Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL3901482

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
COc1ccc(C(C)C)cc1C1=C(CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)OCc2ccccc2)CC(C)(C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3901482
Phase Preclinical
Structure Type MOL
InChI Key PAUIWMQLGVAEIR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

647.7
MW (Da)
10.66
ALogP
3
HBA
0
HBD
38.8
PSA (Ų)
0.22
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H39F6NO3
MW 647.70
Aromatic Rings 3
Heavy Atoms 46
NP-Likeness -0.24

Literature References

PubMed DOI Target Context # Activities
27490022 10.1016/j.ejmech.2016.07.065 Cholesteryl ester transfer protein 1

Data from ChEMBL 36 via Core Engine