Compound Detail
CHEMBL432496
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Basic Information
| ChEMBL ID | CHEMBL432496 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DQSVEQFHEZHQRX-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
419.4
MW (Da)
4.67
ALogP
5
HBA
0
HBD
41.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 7.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 7.66 | 7.43 | 22.0 | 2 |
| Corticotropin-releasing factor receptor 1 CHEMBL4649 | Ki | 7.66 | 7.66 | 22.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 22.0 | nM | 7.66 | Binding affinity for human recombinant corticotropin releasing factor receptor 1 | 10072679 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 22.0 | nM | 7.66 | Binding affinity was determined against corticotropin releasing factor receptor ... | 10072680 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 63.0 | nM | 7.2 | Compound was tested for the inhibition of binding of the radioligand, [125 I-Tyr... | 10794681 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10072679 | 10.1021/jm980222w | Corticotropin-releasing factor receptor 1 | 1 |
| 10072680 | 10.1021/jm980223o | Corticotropin-releasing factor receptor 1 | 1 |
| 10794681 | 10.1021/jm990590f | Corticotropin-releasing factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine