Compound Detail
CHEMBL2426290
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Basic Information
| ChEMBL ID | CHEMBL2426290 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FKHFNUOLPRKNAT-SOFGYWHQSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
461.5
MW (Da)
3.74
ALogP
8
HBA
2
HBD
96.7
PSA (Ų)
0.39
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 6.66 | 5.9333 | 220.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 220.0 | nM | 6.66 | Inhibition of EGFR L858R/T790M double mutant phosphorylation in human NCI-H1975 ... | 23930994 |
| Epidermal growth factor receptor | IC50 | = | 380.0 | nM | 6.42 | Inhibition of EGFR exon 19 deletion activating mutant phosphorylation in human P... | 23930994 |
| Epidermal growth factor receptor | IC50 | = | 19000.0 | nM | 4.72 | Inhibition of wild type EGFR phosphorylation in human LoVo cells after 2 hrs by ... | 23930994 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23930994 | 10.1021/jm400822z | Epidermal growth factor receptor | 3 |
| 23930994 | 10.1021/jm400822z | No relevant target | 1 |
| 23930994 | 10.1021/jm400822z | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine