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Compound Detail

CHEMBL575589

(-)-GOSSYPOL HEXAMETHYL ETHER
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COc1c(OC)c2c3c(c(-c4c(C)cc5c(C(C)C)c(OC)c(OC)c6c5c4OC6OC)c(C)cc3c1C(C)C)OC2OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL575589
Name (-)-GOSSYPOL HEXAMETHYL ETHER
Phase Preclinical
Structure Type MOL
InChI Key UWDFASQFKMYRRO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

602.7
MW (Da)
8.63
ALogP
8
HBA
0
HBD
73.8
PSA (Ų)
0.19
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H42O8
MW 602.72
Aromatic Rings 4
Heavy Atoms 44
NP-Likeness 0.76

Literature References

PubMed DOI Target Context # Activities
19447525 10.1016/j.ejmech.2009.04.025 NON-PROTEIN TARGET 4
19447525 10.1016/j.ejmech.2009.04.025 HeLa 2

Data from ChEMBL 36 via Core Engine