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canSAR740729
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NAMES
    SMILES
    CCN1/C(=C\C=C\C2=[N+](CC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21
    InChI
    InChI=1S/C27H33N2/c1-7-28-22-16-11-9-14-20(22)26(3,4)24(28)18-13-19-25-27(5,6)21-15-10-12-17-23(21)29(25)8-2/h9-19H,7-8H2,1-6H3/q+1
    MOLECULAR FORMULA
    C27H33N2+
    CROSS REFERENCES
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    canSAR740729

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.26
    AlogP 6.34
    HBond donors 0
    HBond acceptors 2
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR740729.