Compound Detail
CHEMBL3945264
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COc1cc(OC)c(C)c(N(CCCN2CCCC2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1.Cl
Basic Information
| ChEMBL ID | CHEMBL3945264 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OKFNCOXKQXFNDZ-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3990133 |
| Active Moiety | CHEMBL3990133 |
6
Targets
10
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
486.6
MW (Da)
4.98
ALogP
8
HBA
0
HBD
68.5
PSA (Ų)
0.33
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 10 meas. best 8.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.66 | 8.22 | 2.2 | 2 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.45 | 8.45 | 3.5 | 1 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.23 | 7.1367 | 5.9 | 3 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 8.05 | 8.05 | 8.9 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.59 | 7.105 | 25.7 | 2 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.08 | 5.08 | 8317.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine