Compound Detail
CHEMBL2153840
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Basic Information
| ChEMBL ID | CHEMBL2153840 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PKBSISADKJRKHT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
291.8
MW (Da)
1.57
ALogP
4
HBA
1
HBD
72.5
PSA (Ų)
0.91
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 4.97 | 4.97 | 10700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 10700.0 | nM | 4.97 | Transactivation of PPARalpha expressed in HEK293A cells co-expressing GAL4 after... | 23137448 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23137448 | 10.1016/j.ejmech.2012.10.019 | Peroxisome proliferator-activated receptor alpha | 4 |
| 23137448 | 10.1016/j.ejmech.2012.10.019 | Peroxisome proliferator-activated receptor gamma | 1 |
Data from ChEMBL 36 via Core Engine