Compound Detail
CHEMBL271265
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Basic Information
| ChEMBL ID | CHEMBL271265 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZBNHYUPVZXORPI-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
526.5
MW (Da)
5.76
ALogP
5
HBA
2
HBD
71.1
PSA (Ų)
0.29
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL3910 | IC50 | 5.68 | 5.68 | 2090.0 | 1 |
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL4235 | IC50 | 5.45 | 5.45 | 3570.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 | IC50 | = | 2090.0 | nM | 5.68 | Inhibition of mouse 11beta-HSD1 | 18242087 |
| 11-beta-hydroxysteroid dehydrogenase 1 | IC50 | = | 3570.0 | nM | 5.45 | Inhibition of human 11beta-HSD1 | 18242087 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18242087 | 10.1016/j.bmcl.2008.01.020 | 11-beta-hydroxysteroid dehydrogenase 1 | 2 |
| 18242087 | 10.1016/j.bmcl.2008.01.020 | 11-beta-hydroxysteroid dehydrogenase type 2 | 1 |
Data from ChEMBL 36 via Core Engine