Compound Detail
CHEMBL138753
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Basic Information
| ChEMBL ID | CHEMBL138753 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OKQVQYKHHUXADN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
378.5
MW (Da)
4.54
ALogP
4
HBA
2
HBD
59.6
PSA (Ų)
0.82
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glucocorticoid receptor CHEMBL2034 | Ki | 5.5 | 5.5 | 3200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glucocorticoid receptor | Ki | = | 3200.0 | nM | 5.5 | Binding affinity towards glucocorticoid receptor (GR) by displacing [3H]dexameth... | 11728194 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11728194 | 10.1021/jm010367u | Glucocorticoid receptor | 5 |
| 11728194 | 10.1021/jm010367u | Progesterone receptor | 1 |
Data from ChEMBL 36 via Core Engine