Compound Detail
CHEMBL105739
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Basic Information
| ChEMBL ID | CHEMBL105739 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WUWDLXZGHZSWQZ-XYOKQWHBSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
238.3
MW (Da)
3.12
ALogP
1
HBA
2
HBD
44.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.4 | 7.4 | 40.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL3337 | IC50 | 5.98 | 5.98 | 1047.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 40.0 | nM | 7.4 | Inhibition of VEGFR-2 (unknown origin) | 37285684 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 1047.13 | nM | 5.98 | Inhibitory activity against vascular endothelial growth factor receptor 2 (FLK1) | 10956210 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10956210 | 10.1021/jm990609e | Vascular endothelial growth factor receptor 2 | 1 |
| 37285684 | 10.1016/j.ejmech.2023.115535 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine