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

CHEMBL392672

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)OC[C@H]1O[C@@H](OC(=O)[C@]23CC[C@@H](C)[C@H](C)[C@H]2C2=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL392672
Phase Preclinical
Structure Type MOL
InChI Key HFCJKCZWSYKRDW-XVTJDCLZSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

803.0
MW (Da)
5.60
ALogP
13
HBA
2
HBD
181.2
PSA (Ų)
0.18
QED
3
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C44H66O13
MW 803.00
Aromatic Rings 0
Heavy Atoms 57
NP-Likeness 2.50

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
17869102 10.1016/j.bmcl.2007.08.057 Unchecked 1

Data from ChEMBL 36 via Core Engine