Compound Detail
CHEMBL19202
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Basic Information
| ChEMBL ID | CHEMBL19202 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XWUOBJXGWLLBPU-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
445.6
MW (Da)
4.33
ALogP
7
HBA
1
HBD
94.3
PSA (Ų)
0.44
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor CHEMBL3948 | IC50 | 8.92 | 8.76 | 1.2 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor | IC50 | = | 1.2 | nM | 8.92 | Displacement of [125I]-Sar1Ile8-angiotensin 2 from angiotensin AT1 receptor in r... | 21071232 |
| Type-1 angiotensin II receptor | IC50 | = | 2.1 | nM | 8.68 | Displacement of 125I[Sar,Ile] from rabbit aorta membrane Angiotensin II receptor... | - |
| Type-1 angiotensin II receptor | IC50 | = | 2.1 | nM | 8.68 | In vitro antagonistic activity for angiotensin II receptor, type 1 by displacing... | 8355255 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8355255 | 10.1021/jm00069a015 | Rattus norvegicus | 4 |
| - | 10.1016/S0960-894X(01)81132-X | Rattus norvegicus | 2 |
| - | 10.1016/S0960-894X(01)81132-X | Type-1 angiotensin II receptor | 1 |
| 8355255 | 10.1021/jm00069a015 | Type-1 angiotensin II receptor | 1 |
| 21071232 | 10.1016/j.bmc.2010.10.043 | Type-1 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine