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canSAR1435319
FEATURES
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NAMES
    SMILES
    CCCCCC(=O)NN=Cc1cc(Br)c(O)c(OC)c1
    InChI
    InChI=1S/C14H19BrN2O3/c1-3-4-5-6-13(18)17-16-9-10-7-11(15)14(19)12(8-10)20-2/h7-9,19H,3-6H2,1-2H3,(H,17,18)
    MOLECULAR FORMULA
    C14H19BrN2O3
    CROSS REFERENCES
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    canSAR1435319

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.06
    AlogP 3.19
    HBond donors 2
    HBond acceptors 5
    Atoms 39
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1435319.