Compound Detail
CHEMBL2071308
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O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O
Basic Information
| ChEMBL ID | CHEMBL2071308 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GZORMMCZSCNNCI-QPFSIERHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
610.5
MW (Da)
1.43
ALogP
14
HBA
8
HBD
236.8
PSA (Ų)
0.08
QED
3
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C2C12 CHEMBL612655 | EC50 | 4.86 | 4.86 | 13800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C2C12 | EC50 | = | 13800.0 | nM | 4.86 | 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