Compound Detail
CHEMBL290762
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Basic Information
| ChEMBL ID | CHEMBL290762 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DVFPSRARRBNMBH-UHFFFAOYSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
391.4
MW (Da)
5.95
ALogP
4
HBA
0
HBD
33.4
PSA (Ų)
0.52
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.3
IC50 1 meas. best 6.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 8.3 | 8.3 | 5.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 6.45 | 6.45 | 357.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 5.0 | nM | 8.3 | Displacement of [125I]0-CRF from human Corticotropin releasing factor receptor 1... | 9873487 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 5.0 | nM | 8.3 | Compound was tested for the binding affinity to human corticotropin releasing fa... | 10794681 |
| Unchecked | IC50 | = | 357.0 | nM | 6.45 | Inhibition of ovine CRF stimulated adenylate cyclase assay in CHO-p5 cells | 10794681 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9873487 | 10.1016/s0960-894x(98)00372-2 | Corticotropin-releasing factor receptor 1 | 1 |
| 10794681 | 10.1021/jm990590f | Corticotropin-releasing factor receptor 1 | 1 |
| 10794681 | 10.1021/jm990590f | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine