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Diallate
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NAMES
  • Diallate
SMILES
CC(C)N(C(=O)SC/C(Cl)=C/Cl)C(C)C
InChI
InChI=1S/C10H17Cl2NOS/c1-7(2)13(8(3)4)10(14)15-6-9(12)5-11/h5,7-8H,6H2,1-4H3/b9-5-
MOLECULAR FORMULA
C10H17Cl2NOS
CROSS REFERENCES
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Diallate

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 269.04
AlogP 4.28
HBond donors 0
HBond acceptors 2
Atoms 32
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Diallate.