Compound Detail
CHEMBL3894754
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CCOc1ccnc(C#CCN(c2cc(OC)cc(OC)c2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)n1
Basic Information
| ChEMBL ID | CHEMBL3894754 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PRVGMAOUBRLMGU-UHFFFAOYSA-N |
6
Targets
11
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
521.6
MW (Da)
4.43
ALogP
10
HBA
0
HBD
100.3
PSA (Ų)
0.27
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 11 meas. best 8.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 8.61 | 8.165 | 2.5 | 2 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 8.44 | 7.24 | 3.6 | 3 |
| Fibroblast growth factor receptor 2 CHEMBL4142 | IC50 | 8.02 | 8.02 | 9.6 | 1 |
| Fibroblast growth factor receptor 4 CHEMBL3973 | IC50 | 7.5 | 7.5 | 31.6 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.15 | 5.12 | 7079.5 | 2 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 5.1 | 5.08 | 7943.3 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine