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

CHEMBL58102

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
CCCCCCCC(=O)OC1CC[C@H](/C=C/CCO)CC1OC(=O)CCCCCCC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL58102
Phase Preclinical
Structure Type MOL
InChI Key OCMVHHORQREAIF-NCIIQIEHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

438.6
MW (Da)
6.27
ALogP
5
HBA
1
HBD
72.8
PSA (Ų)
0.16
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H46O5
MW 438.65
Aromatic Rings 0
Heavy Atoms 31
NP-Likeness 1.29

Literature References

PubMed DOI Target Context # Activities
2362276 10.1021/jm00169a023 Unchecked 2

Data from ChEMBL 36 via Core Engine