Compound Detail
CHEMBL3758630
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Basic Information
| ChEMBL ID | CHEMBL3758630 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MBEXQPRDMJSWPJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
333.4
MW (Da)
3.70
ALogP
4
HBA
0
HBD
30.9
PSA (Ų)
0.62
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | Ki | 6.72 | 6.72 | 191.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | Ki | = | 191.1 | nM | 6.72 | Displacement of [125I]BOB-4 from Amyloid beta (1 to 42) (unknown origin) | 26435514 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26435514 | 10.1016/j.ejmech.2015.09.028 | Amyloid-beta precursor protein | 2 |
Data from ChEMBL 36 via Core Engine