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

CHEMBL5563435

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
CC(C)(C)c1ccc(CN(C(=O)C2CCCC2)c2ccc(CC(=O)NCc3ccc4c(c3)OCO4)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5563435
Phase Preclinical
Structure Type MOL
InChI Key FOENCXMMLSNUMB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

526.7
MW (Da)
6.30
ALogP
4
HBA
1
HBD
67.9
PSA (Ų)
0.37
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H38N2O4
MW 526.68
Aromatic Rings 3
Heavy Atoms 39
NP-Likeness -1.18

Literature References

PubMed DOI Target Context # Activities
38043493 10.1016/j.ejmech.2023.115992 Bile acid receptor 2

Data from ChEMBL 36 via Core Engine