canSAR587336
FEATURES
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NAMES
    SMILES
    COc1cc2nc(c1)CNCCCN(Cc1ccc(CN3CCCNCc4cc(OC)cc(n4)CNCCC3)cc1)CCCNC2
    InChI
    InChI=1S/C36H54N8O2/c1-45-35-19-31-23-37-11-3-15-43(16-4-12-38-24-32(20-35)41-31)27-29-7-9-30(10-8-29)28-44-17-5-13-39-25-33-21-36(46-2)22-34(42-33)26-40-14-6-18-44/h7-10,19-22,37-40H,3-6,11-18,23-28H2,1-2H3
    MOLECULAR FORMULA
    C36H54N8O2
    CROSS REFERENCES
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    canSAR587336
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight630.44
    AlogP3.44
    HBond donors4
    HBond acceptors10
    Atoms100
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR587336.