canSAR1746113
FEATURES
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NAMES
    SMILES
    CCN(CCO)Cc1csc2cccc(Br)c12
    InChI
    InChI=1S/C13H16BrNOS/c1-2-15(6-7-16)8-10-9-17-12-5-3-4-11(14)13(10)12/h3-5,9,16H,2,6-8H2,1H3
    MOLECULAR FORMULA
    C13H16BrNOS
    CROSS REFERENCES
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    canSAR1746113
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight313.01
    AlogP3.48
    HBond donors1
    HBond acceptors2
    Atoms33
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746113.