Compound Detail
CHEMBL4541303
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CCc1ccc2c(c1)c(=O)c(C(=O)Nc1ccc(Oc3ncnc4[nH]cc(-c5ccccc5)c34)cc1)c(C)n2C
Basic Information
| ChEMBL ID | CHEMBL4541303 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YBEGSGXDKQDDOK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
529.6
MW (Da)
6.39
ALogP
6
HBA
2
HBD
101.9
PSA (Ų)
0.26
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 6.98 | 6.98 | 105.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 105.0 | nM | 6.98 | Inhibition of human recombinant AXL incubated for 1 to 1.5 hrs by FRET based Z'-... | 27379978 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27379978 | 10.1021/acs.jmedchem.6b00608 | Tyrosine-protein kinase receptor UFO | 1 |
Data from ChEMBL 36 via Core Engine