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Compound Detail

CHEMBL5416016

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CCOC(=O)COC(=O)Nc1ccccc1OC(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5416016
Phase Preclinical
Structure Type MOL
InChI Key JJQAJXDMEVJIKI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

307.2
MW (Da)
2.70
ALogP
5
HBA
1
HBD
73.9
PSA (Ų)
0.85
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12F3NO5
MW 307.22
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -1.31

Literature References

PubMed DOI Target Context # Activities
37874905 10.1021/acs.jmedchem.3c01398 NACHT, LRR and PYD domains-containing protein 3 2

Data from ChEMBL 36 via Core Engine