Compound Detail
CHEMBL131839
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Basic Information
| ChEMBL ID | CHEMBL131839 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LLHXOKABAVERBP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
517.6
MW (Da)
5.72
ALogP
5
HBA
1
HBD
92.5
PSA (Ų)
0.32
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-1 angiotensin II receptor B CHEMBL263 | IC50 | 7.47 | 7.47 | 34.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-1 angiotensin II receptor B | IC50 | = | 34.0 | nM | 7.47 | Inhibition of specific binding of [125I]angiotensin-II to angiotensin 1 receptor... | 8258826 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8258826 | 10.1021/jm00077a007 | Type-1 angiotensin II receptor B | 1 |
Data from ChEMBL 36 via Core Engine