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canSAR552150
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NAMES
    SMILES
    CN(C)c1cc[n+](Cc2cccc(-c3cccc(C[n+]4ccc(N(C)C)c5ccccc54)c3)c2)c2ccccc12
    InChI
    InChI=1S/C36H36N4/c1-37(2)33-19-21-39(35-17-7-5-15-31(33)35)25-27-11-9-13-29(23-27)30-14-10-12-28(24-30)26-40-22-20-34(38(3)4)32-16-6-8-18-36(32)40/h5-24H,25-26H2,1-4H3/q+2
    MOLECULAR FORMULA
    C36H36N4+2
    CROSS REFERENCES
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    canSAR552150

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.29
    AlogP 6.46
    HBond donors 0
    HBond acceptors 4
    Atoms 76
    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 canSAR552150.