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Compound Detail

CHEMBL1796019

BENZYLPHENYLETHER
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c1ccc(COc2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1796019
Name BENZYLPHENYLETHER
Phase Preclinical
Structure Type MOL
InChI Key BOTNYLSAWDQNEX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

184.2
MW (Da)
3.27
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H12O
MW 184.24
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.63

Literature References

PubMed DOI Target Context # Activities
21514702 10.1016/j.ejmech.2011.03.057 Calmodulin-1 1
21514702 10.1016/j.ejmech.2011.03.057 Unchecked 1

Data from ChEMBL 36 via Core Engine