Compound Detail
CHEMBL385178
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Basic Information
| ChEMBL ID | CHEMBL385178 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CPVRYQAOUPSUDO-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
396.4
MW (Da)
5.13
ALogP
5
HBA
2
HBD
76.1
PSA (Ų)
0.45
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.42
Ki 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | Ki | 8.0 | 8.0 | 10.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.42 | 7.42 | 38.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | Ki | = | 10.0 | nM | 8.0 | Inhibition of phosphorylated-Kdr after 30 mins | 17869515 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 38.0 | nM | 7.42 | Inhibition of KDR by HTRF assay | 17253678 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17253678 | 10.1021/jm061107l | Vascular endothelial growth factor receptor 2 | 1 |
| 17253678 | 10.1021/jm061107l | Angiopoietin-1 receptor | 1 |
| 17869515 | 10.1016/j.bmcl.2007.07.077 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine