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Compound Detail

CHEMBL5426514

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Cc1cc(CN2C(=O)CN(c3ccccc3C(F)(F)F)C2=O)cc(C)c1OC(C)(C)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5426514
Phase Preclinical
Structure Type MOL
InChI Key KPRBCJLTXNSTAL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

464.4
MW (Da)
4.53
ALogP
4
HBA
1
HBD
87.2
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H23F3N2O5
MW 464.44
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness -0.79

Literature References

PubMed DOI Target Context # Activities
37243609 10.1021/acs.jmedchem.2c02123 Peroxisome proliferator-activated receptor alpha 1
37243609 10.1021/acs.jmedchem.2c02123 Peroxisome proliferator-activated receptor delta 1
37243609 10.1021/acs.jmedchem.2c02123 Peroxisome proliferator-activated receptor gamma 1

Data from ChEMBL 36 via Core Engine