Compound Detail
CHEMBL303822
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Basic Information
| ChEMBL ID | CHEMBL303822 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZZNGOSDWGJACFQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
428.5
MW (Da)
3.04
ALogP
7
HBA
1
HBD
98.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor B CHEMBL263 | IC50 | 8.48 | 8.48 | 3.3 | 1 |
| Type-1 angiotensin II receptor CHEMBL3374 | IC50 | 7.47 | 7.47 | 34.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor B | IC50 | = | 3.3 | nM | 8.48 | Tested for binding affinity against angiotensin II receptor in rat adrenal corte... | - |
| Type-1 angiotensin II receptor | IC50 | = | 34.0 | nM | 7.47 | Tested for binding affinity against angiotensin II receptor in bovine adrenal co... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00370-9 | Type-1 angiotensin II receptor | 1 |
| - | 10.1016/0960-894X(95)00370-9 | Type-1 angiotensin II receptor B | 1 |
Data from ChEMBL 36 via Core Engine