Compound Detail
CHEMBL452600
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 | CHEMBL452600 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDTUJTKFWCTQTA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
468.6
MW (Da)
3.62
ALogP
4
HBA
3
HBD
70.6
PSA (Ų)
0.34
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.46 | 8.46 | 3.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 3.5 | nM | 8.46 | Inhibition of MEK-stimulated ERK phosphorylation in PDGF-stimulated mouse C26 ce... | 18952427 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18952427 | 10.1016/j.bmcl.2008.10.054 | Unchecked | 1 |
| 18952427 | 10.1016/j.bmcl.2008.10.054 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine