Compound Detail
CHEMBL2071307
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COC(=O)C1=CO[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12
Basic Information
| ChEMBL ID | CHEMBL2071307 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IZODPOCIKVLNIL-QFTSMDQASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
420.4
MW (Da)
-1.77
ALogP
11
HBA
4
HBD
153.4
PSA (Ų)
0.37
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C2C12 CHEMBL612655 | EC50 | 4.59 | 4.59 | 25900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C2C12 | EC50 | = | 25900.0 | nM | 4.59 | Increase in glucose uptake in mouse C2C12 cells incubated for 18 hrs using [3H]-... | 22738356 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22738356 | 10.1021/np3001317 | C2C12 | 2 |
Data from ChEMBL 36 via Core Engine