Compound Detail
CHEMBL3815074
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 | CHEMBL3815074 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WVXFPLPIKDKMON-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
302.3
MW (Da)
3.31
ALogP
4
HBA
2
HBD
66.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 8.69 | 7.7567 | 2.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 2.04 | nM | 8.69 | Inhibition of recombinant human EGFR expressed in baculovirus by fluorescence ba... | 27288180 |
| Epidermal growth factor receptor | IC50 | = | 39.0 | nM | 7.41 | Inhibition of wild type EGFR (unknown origin) expressed in mouse BaF/3 cells ass... | 27288180 |
| Epidermal growth factor receptor | IC50 | = | 68.0 | nM | 7.17 | Inhibition of EGFR L858R mutant (unknown origin) expressed in mouse BaF/3 cells ... | 27288180 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27288180 | 10.1016/j.bmc.2016.05.063 | Epidermal growth factor receptor | 3 |
Data from ChEMBL 36 via Core Engine