Compound Detail
CHEMBL344407
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Basic Information
| ChEMBL ID | CHEMBL344407 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NWZZJFYBFATYKU-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
445.6
MW (Da)
4.19
ALogP
6
HBA
1
HBD
81.4
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3948 | IC50 | 9.15 | 9.15 | 0.7 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | IC50 | = | 0.7 | nM | 9.15 | Displacement of the specific binding ligand [125I]Sar1,Ile8-AII from Angiotensin... | - |
| Type-1 angiotensin II receptor | IC50 | = | 0.7 | nM | 9.15 | Binding affinity to angiotensin AT1 receptor in rabbit aortic rings | 21071232 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81119-7 | Type-1 angiotensin II receptor | 1 |
| - | 10.1016/S0960-894X(01)81119-7 | No relevant target | 1 |
| 21071232 | 10.1016/j.bmc.2010.10.043 | Type-1 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine