Compound Detail
CHEMBL403237
CURCULIGOSIDE B Enter ChEMBL ID:
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COc1cccc(O)c1C(=O)OCc1cc(O)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Basic Information
| ChEMBL ID | CHEMBL403237 |
| Name | CURCULIGOSIDE B |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DIZYHORWVKHYCQ-PEVLUNPASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
452.4
MW (Da)
-0.36
ALogP
11
HBA
6
HBD
175.4
PSA (Ų)
0.30
QED
2
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.07 | 5.07 | 8500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 8500.0 | nM | 5.07 | Inhibition of beta amyloid 25-35 fibril formation | 18042380 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18042380 | 10.1016/j.bmcl.2007.11.028 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine