Compound Detail
CHEMBL194192
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Basic Information
| ChEMBL ID | CHEMBL194192 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DIWGSLNGJZKMCD-NRSPTQNISA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
328.4
MW (Da)
4.52
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.50
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oxysterols receptor LXR-beta CHEMBL4093 | IC50 | 5.42 | 5.42 | 3850.0 | 1 |
| Oxysterols receptor LXR-alpha CHEMBL2808 | IC50 | 5.3 | 5.3 | 5060.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oxysterols receptor LXR-beta | IC50 | = | 3850.0 | nM | 5.42 | Inhibitory concentration in LXRSPA beta binding assay | 16125384 |
| Oxysterols receptor LXR-alpha | IC50 | = | 5060.0 | nM | 5.3 | Inhibitory concentration in LXRSPA alpha binding assay | 16125384 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16125384 | 10.1016/j.bmcl.2005.06.100 | Oxysterols receptor LXR-alpha | 4 |
| 16125384 | 10.1016/j.bmcl.2005.06.100 | Oxysterols receptor LXR-beta | 4 |
Data from ChEMBL 36 via Core Engine