Compound Detail
CHEMBL3942763
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COc1cc(OC)cc(N(CCCN2CCC[C@@H]2CO)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
Basic Information
| ChEMBL ID | CHEMBL3942763 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LKMLECIRYJPQOC-JOCHJYFZSA-N |
6
Targets
11
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
502.6
MW (Da)
4.03
ALogP
9
HBA
1
HBD
88.8
PSA (Ų)
0.35
QED
1
Ro5 Violations
10
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 | 8.71 | 0.4 | 3 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 9.05 | 8.405 | 0.9 | 2 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.69 | 8.69 | 2.0 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 8.33 | 8.33 | 4.7 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.47 | 6.89 | 33.9 | 3 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.46 | 5.46 | 3467.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine