Compound Detail
CHEMBL481189
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 | CHEMBL481189 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XXRGLZUCVWZDBP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
467.6
MW (Da)
6.34
ALogP
5
HBA
2
HBD
61.5
PSA (Ų)
0.33
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor CHEMBL206 | IC50 | 7.7 | 7.7 | 20.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor | IC50 | = | 20.0 | nM | 7.7 | Antagonist activity at human ERalpha receptor expressed in HEC1 cells assessed a... | 19014882 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19014882 | 10.1016/j.bmcl.2008.11.006 | Estrogen receptor | 2 |
| 19014882 | 10.1016/j.bmcl.2008.11.006 | Estrogen receptor beta | 1 |
| 19014882 | 10.1016/j.bmcl.2008.11.006 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine