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Compound Detail

CHEMBL227659

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COC(=O)c1ccccc1NC(=O)COc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL227659
Phase Preclinical
Structure Type MOL
InChI Key AWXAWMBJMXVXBJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

319.7
MW (Da)
3.14
ALogP
4
HBA
1
HBD
64.6
PSA (Ų)
0.86
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14ClNO4
MW 319.74
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.50

Literature References

PubMed DOI Target Context # Activities
17402724 10.1021/jm061428x Hepatitis C virus 1

Data from ChEMBL 36 via Core Engine