Compound Detail
CHEMBL3926556
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COC[C@H](O)CN(c1cc(OC)cc(OC)c1)c1ccc2ncc(-c3cnn(C(C)C)c3)nc2c1.Cl
Basic Information
| ChEMBL ID | CHEMBL3926556 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GJXMORWINPOZCG-ZMBIFBSDSA-N |
| Parent Compound | CHEMBL3990187 |
| Active Moiety | CHEMBL3990187 |
6
Targets
9
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
477.6
MW (Da)
4.24
ALogP
9
HBA
1
HBD
94.8
PSA (Ų)
0.36
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 9 meas. best 8.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.96 | 8.21 | 1.1 | 2 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.59 | 7.875 | 2.6 | 2 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.46 | 8.46 | 3.5 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 8.14 | 8.14 | 7.2 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 6.81 | 6.15 | 154.9 | 2 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.11 | 5.11 | 7762.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine