Compound Detail
CHEMBL496492
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Basic Information
| ChEMBL ID | CHEMBL496492 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DZUHOSORNHKGTI-ZRDIBKRKSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
306.4
MW (Da)
4.40
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.29
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 7.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | EC50 | 7.28 | 6.53 | 52.0 | 2 |
| Amyloid-beta precursor protein CHEMBL2487 | EC50 | 5.02 | 5.02 | 9520.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | EC50 | = | 52.0 | nM | 7.28 | Inhibition of LPS-induced nitric oxide production in mouse RAW264.7 cells assess... | 18667320 |
| RAW264.7 | EC50 | = | 1658.0 | nM | 5.78 | Cytotoxicity against mouse RAW264.7 cells assessed as cell survival after 24 hrs... | 18667320 |
| Amyloid-beta precursor protein | EC50 | = | 9520.0 | nM | 5.02 | Inhibition of QD-labeled amyloid beta (1 to 42) (unknown origin) aggregation aft... | 28759879 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18667320 | 10.1016/j.bmc.2008.07.006 | RAW264.7 | 3 |
| 28759879 | 10.1016/j.ejmech.2017.07.026 | Unchecked | 2 |
| 28759879 | 10.1016/j.ejmech.2017.07.026 | No relevant target | 2 |
| 28759879 | 10.1016/j.ejmech.2017.07.026 | Amyloid-beta precursor protein | 1 |
Data from ChEMBL 36 via Core Engine