Compound Detail
CHEMBL565658
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Basic Information
| ChEMBL ID | CHEMBL565658 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AUUMQVZRQARMSP-QZQOTICOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
523.8
MW (Da)
11.27
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.11
QED
2
Ro5 Violations
24
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.91
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | Ki | 7.91 | 7.91 | 12.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | Ki | = | 12.2 | nM | 7.91 | Binding affinity to Beta amyloid aggregates in Alzheimer's disease patient brain... | 19845387 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19845387 | 10.1021/jm901039z | Amyloid-beta precursor protein | 1 |
Data from ChEMBL 36 via Core Engine