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canSAR549129
FEATURES
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NAMES
    SMILES
    CCCCCCC[N+](CC)(CC)C/C=C\Cc1ccc(Cl)cc1
    InChI
    InChI=1S/C21H35ClN/c1-4-7-8-9-11-18-23(5-2,6-3)19-12-10-13-20-14-16-21(22)17-15-20/h10,12,14-17H,4-9,11,13,18-19H2,1-3H3/q+1/b12-10-
    MOLECULAR FORMULA
    C21H35ClN+
    CROSS REFERENCES
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    canSAR549129

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 336.25
    AlogP 6.27
    HBond donors 0
    HBond acceptors 1
    Atoms 58
    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 canSAR549129.