Compound Detail
CHEMBL50135
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Basic Information
| ChEMBL ID | CHEMBL50135 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RRNJUVTWVGPDDH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
404.9
MW (Da)
4.85
ALogP
5
HBA
2
HBD
75.3
PSA (Ų)
0.56
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oryctolagus cuniculus CHEMBL374 | IC50 | 5.38 | 5.38 | 4160.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oryctolagus cuniculus | IC50 | = | 4160.0 | nM | 5.38 | In vitro antagonist activity was determined by the ability to antagonize the con... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7966154 | 10.1021/jm00049a012 | Angiotensin II receptor | 2 |
| - | 10.1016/0960-894X(94)00451-K | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine