Compound Detail
CHEMBL1170331
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Basic Information
| ChEMBL ID | CHEMBL1170331 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XHPQTYAKVAFOLZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
423.4
MW (Da)
4.35
ALogP
6
HBA
1
HBD
77.2
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 8.74 | 8.74 | 1.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 1.8 | nM | 8.74 | Induction of [14C]-oleic acid oxidation in human differentiated skeletal muscle ... | 20403648 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20403648 | 10.1016/j.ejmech.2010.03.035 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine