Compound Detail
CHEMBL254850
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL254850 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AEDCJFPKFVWIEF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
3.31
ALogP
4
HBA
1
HBD
43.3
PSA (Ų)
0.56
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | Ki | 6.42 | 6.42 | 377.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | Ki | = | 377.0 | nM | 6.42 | Binding affinity to beta amyloid plaque in human Alzheimer's disease brain tissu... | 18078311 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18078311 | 10.1021/jm700970s | Amyloid-beta precursor protein | 1 |
| 18078311 | 10.1021/jm700970s | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine