Compound Detail
CHEMBL303380
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Basic Information
| ChEMBL ID | CHEMBL303380 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AGQQWJNSMXZLLB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
392.3
MW (Da)
5.27
ALogP
5
HBA
0
HBD
46.8
PSA (Ų)
0.57
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 8.7 | 8.7 | 2.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 2.0 | nM | 8.7 | Displacement of [125I]-sauvagine from Corticotropin releasing factor receptor 1 ... | 12127521 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 2.0 | nM | 8.7 | Displacement of 125I-sauvagine from CRF1 receptor in human IMR-32 cells | 29273417 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12127521 | 10.1016/s0960-894x(02)00358-x | Corticotropin-releasing factor receptor 1 | 1 |
| 29273417 | 10.1016/j.bmc.2017.10.012 | Corticotropin-releasing factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine