Compound Detail
CHEMBL354859
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Basic Information
| ChEMBL ID | CHEMBL354859 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VTTGJOYJTWSWLG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
465.4
MW (Da)
4.93
ALogP
6
HBA
0
HBD
50.7
PSA (Ų)
0.47
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 7.6 | 7.6 | 25.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 25.0 | nM | 7.6 | Binding affinity for human recombinant corticotropin releasing factor receptor 1 | 10072679 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10072679 | 10.1021/jm980222w | Corticotropin-releasing factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine