Compound Detail
CHEMBL210003
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Basic Information
| ChEMBL ID | CHEMBL210003 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XDGUQWMBCHDRBW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
374.4
MW (Da)
4.07
ALogP
6
HBA
3
HBD
119.0
PSA (Ų)
0.50
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.62 | 7.11 | 24.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 24.0 | nM | 7.62 | Inhibition of KDR | 16735117 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 250.0 | nM | 6.6 | Inhibition of KDR by cellular assay | 16735117 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16735117 | 10.1016/j.bmcl.2006.05.057 | Vascular endothelial growth factor receptor 2 | 2 |
Data from ChEMBL 36 via Core Engine