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canSAR659940
FEATURES
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NAMES
    SMILES
    CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)c(CCCCC)c2)cc1CCCCC
    InChI
    InChI=1S/C42H74N2/c1-5-9-21-27-39-31-35-43(37-41(39)29-23-11-7-3)33-25-19-17-15-13-14-16-18-20-26-34-44-36-32-40(28-22-10-6-2)42(38-44)30-24-12-8-4/h31-32,35-38H,5-30,33-34H2,1-4H3/q+2
    MOLECULAR FORMULA
    C42H74N2+2
    CROSS REFERENCES
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    canSAR659940

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 606.58
    AlogP 11.79
    HBond donors 0
    HBond acceptors 2
    Atoms 118
    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 canSAR659940.