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

CHEMBL593707

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)(Cl)C(O)COc1c2c(cc3oc(=O)ccc13)OCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL593707
Phase Preclinical
Structure Type MOL
InChI Key XHMFVXPQWOFICF-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

326.7
MW (Da)
2.28
ALogP
6
HBA
1
HBD
78.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H15ClO6
MW 326.73
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 1.40

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
19716307 10.1016/j.bmc.2009.08.002 U-937 2

Data from ChEMBL 36 via Core Engine