Compound Detail
CHEMBL4211818
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CCOC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(F)c(F)c2)c1
Basic Information
| ChEMBL ID | CHEMBL4211818 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PVDNMYIFAZVSLI-IBGZPJMESA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
472.5
MW (Da)
3.61
ALogP
5
HBA
2
HBD
101.6
PSA (Ų)
0.54
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28688280 | 10.1016/j.ejmech.2017.06.062 | Hepatitis B virus | 1 |
| 28688280 | 10.1016/j.ejmech.2017.06.062 | PBMC | 1 |
| 28688280 | 10.1016/j.ejmech.2017.06.062 | CCRF-CEM | 1 |
| 28688280 | 10.1016/j.ejmech.2017.06.062 | Vero | 1 |
| 28688280 | 10.1016/j.ejmech.2017.06.062 | HepG2 | 1 |
Data from ChEMBL 36 via Core Engine