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Compound Detail

CHEMBL611349

FRAXINOL
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COc1cc2oc(=O)ccc2c(OC)c1O

Basic Information

ChEMBL ID CHEMBL611349
Name FRAXINOL
Phase Preclinical
Structure Type MOL
InChI Key PBPNOAHYDPHKFH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

222.2
MW (Da)
1.52
ALogP
5
HBA
1
HBD
68.9
PSA (Ų)
0.78
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 C11H10O5
MW 222.20
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness 1.29

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