Compound Detail
CHEMBL386718
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Basic Information
| ChEMBL ID | CHEMBL386718 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JRELQXXPAXDOSZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
459.6
MW (Da)
4.72
ALogP
6
HBA
1
HBD
81.1
PSA (Ų)
0.48
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-2 angiotensin II receptor CHEMBL4607 | Ki | 7.1 | 7.1 | 79.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-2 angiotensin II receptor | Ki | = | 79.0 | nM | 7.1 | Displacement of [125I]Ang2 from AT2 receptor in pig uterus membrane | 17125268 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17125268 | 10.1021/jm0606185 | Type-2 angiotensin II receptor | 2 |
Data from ChEMBL 36 via Core Engine