Compound Detail
CHEMBL127611
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Basic Information
| ChEMBL ID | CHEMBL127611 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OUDUEUZRZJNOKY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
494.4
MW (Da)
0.40
ALogP
10
HBA
6
HBD
155.1
PSA (Ų)
0.25
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 8.49 | 8.49 | 3.2 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 3.2 | nM | 8.49 | Inhibition of phosphorylation of polyglutamic acid/tyrosine random copolymer by ... | 9397172 |
| Epidermal growth factor receptor | IC50 | = | 3.236 | nM | 8.49 | Inhibition of human recombinant EGFR | 19170633 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9397172 | 10.1021/jm970366v | Epidermal growth factor receptor | 1 |
| 19170633 | 10.1021/jm800829v | Epidermal growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine