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Compound Detail

CHEMBL1834813

EGONOLPROPANOATE
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CCC(=O)OCCCc1cc(OC)c2oc(-c3ccc4c(c3)OCO4)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1834813
Name EGONOLPROPANOATE
Phase Preclinical
Structure Type MOL
InChI Key XDGRTOUNCQCWMA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

382.4
MW (Da)
4.72
ALogP
6
HBA
0
HBD
67.1
PSA (Ų)
0.43
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C22H22O6
MW 382.41
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness 0.44

Literature References

PubMed DOI Target Context # Activities
21939219 10.1021/np200308j Acetylcholinesterase 3

Data from ChEMBL 36 via Core Engine