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Compound Detail

CHEMBL2397752

(3R)-SATIVANONE
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COc1ccc([C@@H]2COc3cc(O)ccc3C2=O)c(OC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2397752
Name (3R)-SATIVANONE
Phase Preclinical
Structure Type MOL
InChI Key JOVYBWHPTQRVNZ-AWEZNQCLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

300.3
MW (Da)
2.77
ALogP
5
HBA
1
HBD
65.0
PSA (Ų)
0.94
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H16O5
MW 300.31
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 1.18

Literature References

PubMed DOI Target Context # Activities
23743282 10.1016/j.bmcl.2013.04.032 ADMET 1
23743282 10.1016/j.bmcl.2013.04.032 NON-PROTEIN TARGET 1
29482940 10.1016/j.bmcl.2018.02.026 BV-2 1

Data from ChEMBL 36 via Core Engine