Compound Detail
CHEMBL5191595
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Basic Information
| ChEMBL ID | CHEMBL5191595 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WPJUNGSMJWIICZ-KTKRTIGZSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
388.6
MW (Da)
7.04
ALogP
3
HBA
0
HBD
35.5
PSA (Ų)
0.16
QED
1
Ro5 Violations
17
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 5.36 | 5.36 | 4400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 4400.0 | nM | 5.36 | Agonist activity at human PPARalpha expressed in HEK293 cells by luciferase/beta... | 35089724 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35089724 | 10.1021/acs.jmedchem.1c01542 | Peroxisome proliferator-activated receptor alpha | 7 |
| 35089724 | 10.1021/acs.jmedchem.1c01542 | Peroxisome proliferator-activated receptor gamma | 6 |
| 35089724 | 10.1021/acs.jmedchem.1c01542 | Peroxisome proliferator-activated receptor delta | 3 |
Data from ChEMBL 36 via Core Engine