Compound Detail
CHEMBL4458533
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Cc1c(C(=O)Nc2ccc(Oc3ncnc4[nH]cc(-c5ccccc5)c34)c(F)c2)c(=O)c2cc(Br)ccc2n1C
Basic Information
| ChEMBL ID | CHEMBL4458533 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KJPHBWFBENZKPS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
598.4
MW (Da)
6.73
ALogP
6
HBA
2
HBD
101.9
PSA (Ų)
0.23
QED
2
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 5.51 | 5.51 | 3120.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 3120.0 | nM | 5.51 | 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