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Compound Detail

CHEMBL5218531

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CN1C(=O)[C@@]2(C)[C@@H]3CC[C@@H](O3)[C@@]2(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5218531
Phase Preclinical
Structure Type MOL
InChI Key WUQNOBSCYAIJIH-FIPCFZRWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

209.2
MW (Da)
0.56
ALogP
3
HBA
0
HBD
46.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H15NO3
MW 209.25
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness 1.31

Literature References

PubMed DOI Target Context # Activities
33454654 10.1016/j.bmc.2021.116012 Hep 3B2 1

Data from ChEMBL 36 via Core Engine