Compound Detail
CHEMBL90392
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL90392 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JWVGFLDJSXAINR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
357.4
MW (Da)
3.32
ALogP
4
HBA
2
HBD
67.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 4.93 | 4.615 | 11770.0 | 2 |
| Brain CHEMBL613617 | IC50 | 4.93 | 4.93 | 11770.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 11770.0 | nM | 4.93 | Compound was tested for its inhibitory concentration against formation of lipid ... | 12182869 |
| Brain | IC50 | = | 11770.0 | nM | 4.93 | Inhibition of lipid peroxidation in Sprague-Dawley rat brain after 30 mins by TB... | 18249541 |
| Rattus norvegicus | IC50 | = | 50100.0 | nM | 4.3 | Compound was tested for its DPPH radical scavenging activity in rat brain homoge... | 12182869 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12182869 | 10.1016/s0960-894x(02)00479-1 | Rattus norvegicus | 2 |
| 18249541 | 10.1016/j.bmcl.2008.01.061 | Brain | 1 |
Data from ChEMBL 36 via Core Engine