Compound Detail
CHEMBL129447
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Basic Information
| ChEMBL ID | CHEMBL129447 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GCEPCIJDUCGARX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
467.5
MW (Da)
4.68
ALogP
7
HBA
2
HBD
122.5
PSA (Ų)
0.34
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3374 | IC50 | 7.44 | 7.44 | 36.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | IC50 | = | 36.0 | nM | 7.44 | Concentration required to inhibit [125I]AII binding to Angiotensin II receptor f... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81118-5 | Type-1 angiotensin II receptor | 1 |
| - | 10.1016/S0960-894X(01)81118-5 | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine