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Compound Detail

CHEMBL391981

ERYCIBENIN F
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COc1ccc([C@@H]2CCc3c(OC)cc(OC)cc3O2)c(OC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL391981
Name ERYCIBENIN F
Phase Preclinical
Structure Type MOL
InChI Key PMRQWIMUVQIZNP-INIZCTEOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

330.4
MW (Da)
3.79
ALogP
5
HBA
0
HBD
46.1
PSA (Ų)
0.83
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C19H22O5
MW 330.38
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.94

Literature References

PubMed DOI Target Context # Activities
17158054 10.1016/j.bmc.2006.09.024 U-937 3

Data from ChEMBL 36 via Core Engine