Compound Detail
CHEMBL285103
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Basic Information
| ChEMBL ID | CHEMBL285103 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FDRWMRLSMYCJTH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
330.3
MW (Da)
0.09
ALogP
7
HBA
2
HBD
119.2
PSA (Ų)
0.70
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosine A2 receptor CHEMBL2094257 | Ki | 6.37 | 6.37 | 430.0 | 1 |
| Adenosine receptor A1 CHEMBL318 | Ki | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosine A2 receptor | Ki | = | 430.0 | nM | 6.37 | Binding affinity against A2 adenosine receptor in guinea pig cerebral cortical s... | 2993622 |
| Adenosine receptor A1 | Ki | = | 500.0 | nM | 6.3 | Binding affinity towards adenosine A1 receptor in rat cerebral cortical membrane... | 2993622 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2993622 | 10.1021/jm00147a038 | Adenosine receptor A1 | 1 |
| 2993622 | 10.1021/jm00147a038 | Adenosine A2 receptor | 1 |
| 2993622 | 10.1021/jm00147a038 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine