Compound Detail
CHEMBL246805
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Basic Information
| ChEMBL ID | CHEMBL246805 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MSIJSINSLDDVQJ-CSKARUKUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
393.5
MW (Da)
4.80
ALogP
3
HBA
1
HBD
66.8
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.01 | 6.01 | 975.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 975.0 | nM | 6.01 | Activity at RXR-LXR heterodimer in human THP1 cells assessed as induction of ABC... | 17485209 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17485209 | 10.1016/j.bmcl.2007.01.047 | Unchecked | 1 |
| 17485209 | 10.1016/j.bmcl.2007.01.047 | Retinoic acid receptor RXR-alpha | 1 |
Data from ChEMBL 36 via Core Engine