Compound Detail
CHEMBL5437292
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Cc1ccc(S(=O)(=O)Nc2ccc(-c3cc(-c4cccc(F)c4)c(C#N)c(N)n3)cc2)cc1
Basic Information
| ChEMBL ID | CHEMBL5437292 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VFTFPVGRUWFDKP-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
458.5
MW (Da)
5.12
ALogP
5
HBA
2
HBD
108.9
PSA (Ų)
0.43
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.44 | 5.44 | 3620.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 3620.0 | nM | 5.44 | Inhibition of human VEGFR-2 kinase activity using poly(Glu-Tyr) at 4:1 ratio as ... | 38389872 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 3620.0 | nM | 5.44 | Inhibition of VEGFR2 (unknown origin) | 38728867 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38389872 | 10.1039/d3md00506b | Vascular endothelial growth factor receptor 2 | 1 |
| 38728867 | 10.1016/j.ejmech.2024.116472 | Vascular endothelial growth factor receptor 2 | 1 |
| 38728867 | 10.1016/j.ejmech.2024.116472 | HOP-92 | 1 |
Data from ChEMBL 36 via Core Engine