Compound Detail
CHEMBL3813717
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CNc1ncnc(Oc2ccc(NC(=O)C3(C(=O)Nc4ccc(F)cc4)CC3)cc2F)c1/C=N/OC
Basic Information
| ChEMBL ID | CHEMBL3813717 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UZCWBLUZUMDXML-PNQUVVCRSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
496.5
MW (Da)
3.93
ALogP
8
HBA
3
HBD
126.8
PSA (Ų)
0.23
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27068889 | 10.1016/j.bmc.2016.03.061 | No relevant target | 1 |
| 27068889 | 10.1016/j.bmc.2016.03.061 | NON-PROTEIN TARGET | 1 |
| 27068889 | 10.1016/j.bmc.2016.03.061 | HUVEC | 1 |
| 27068889 | 10.1016/j.bmc.2016.03.061 | Hepatocyte growth factor receptor | 1 |
| 27068889 | 10.1016/j.bmc.2016.03.061 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine