Compound Detail
CHEMBL416929
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Basic Information
| ChEMBL ID | CHEMBL416929 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LYGOGDPXOMDJJQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
470.9
MW (Da)
5.27
ALogP
6
HBA
1
HBD
90.7
PSA (Ų)
0.38
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Angiotensin II receptor CHEMBL2094112 | IC50 | 5.75 | 5.75 | 1800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Angiotensin II receptor | IC50 | = | 1800.0 | nM | 5.75 | Ability to displace [3H]AII (2 nM) from its specific binding sites in rat adrena... | 2329554 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2329554 | 10.1021/jm00167a008 | Angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine