Compound Detail
CHEMBL185522
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 | CHEMBL185522 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FDUMAVYZLKWHTH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
391.9
MW (Da)
5.20
ALogP
2
HBA
3
HBD
70.2
PSA (Ų)
0.57
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.52 | 7.52 | 30.0 | 1 |
| NIH3T3 CHEMBL614822 | IC50 | 7.0 | 7.0 | 99.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 30.0 | nM | 7.52 | Inhibition of Vascular endothelial growth factor receptor 2 (KDR) | 15357981 |
| NIH3T3 | IC50 | = | 99.0 | nM | 7.0 | inhibitory activity of the Compound against NIH3T3 Cell lines | 15357981 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15357981 | 10.1016/j.bmcl.2004.06.041 | Vascular endothelial growth factor receptor 2 | 1 |
| 15357981 | 10.1016/j.bmcl.2004.06.041 | NIH3T3 | 1 |
Data from ChEMBL 36 via Core Engine