Compound Detail
CHEMBL490809
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 | CHEMBL490809 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FWWXZTJGBMXIDI-CPNJWEJPSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
408.5
MW (Da)
6.12
ALogP
3
HBA
2
HBD
66.8
PSA (Ų)
0.46
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.95 | 5.78 | 1130.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1130.0 | nM | 5.95 | Inhibition of TNF-alpha-induced NF-kappaB activation in human HeLa cells by SEAP... | 18841906 |
| Unchecked | IC50 | = | 2440.0 | nM | 5.61 | Inhibition of LPS-induced NF-kappaB activation in mouse RAW264.7 cells by SEAP r... | 18841906 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18841906 | 10.1021/np800383q | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine