Compound Detail
CHEMBL171256
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Basic Information
| ChEMBL ID | CHEMBL171256 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CTAZKUKBHBXUFJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
374.4
MW (Da)
3.47
ALogP
6
HBA
2
HBD
86.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 4.84 | 4.84 | 14400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 14400.0 | nM | 4.84 | Inhibition of Epidermal growth factor receptor (EGF-R) tyrosine kinase activity | 11277535 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11277535 | 10.1016/s0960-894x(01)00079-8 | Proto-oncogene tyrosine-protein kinase Src | 2 |
| 11277535 | 10.1016/s0960-894x(01)00079-8 | Epidermal growth factor receptor | 1 |
| 11277535 | 10.1016/s0960-894x(01)00079-8 | Tyrosine-protein kinase ABL | 1 |
Data from ChEMBL 36 via Core Engine