Compound Detail
CHEMBL5272747
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
Basic Information
| ChEMBL ID | CHEMBL5272747 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JGSRURALHADGHE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
479.6
MW (Da)
7.11
ALogP
5
HBA
1
HBD
63.0
PSA (Ų)
0.30
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 7.88 | 7.74 | 13.2 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 13.2 | nM | 7.88 | Inhibition of EGFR d746-750/T790M double mutant (unknown origin) | 36064123 |
| Epidermal growth factor receptor | IC50 | = | 25.2 | nM | 7.6 | Inhibition of EGFR L858R/T790M double mutant (unknown origin) | 36064123 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36064123 | 10.1016/j.bmcl.2022.128970 | Epidermal growth factor receptor | 3 |
Data from ChEMBL 36 via Core Engine