Compound Detail
CHEMBL5282696
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Basic Information
| ChEMBL ID | CHEMBL5282696 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SMRIAXWJDJOGQF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
403.4
MW (Da)
6.13
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.50
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 7.1 | 7.1 | 80.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 80.0 | nM | 7.1 | Agonist activity at human PPARalpha incubated for 22 to 24 hrs by luciferase ass... | 37312852 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37312852 | 10.1021/acsmedchemlett.3c00056 | Peroxisome proliferator-activated receptor alpha | 2 |
| 37312852 | 10.1021/acsmedchemlett.3c00056 | Peroxisome proliferator-activated receptor delta | 1 |
| 37312852 | 10.1021/acsmedchemlett.3c00056 | Peroxisome proliferator-activated receptor gamma | 1 |
Data from ChEMBL 36 via Core Engine