Compound Detail
CHEMBL237126
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Basic Information
| ChEMBL ID | CHEMBL237126 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KWEPTXFPNVUYJW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
507.0
MW (Da)
5.57
ALogP
6
HBA
3
HBD
69.7
PSA (Ų)
0.27
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041 | IC50 | 7.12 | 7.12 | 75.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 75.0 | nM | 7.12 | Inhibition of RET kinase in Sf9 cells | 17884497 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17884497 | 10.1016/j.bmcl.2007.07.104 | Proto-oncogene tyrosine-protein kinase receptor Ret | 1 |
Data from ChEMBL 36 via Core Engine