Compound Detail
CHEMBL5597086
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CC(C)n1cc(C(=O)Nc2ccc(Oc3ccnc4c3Oc3ccccc3N4)c(F)c2)c(=O)c(-c2ccc(F)cc2)c1
Basic Information
| ChEMBL ID | CHEMBL5597086 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IVRKZMDXSUEQLM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
566.6
MW (Da)
7.66
ALogP
7
HBA
2
HBD
94.5
PSA (Ų)
0.21
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 8.15 | 8.15 | 7.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 7.0 | nM | 8.15 | Inhibition of AXL (unknown origin) | 38733884 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38733884 | 10.1016/j.ejmech.2024.116477 | Tyrosine-protein kinase receptor UFO | 1 |
Data from ChEMBL 36 via Core Engine