Compound Detail
CHEMBL1980163
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Basic Information
| ChEMBL ID | CHEMBL1980163 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CQXFMKMVOOUGSS-UHFFFAOYSA-N |
9
Targets
9
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
327.4
MW (Da)
4.95
ALogP
4
HBA
1
HBD
47.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 9 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | Ki | 7.0 | 7.0 | 100.0 | 1 |
| Receptor tyrosine-protein kinase erbB-2 CHEMBL1824 | Ki | 6.5 | 6.5 | 316.2 | 1 |
| Receptor tyrosine-protein kinase erbB-4 CHEMBL3009 | Ki | 6.4 | 6.4 | 398.1 | 1 |
| Aurora kinase B CHEMBL2185 | Ki | 6.3 | 6.3 | 501.2 | 1 |
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | Ki | 6.1 | 6.1 | 794.3 | 1 |
| Proto-oncogene tyrosine-protein kinase ROS CHEMBL5568 | Ki | 6.1 | 6.1 | 794.3 | 1 |
| Serine/threonine-protein kinase Chk2 CHEMBL2527 | Ki | 5.9 | 5.9 | 1258.9 | 1 |
| MAP kinase-interacting serine/threonine-protein kinase 2 CHEMBL4204 | Ki | 5.4 | 5.4 | 3981.1 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | Ki | 5.3 | 5.3 | 5011.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine