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

CHEMBL504055

OBOFLAVANONE B
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
CCOC(=O)CCC[C@@H]1C[C@H]2C[C@](/C=C/c3ccccc3)(Oc3cc4c(c(O)c32)C(=O)C[C@H](c2ccccc2)O4)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL504055
Name OBOFLAVANONE B
Phase Preclinical
Structure Type MOL
InChI Key PBUGPZVNGOXMPZ-IOLYBBLISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

554.6
MW (Da)
6.90
ALogP
7
HBA
1
HBD
91.3
PSA (Ų)
0.30
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C34H34O7
MW 554.64
Aromatic Rings 3
Heavy Atoms 41
NP-Likeness 1.66

Literature References

PubMed DOI Target Context # Activities
15165150 10.1021/np030510h KB 1

Data from ChEMBL 36 via Core Engine