Compound Detail
CHEMBL3628791
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Basic Information
| ChEMBL ID | CHEMBL3628791 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SDZQYPACAPOYTG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
279.7
MW (Da)
4.23
ALogP
4
HBA
1
HBD
37.8
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.53
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 5.53 | 5.53 | 2980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 2980.0 | nM | 5.53 | Inhibition of human EGFR after 1 hr using [gamma-32P]ATP | 26526740 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26526740 | 10.1016/j.bmc.2015.10.035 | Epidermal growth factor receptor | 1 |
| 26526740 | 10.1016/j.bmc.2015.10.035 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine