Compound Detail
CHEMBL234394
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Basic Information
| ChEMBL ID | CHEMBL234394 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SFJHXIKHAFLZTL-MFKMUULPSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
358.8
MW (Da)
0.82
ALogP
6
HBA
1
HBD
107.7
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.56
Ki 1 meas. best 7.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | Ki | 7.44 | 7.44 | 36.0 | 1 |
| Androgen receptor CHEMBL3056 | IC50 | 6.56 | 6.56 | 278.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | Ki | = | 36.0 | nM | 7.44 | Displacement of [3H]DHT from human androgen receptor in MDA453 cells | 17574413 |
| Androgen receptor | IC50 | = | 278.0 | nM | 6.56 | Antagonist activity at androgen receptor in mouse C2C12 cells by receptor transa... | 17574413 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17574413 | 10.1016/j.bmcl.2007.06.007 | Androgen receptor | 3 |
Data from ChEMBL 36 via Core Engine