Compound Detail
CHEMBL87341
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Basic Information
| ChEMBL ID | CHEMBL87341 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IGJPOVOJDKIXNG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
459.6
MW (Da)
3.37
ALogP
8
HBA
2
HBD
114.5
PSA (Ų)
0.42
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3948 | IC50 | 7.92 | 7.92 | 12.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | IC50 | = | 12.0 | nM | 7.92 | In vitro antagonistic activity for angiotensin II receptor, type 1 by displacing... | 8355255 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8355255 | 10.1021/jm00069a015 | Type-1 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine