Compound Detail
CHEMBL404466
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Basic Information
| ChEMBL ID | CHEMBL404466 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RBRPTFMVULVGIC-ZTIIIDENSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
246.3
MW (Da)
2.59
ALogP
3
HBA
0
HBD
43.4
PSA (Ų)
0.56
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 6.42 | 6.42 | 380.0 | 1 |
| BV-2 CHEMBL614781 | IC50 | 6.33 | 6.33 | 470.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 380.0 | nM | 6.42 | Inhibition of VEGFR-2 (unknown origin) | 37285684 |
| BV-2 | IC50 | = | 470.0 | nM | 6.33 | Inhibition of NO production in LPS-activated mouse BV2 cells by ELISA | 18276135 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18276135 | 10.1016/j.bmcl.2007.12.076 | BV-2 | 6 |
| 18276135 | 10.1016/j.bmcl.2007.12.076 | Unchecked | 1 |
| 37285684 | 10.1016/j.ejmech.2023.115535 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine