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canSAR502261
FEATURES
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NAMES
    SMILES
    CC[N+](C)(CCCCCCOCCCCCCCCOCCCCCC[N+](C)(CC)Cc1ccccc1OC)Cc1ccccc1OC
    InChI
    InChI=1S/C42H74N2O4/c1-7-43(3,37-39-27-17-19-29-41(39)45-5)31-21-11-15-25-35-47-33-23-13-9-10-14-24-34-48-36-26-16-12-22-32-44(4,8-2)38-40-28-18-20-30-42(40)46-6/h17-20,27-30H,7-16,21-26,31-38H2,1-6H3/q+2
    MOLECULAR FORMULA
    C42H74N2O4+2
    CROSS REFERENCES
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    canSAR502261

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 670.56
    AlogP 9.83
    HBond donors 0
    HBond acceptors 6
    Atoms 122
    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 canSAR502261.