Compound Detail
CHEMBL2268841
ETHYLENE GLYCOL DIOCTANOATE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL2268841 |
| Name | ETHYLENE GLYCOL DIOCTANOATE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HTNFLUQQANUSLR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
314.5
MW (Da)
4.79
ALogP
4
HBA
0
HBD
52.6
PSA (Ų)
0.32
QED
0
Ro5 Violations
15
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Diacylglycerol kinase alpha CHEMBL4105787 | Ki | 4.24 | 4.24 | 58000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Diacylglycerol kinase alpha | Ki | = | 58000.0 | nM | 4.24 | Inhibition of DGKalpha in human erythrocytes using OAG as substrate preincubated... | 30611057 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/j.indcrop.2012.03.010 | Helicoverpa armigera | 7 |
| - | 10.1016/j.indcrop.2012.03.010 | Spodoptera litura | 7 |
| 30611057 | 10.1016/j.ejmech.2018.12.061 | Diacylglycerol kinase alpha | 1 |
Data from ChEMBL 36 via Core Engine