Compound Detail
CHEMBL3902434
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COc1cc(OC)cc(N(CCN(CCCN)C(C)C)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1.Cl
Basic Information
| ChEMBL ID | CHEMBL3902434 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FTRYOTCWDVTGOU-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3990097 |
| Active Moiety | CHEMBL3990097 |
6
Targets
13
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
503.6
MW (Da)
4.24
ALogP
9
HBA
1
HBD
94.6
PSA (Ų)
0.31
QED
1
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 13 meas. best 8.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.49 | 6.9667 | 3.2 | 3 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.3 | 8.3 | 5.0 | 1 |
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 7.91 | 6.6667 | 12.3 | 3 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 7.5 | 7.5 | 31.6 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.03 | 5.88 | 93.3 | 3 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.35 | 5.34 | 4466.8 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine