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

CHEMBL459616

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
C[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@H](O)[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL459616
Phase Preclinical
Structure Type MOL
InChI Key WUESMFFURQTTOA-ZRGMHRHVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

490.7
MW (Da)
3.76
ALogP
5
HBA
5
HBD
118.2
PSA (Ų)
0.36
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C29H46O6
MW 490.68
Aromatic Rings 0
Heavy Atoms 35
NP-Likeness 3.06

Literature References

PubMed DOI Target Context # Activities
11473413 10.1021/np0100237 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine