Compound Detail
CHEMBL4643041
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
C[C@@H](Oc1cncc(-c2cnn(C3CCN(Cc4ccccc4F)CC3)c2)c1)c1c(Cl)ccc(F)c1Cl
Basic Information
| ChEMBL ID | CHEMBL4643041 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GRIRMNKPYJEVFC-GOSISDBHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
543.5
MW (Da)
7.51
ALogP
5
HBA
0
HBD
43.2
PSA (Ų)
0.23
QED
2
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 6.9 | 6.9 | 126.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 126.0 | nM | 6.9 | Inhibition of c-Met (unknown origin) by ADP-Glo kinase assay | 32371098 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32371098 | 10.1016/j.bmcl.2020.127189 | Hepatocyte growth factor receptor | 1 |
| 32371098 | 10.1016/j.bmcl.2020.127189 | MKN-45 | 1 |
Data from ChEMBL 36 via Core Engine