Compound Detail
CHEMBL395414
DISOGLUSIDE 🧪 Phase II
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🧪 Phase II
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Basic Information
| ChEMBL ID | CHEMBL395414 |
| Name | DISOGLUSIDE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | WXMARHKAXWRNDM-GAMIEDRGSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
4
Publications
3
Known Names
Molecular Properties
576.8
MW (Da)
3.54
ALogP
8
HBA
4
HBD
117.8
PSA (Ų)
0.38
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Activity Summary
IC50 1 meas. best 4.52
Kd 1 meas. best 10.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Interleukin-2 CHEMBL5880 | Kd | 10.54 | 10.54 | 0.0 | 1 |
| HepG2 CHEMBL395 | IC50 | 4.52 | 4.52 | 30300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Interleukin-2 | Kd | = | 0.0289 | nM | 10.54 | Binding affinity to IL-2 (unknown origin) | 24974349 |
| HepG2 | IC50 | = | 30300.0 | nM | 4.52 | Anticancer activity against human HepG2 cells assessed as cell viability after 2... | 24974349 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22704886 | 10.1016/j.bmcl.2012.05.094 | Mus musculus | 12 |
| 17306549 | 10.1016/j.bmc.2007.01.058 | ADMET | 2 |
| 24974349 | 10.1016/j.ejmech.2014.06.037 | Interleukin-2 | 1 |
| 24974349 | 10.1016/j.ejmech.2014.06.037 | HepG2 | 1 |
Data from ChEMBL 36 via Core Engine