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Compound Detail

CHEMBL379363

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COc1ccc(/C=C/C=C/C=C/c2ccc(OC)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL379363
Phase Preclinical
Structure Type MOL
InChI Key ZZEXRQNWFCTKHJ-OKWWDJPNSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

292.4
MW (Da)
4.99
ALogP
2
HBA
0
HBD
18.5
PSA (Ų)
0.70
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20O2
MW 292.38
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 0.24

Literature References

PubMed DOI Target Context # Activities
16640346 10.1021/jm051020k Amyloid-beta precursor protein 2

Data from ChEMBL 36 via Core Engine