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Cassiarin A Butyl Ether
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NAMES
  • Cassiarin A butyl ether
SMILES
CCCCOc1cc2cc(C)nc3cc(C)oc(c1)c23
InChI
InChI=1S/C17H19NO2/c1-4-5-6-19-14-9-13-7-11(2)18-15-8-12(3)20-16(10-14)17(13)15/h7-10H,4-6H2,1-3H3
MOLECULAR FORMULA
C17H19NO2
CROSS REFERENCES
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Cassiarin A Butyl Ether

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 269.14
AlogP 4.78
HBond donors 0
HBond acceptors 3
Atoms 39
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Cassiarin A Butyl Ether.