Compound Detail
CHEMBL1275979
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Basic Information
| ChEMBL ID | CHEMBL1275979 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TWHAVEWPWVFFDU-VOTSOKGWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
239.3
MW (Da)
3.91
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 4.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 4.75 | 4.75 | 17900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 17900.0 | nM | 4.75 | Binding affinity to amyloid beta (1 to 40) | 20621493 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20621493 | 10.1016/j.bmc.2010.06.044 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine