Compound Detail
CHEMBL2048302
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Basic Information
| ChEMBL ID | CHEMBL2048302 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NZYXQPVYVKZJSN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
289.3
MW (Da)
3.45
ALogP
5
HBA
2
HBD
58.0
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | IC50 | 7.48 | 7.48 | 33.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | IC50 | = | 33.0 | nM | 7.48 | Displacement of [3H]AZD2184 from human amyloid beta(1 to 40) | 22647721 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22647721 | 10.1016/j.bmcl.2012.05.011 | Amyloid-beta precursor protein | 1 |
Data from ChEMBL 36 via Core Engine