Compound Detail
CHEMBL2023349
R428 Enter ChEMBL ID:
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Nc1nc(Nc2ccc3c(c2)CCC(N2CCCC2)CC3)nn1-c1cc2c(nn1)-c1ccccc1CCC2
Basic Information
| ChEMBL ID | CHEMBL2023349 |
| Name | R428 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KXMZDGSRSGHMMK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
506.7
MW (Da)
4.88
ALogP
8
HBA
2
HBD
97.8
PSA (Ų)
0.38
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 14.0 | nM | 7.85 | Inhibition of AXL kinase | 22247788 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22247788 | 10.1021/ml200198x | Tyrosine-protein kinase receptor UFO | 1 |
Data from ChEMBL 36 via Core Engine