Compound Detail
CHEMBL409512
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Basic Information
| ChEMBL ID | CHEMBL409512 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UTUQVVOKHILSBX-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
497.9
MW (Da)
6.19
ALogP
5
HBA
2
HBD
103.5
PSA (Ų)
0.29
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 9.7 | 9.7 | 0.2 | 1 |
| HUVEC CHEMBL613979 | IC50 | 8.52 | 7.47 | 3.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 0.2 | nM | 9.7 | Inhibition of KDR by HTRF assay | 18324761 |
| HUVEC | IC50 | = | 3.0 | nM | 8.52 | Inhibition of VEGF-induced proliferation of HUVEC cells | 18324761 |
| HUVEC | IC50 | = | 380.0 | nM | 6.42 | Inhibition of bFGF-induced proliferation of HUVEC cells | 18324761 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18324761 | 10.1021/jm701097z | HUVEC | 3 |
| 18324761 | 10.1021/jm701097z | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine