 1 |
| 19006671 | 10.1016/j.bmc.2008.10.049 | Adenosine receptor A2a | 1 |
| 19006671 | 10.1016/j.bmc.2008.10.049 | Adenosine receptor A2b | 1 |
| 19006671 | 10.1016/j.bmc.2008.10.049 | Adenosine receptor A3 | 1 |
Data from ChEMBL 36 via Core Engine