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Compound Detail

CHEMBL3298699

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CCCCCCCCCCC[C@H](O)[C@H](C)NC(C)=O

Basic Information

ChEMBL ID CHEMBL3298699
Phase Preclinical
Structure Type MOL
InChI Key IIHODMXLVYVECB-HOCLYGCPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

271.4
MW (Da)
3.79
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.53
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C16H33NO2
MW 271.45
Aromatic Rings 0
Heavy Atoms 19
NP-Likeness 0.83

Literature References

PubMed DOI Target Context # Activities
24856903 10.1021/np500171z Mycobacterium tuberculosis 2

Data from ChEMBL 36 via Core Engine