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canSAR552512
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NAMES
    SMILES
    c1ccc2c(c1)ccc[n+]2CCCCCCCCCC[n+]1cccc2ccccc21
    InChI
    InChI=1S/C28H34N2/c1(3-5-11-21-29-23-13-17-25-15-7-9-19-27(25)29)2-4-6-12-22-30-24-14-18-26-16-8-10-20-28(26)30/h7-10,13-20,23-24H,1-6,11-12,21-22H2/q+2
    MOLECULAR FORMULA
    C28H34N2+2
    CROSS REFERENCES
    552512 logo

    canSAR552512

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.27
    AlogP 6.39
    HBond donors 0
    HBond acceptors 2
    Atoms 64
    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 canSAR552512.