Compound Detail
CHEMBL82307
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Basic Information
| ChEMBL ID | CHEMBL82307 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CDXXFXPTTWOXBC-JOCHJYFZSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
318.4
MW (Da)
4.41
ALogP
2
HBA
0
HBD
26.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | Ki | 7.27 | 7.27 | 54.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | Ki | = | 54.0 | nM | 7.27 | Displacement of [3H]DHT from human Androgen receptor | 12036351 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12036351 | 10.1021/jm0105530 | Glucocorticoid receptor | 2 |
| 12036351 | 10.1021/jm0105530 | Progesterone receptor | 2 |
| 12036351 | 10.1021/jm0105530 | Androgen receptor | 1 |
| 12036351 | 10.1021/jm0105530 | Estrogen receptor | 1 |
| 12036351 | 10.1021/jm0105530 | Estrogen receptor beta | 1 |
| 12036351 | 10.1021/jm0105530 | Mineralocorticoid receptor | 1 |
Data from ChEMBL 36 via Core Engine