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

CHEMBL2205241

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
COc1cc(C)oc(=O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2205241
Phase Preclinical
Structure Type MOL
InChI Key MTZAUZNQAMNFME-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

140.1
MW (Da)
0.96
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.58
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 C7H8O3
MW 140.14
Aromatic Rings 1
Heavy Atoms 10
NP-Likeness 0.54

Literature References

PubMed DOI Target Context # Activities
22925447 10.1016/j.bmc.2012.07.043 U-937 4
22925447 10.1016/j.bmc.2012.07.043 No relevant target 1

Data from ChEMBL 36 via Core Engine