Compound Detail
CHEMBL5819606
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COC[C@@H](C)Oc1nc(C(=O)N2CC(F)(F)C2)cc(N2CCC(c3c[nH]c4nccc(OC)c34)CC2)n1
Basic Information
| ChEMBL ID | CHEMBL5819606 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UKCSRTKFPOZTEF-OAHLLOKOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
516.5
MW (Da)
3.25
ALogP
8
HBA
1
HBD
105.7
PSA (Ų)
0.49
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 10.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | Ki | 10.74 | 10.74 | 0.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | Ki | = | 0.018 | nM | 10.74 | Enzyme Assay: AXL enzyme inhibition (% inhibition, Kiapp and Ki values) by small... | - |
Data from ChEMBL 36 via Core Engine