Compound Detail
CHEMBL1651148
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Basic Information
| ChEMBL ID | CHEMBL1651148 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CQXOEKVDLFCWTB-ZENOOKHLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
244.3
MW (Da)
3.65
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor beta CHEMBL242 | EC50 | 6.6 | 6.6 | 251.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor beta | EC50 | = | 251.19 | nM | 6.6 | Agonist activity at ER-beta (unknown origin) transfected in HEK293T cells after ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C3MD00194F | Estrogen receptor beta | 2 |
| - | 10.1039/C3MD00194F | Estrogen receptor | 2 |
| 21190382 | 10.1021/jm100513m | Estrogen receptor | 1 |
| 21190382 | 10.1021/jm100513m | Estrogen receptor beta | 1 |
| 21190382 | 10.1021/jm100513m | Unchecked | 1 |
| - | 10.1039/C3MD00194F | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine