Compound Detail
CHEMBL3976275
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COc1cccnc1C#CCN(c1ccc2ncc(-c3cnn(C)c3)nc2c1)c1c(F)c(OC)cc(OC)c1F
Basic Information
| ChEMBL ID | CHEMBL3976275 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GUHZQOUGERIFMY-UHFFFAOYSA-N |
6
Targets
11
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
542.5
MW (Da)
4.92
ALogP
9
HBA
0
HBD
87.4
PSA (Ų)
0.27
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 11 meas. best 9.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 9.41 | 9.015 | 0.4 | 2 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 9.22 | 7.7067 | 0.6 | 3 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.51 | 8.51 | 3.1 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 8.36 | 8.36 | 4.4 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.64 | 6.2333 | 22.9 | 3 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.32 | 5.32 | 4786.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine