Compound Detail
CHEMBL184223
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Basic Information
| ChEMBL ID | CHEMBL184223 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XZXIHTJGNYBSTH-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
387.4
MW (Da)
4.56
ALogP
3
HBA
3
HBD
79.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.68 | 7.68 | 21.0 | 2 |
| NIH3T3 CHEMBL614822 | IC50 | 6.77 | 6.77 | 170.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 21.0 | nM | 7.68 | Inhibition of Vascular endothelial growth factor receptor 2 (KDR) | 15357981 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 21.0 | nM | 7.68 | Inhibition of KDR (unknown origin) | 36335744 |
| NIH3T3 | IC50 | = | 170.0 | nM | 6.77 | inhibitory activity of the Compound against NIH3T3 Cell lines | 15357981 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15357981 | 10.1016/j.bmcl.2004.06.041 | Vascular endothelial growth factor receptor 2 | 1 |
| 15357981 | 10.1016/j.bmcl.2004.06.041 | NIH3T3 | 1 |
| 36335744 | 10.1016/j.ejmech.2022.114884 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine