Compound Detail
CHEMBL3120617
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O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@]2(C(=O)O)C[C@@H](O)[C@@H](O)[C@@H]1O2
Basic Information
| ChEMBL ID | CHEMBL3120617 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VZDAUTWTNKAFSV-NIQOAUNZSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
382.3
MW (Da)
-0.66
ALogP
9
HBA
5
HBD
163.0
PSA (Ų)
0.25
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24471493 | 10.1021/np400780n | HepG2 | 2 |
| 24471493 | 10.1021/np400780n | RAW264.7 | 1 |
| 24471493 | 10.1021/np400780n | Oxysterols receptor LXR-alpha | 1 |
| 24471493 | 10.1021/np400780n | Peroxisome proliferator-activated receptor gamma | 1 |
| 24471493 | 10.1021/np400780n | Peroxisome proliferator-activated receptor alpha | 1 |
| 24471493 | 10.1021/np400780n | Growth/differentiation factor 15 | 1 |
| 24471493 | 10.1021/np400780n | Nitric oxide synthase, inducible | 1 |
| 24471493 | 10.1021/np400780n | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine