Compound Detail
CHEMBL1828825
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1828825 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RDDWSPQQHUIGAG-MDZDMXLPSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
296.4
MW (Da)
4.49
ALogP
2
HBA
1
HBD
46.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 4.73 | 4.73 | 18800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 18800.0 | nM | 4.73 | Agonist activity at Gal4-fused PPARalpha expressed in HEK293 cells after 18 hrs ... | 21889235 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21889235 | 10.1016/j.ejmech.2011.08.022 | Peroxisome proliferator-activated receptor alpha | 2 |
| 21889235 | 10.1016/j.ejmech.2011.08.022 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine