Compound Detail
CHEMBL302869
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Basic Information
| ChEMBL ID | CHEMBL302869 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JYMFEGYVMQOXIL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
465.3
MW (Da)
3.76
ALogP
6
HBA
1
HBD
77.2
PSA (Ų)
0.47
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3948 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | IC50 | = | 1100.0 | nM | 5.96 | Binding affinity evaluated by its ability to displace the specific binding ligan... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81148-3 | No relevant target | 2 |
| - | 10.1016/S0960-894X(01)81148-3 | Type-1 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine