Compound Detail
CHEMBL379527
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Basic Information
| ChEMBL ID | CHEMBL379527 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HFBFCDLZAKZWOX-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
250.3
MW (Da)
3.04
ALogP
3
HBA
1
HBD
38.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL3072 | IC50 | 7.54 | 7.54 | 29.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | IC50 | = | 29.0 | nM | 7.54 | Inhibition of rat AR-mediated reporter gene expression in COS7 cells | 16603353 |
| Androgen receptor | IC50 | = | 29.0 | nM | 7.54 | Binding affinity to rat Androgen receptor in African green monkey COS-7 cells me... | 35786895 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16603353 | 10.1016/j.bmcl.2006.03.047 | Androgen receptor | 2 |
| 35786895 | 10.1021/acs.jmedchem.2c00716 | Androgen receptor | 1 |
Data from ChEMBL 36 via Core Engine