Compound Detail
CHEMBL4294830
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Basic Information
| ChEMBL ID | CHEMBL4294830 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HBUYINNDKULSLR-OWOJBTEDSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
246.2
MW (Da)
1.93
ALogP
5
HBA
3
HBD
90.9
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| No relevant target CHEMBL2362975 | IC50 | 5.92 | 5.92 | 1190.0 | 1 |
| Amyloid-beta precursor protein CHEMBL2487 | IC50 | 4.75 | 4.75 | 17950.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| No relevant target | IC50 | = | 1190.0 | nM | 5.92 | Antioxidant activity assessed as ABTS radical scavenging activity incubated for ... | 30360953 |
| Amyloid-beta precursor protein | IC50 | = | 17950.0 | nM | 4.75 | Inhibition of HFIP-pretreated amyloid beta (1 to 42) (unknown origin) self-induc... | 30360953 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30360953 | 10.1016/j.bmc.2018.08.011 | Amyloid-beta precursor protein | 2 |
| 30360953 | 10.1016/j.bmc.2018.08.011 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine