Compound Detail
CHEMBL606082
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 | CHEMBL606082 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FUODJAMHKWCPRT-MSOSYJBYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
373.4
MW (Da)
-0.40
ALogP
10
HBA
4
HBD
148.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosine A2 receptor CHEMBL2094257 | EC50 | 6.38 | 6.38 | 416.9 | 1 |
| Adenosine receptor A1 CHEMBL2304404 | EC50 | 5.2 | 5.2 | 6309.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosine A2 receptor | EC50 | = | 416.87 | nM | 6.38 | Concentration required for coronary arteries vasodilation at the Adenosine A2 re... | 2016708 |
| Adenosine receptor A1 | EC50 | = | 6309.57 | nM | 5.2 | Effective concentration required for prolongation of the stimulus-QRS interval b... | 2016708 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2016708 | 10.1021/jm00108a015 | Adenosine receptor A1 | 1 |
| 2016708 | 10.1021/jm00108a015 | Adenosine A2 receptor | 1 |
| 2016708 | 10.1021/jm00108a015 | Adenosine receptors; A1 & A2 | 1 |
Data from ChEMBL 36 via Core Engine