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Compound Detail

CHEMBL5077770

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Fc1cc(Nc2ccnc3ccc(C(F)(F)F)cc23)cc(F)c1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5077770
Phase Preclinical
Structure Type MOL
InChI Key KVQLKUKPSPOLRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

342.2
MW (Da)
5.41
ALogP
2
HBA
1
HBD
24.9
PSA (Ų)
0.50
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H8F6N2
MW 342.24
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.54

Literature References

PubMed DOI Target Context # Activities
34624490 10.1016/j.bmcl.2021.128407 dengue virus type 2 1
34624490 10.1016/j.bmcl.2021.128407 Huh-7 1
34624490 10.1016/j.bmcl.2021.128407 Venezuelan equine encephalitis virus 1
34624490 10.1016/j.bmcl.2021.128407 U-87 MG 1

Data from ChEMBL 36 via Core Engine