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Compound Detail

CHEMBL5613898

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O=C(O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(F)cc3)cc2c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5613898
Phase Preclinical
Structure Type MOL
InChI Key GNAVIDXFQAVCSH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

421.4
MW (Da)
4.61
ALogP
4
HBA
1
HBD
68.5
PSA (Ų)
0.49
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H17F2NO4
MW 421.40
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -0.94

Literature References

PubMed DOI Target Context # Activities
39291012 10.1021/acsmedchemlett.4c00268 Human immunodeficiency virus type 1 integrase 2
39291012 10.1021/acsmedchemlett.4c00268 Unchecked 2

Data from ChEMBL 36 via Core Engine