Compound Detail
CHEMBL3314497
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Basic Information
| ChEMBL ID | CHEMBL3314497 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BTMNGQCCCWTUQH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
360.3
MW (Da)
2.60
ALogP
8
HBA
3
HBD
118.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma CHEMBL2459 | EC50 | 5.37 | 5.37 | 4300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma | EC50 | = | 4300.0 | nM | 5.37 | Agonist activity at mouse PPARgamma expressed in HEK293 cells co-expressing with... | 24955889 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24955889 | 10.1021/np500150f | Peroxisome proliferator-activated receptor gamma | 2 |
Data from ChEMBL 36 via Core Engine