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

CHEMBL3314713

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(=O)/C=C/[C@]1(O)C(C)(O)C[C@H](O)C[C@@]1(C)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3314713
Phase Preclinical
Structure Type MOL
InChI Key KMBKVLDJXQMMRB-JXJOLMDKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

244.3
MW (Da)
-0.48
ALogP
5
HBA
4
HBD
98.0
PSA (Ų)
0.49
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C12H20O5
MW 244.29
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 2.10

Literature References

PubMed DOI Target Context # Activities
24963714 10.1021/np400831p RAW264.7 4

Data from ChEMBL 36 via Core Engine