Compound Detail
CHEMBL3939200
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COc1cc(OC)cc(N(CCN2CCC[C@@H]2C)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1.Cl
Basic Information
| ChEMBL ID | CHEMBL3939200 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CHNWMSQQHAFKHI-FYZYNONXSA-N |
| Parent Compound | CHEMBL3991230 |
| Active Moiety | CHEMBL3991230 |
5
Targets
8
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
472.6
MW (Da)
4.67
ALogP
8
HBA
0
HBD
68.5
PSA (Ų)
0.37
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 8.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.62 | 8.62 | 2.4 | 1 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.6 | 8.16 | 2.5 | 2 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.52 | 8.135 | 3.0 | 2 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 7.88 | 7.88 | 13.2 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.13 | 6.43 | 74.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine