Compound Detail
CHEMBL34648
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Basic Information
| ChEMBL ID | CHEMBL34648 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GPRKJRWPCMWKLE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
322.8
MW (Da)
5.25
ALogP
2
HBA
2
HBD
40.5
PSA (Ų)
0.65
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Estrogen receptor CHEMBL2094114 | EC50 | 8.35 | 8.35 | 4.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Estrogen receptor | EC50 | = | 4.5 | nM | 8.35 | In vitro displacement of [3H]estradiol from estrogen receptor of rat uterine cys... | 3385736 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3385736 | 10.1021/jm00402a037 | Estrogen receptor | 2 |
Data from ChEMBL 36 via Core Engine