Compound Detail
CHEMBL3901119
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COc1cc(OC)cc(N(CC2COCC(C)(C)N2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
Basic Information
| ChEMBL ID | CHEMBL3901119 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZAWBYXATEBIOBQ-UHFFFAOYSA-N |
6
Targets
9
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
488.6
MW (Da)
3.95
ALogP
9
HBA
1
HBD
86.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 9 meas. best 9.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 9.12 | 8.355 | 0.8 | 2 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.51 | 8.025 | 3.1 | 2 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.47 | 8.47 | 3.4 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 8.34 | 8.34 | 4.6 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.65 | 6.855 | 22.4 | 2 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.07 | 5.07 | 8511.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine