Compound Detail
CHEMBL4473213
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
CC(C)(C)c1cc(NC(=O)Cc2ccc(-n3cnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccc43)cc2)no1
Basic Information
| ChEMBL ID | CHEMBL4473213 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LMFNJXLDISVWLF-UHFFFAOYSA-N |
7
Targets
14
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
528.6
MW (Da)
5.56
ALogP
7
HBA
1
HBD
107.1
PSA (Ų)
0.31
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 14 meas. best 9.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041 | IC50 | 9.17 | 8.77 | 0.7 | 7 |
| Coiled-coil domain-containing protein 6/Tyrosine-protein kinase receptor RET CHEMBL3430904 | IC50 | 9.17 | 9.17 | 0.7 | 2 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 8.52 | 8.52 | 3.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 8.51 | 8.51 | 3.1 | 1 |
| High affinity nerve growth factor receptor CHEMBL2815 | IC50 | 7.5 | 7.5 | 32.0 | 1 |
| Macrophage colony-stimulating factor 1 receptor CHEMBL1844 | IC50 | 7.34 | 7.34 | 46.0 | 1 |
| Voltage-gated inwardly rectifying potassium channel KCNH2 CHEMBL240 | IC50 | 5.12 | 5.12 | 7570.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine