Compound Detail
CHEMBL240573
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Basic Information
| ChEMBL ID | CHEMBL240573 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OZBWMKUXDHFFFT-LFYBBSHMSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
377.2
MW (Da)
4.25
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 8.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 8.71 | 8.3767 | 2.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 1.97 | nM | 8.71 | Displacement of [125I]IMPY from amyloid beta 1 to 42 after 2 hrs | 21216142 |
| Unchecked | Ki | = | 2.9 | nM | 8.54 | Displacement of [125I](E)-3-(4-(Dimethylamino-phenyl)-1-(4-iodophenyl)prop-2-en-... | 17826102 |
| Unchecked | Ki | = | 13.1 | nM | 7.88 | Displacement of [125I]DMIC from amyloid beta (1 to 42) peptide | 19757822 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21216142 | 10.1016/j.bmcl.2010.12.045 | Unchecked | 2 |
| 17826102 | 10.1016/j.bmc.2007.07.052 | Unchecked | 1 |
| 19757822 | 10.1021/jm901057p | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine