Compound Detail
CHEMBL5965106
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O=C(N1CCc2ccc(Nc3nc(Nc4cccc(F)c4)ncc3-c3cnn(CCO)c3)cc2C1)C(F)(F)F
Basic Information
| ChEMBL ID | CHEMBL5965106 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VQZOVNXFKLFYIO-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
541.5
MW (Da)
4.41
ALogP
8
HBA
3
HBD
108.2
PSA (Ų)
0.30
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor TYRO3 CHEMBL5314 | IC50 | 7.8 | 7.8 | 16.0 | 1 |
| Tyrosine-protein kinase Mer CHEMBL5331 | IC50 | 7.64 | 7.64 | 23.0 | 1 |
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 6.36 | 6.36 | 440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor TYRO3 | IC50 | = | 16.0 | nM | 7.8 | Verification on Inhibitory Activities of TAM Receptor Inhibiting Compounds on Ty... | - |
| Tyrosine-protein kinase Mer | IC50 | = | 23.0 | nM | 7.64 | Verification on Inhibitory Activities of TAM Receptor Inhibiting Compounds on Ty... | - |
| Tyrosine-protein kinase receptor UFO | IC50 | = | 440.0 | nM | 6.36 | Verification on Inhibitory Activities of TAM Receptor Inhibiting Compounds on Ty... | - |
Data from ChEMBL 36 via Core Engine