Compound Detail
CHEMBL106972
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Basic Information
| ChEMBL ID | CHEMBL106972 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IEZMGDHWPPAZMB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
393.4
MW (Da)
5.68
ALogP
4
HBA
0
HBD
34.0
PSA (Ų)
0.58
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 7.1 | 7.1 | 80.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 80.0 | nM | 7.1 | Inhibition of [125I]o-CRF binding to human Corticotropin releasing factor recept... | 11720866 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 80.0 | nM | 7.1 | Inhibition of [125I][Tyr0]-sauvagine binding to human Corticotropin releasing fa... | 15743196 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11720866 | 10.1016/s0960-894x(01)00657-6 | Corticotropin-releasing factor receptor 1 | 1 |
| 15743196 | 10.1021/jm049339c | Corticotropin-releasing factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine