Compound Detail
CHEMBL232023
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Basic Information
| ChEMBL ID | CHEMBL232023 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GTJKIXUWJLVLLU-GIJQJNRQSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
284.3
MW (Da)
3.59
ALogP
4
HBA
2
HBD
57.8
PSA (Ų)
0.43
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor beta CHEMBL242 | IC50 | 8.09 | 8.09 | 8.1 | 1 |
| Estrogen receptor CHEMBL206 | IC50 | 6.53 | 6.53 | 298.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor beta | IC50 | = | 8.05 | nM | 8.09 | Inhibition of human ERbeta by radioligand binding assay | 17188490 |
| Estrogen receptor | IC50 | = | 298.0 | nM | 6.53 | Inhibition of human ERalpha by radioligand binding assay | 17188490 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17188490 | 10.1016/j.bmcl.2006.11.066 | Estrogen receptor beta | 1 |
| 17188490 | 10.1016/j.bmcl.2006.11.066 | Estrogen receptor | 1 |
| 17188490 | 10.1016/j.bmcl.2006.11.066 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine