Compound Detail
CHEMBL231127
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Basic Information
| ChEMBL ID | CHEMBL231127 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SBXVZMIZJGLIRS-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
452.5
MW (Da)
5.95
ALogP
6
HBA
3
HBD
105.8
PSA (Ų)
0.31
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 9.0 | 8.55 | 1.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 1.0 | nM | 9.0 | Inhibition of human KDR phosphorylation in NIH3T3 cells | 17188869 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 8.0 | nM | 8.1 | Inhibition of KDR | 17188869 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17188869 | 10.1016/j.bmcl.2006.12.015 | Vascular endothelial growth factor receptor 2 | 2 |
Data from ChEMBL 36 via Core Engine