Compound Detail
CHEMBL1950809
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1950809 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GHZHWDWADLAOIQ-CYBMUJFWSA-N |
3
Targets
9
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
239.3
MW (Da)
2.95
ALogP
3
HBA
2
HBD
64.2
PSA (Ų)
0.87
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 8 meas. best 9.12
Ki 1 meas. best 8.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor beta CHEMBL242 | EC50 | 9.12 | 8.3875 | 0.8 | 4 |
| Estrogen receptor beta CHEMBL3021 | Ki | 8.74 | 8.74 | 1.8 | 1 |
| Estrogen receptor CHEMBL206 | EC50 | 8.21 | 6.8075 | 6.2 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22122563 | 10.1021/jm201436k | Estrogen receptor beta | 12 |
| 22122563 | 10.1021/jm201436k | Estrogen receptor | 11 |
| 22122563 | 10.1021/jm201436k | Unchecked | 5 |
Data from ChEMBL 36 via Core Engine