canSAR2161274
FEATURES
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NAMES
    SMILES
    CCN(CC)CCCCC(=O)Nc1ccc(Nc2nc(-c3ccccc3NC(=O)CCCCN(CC)CC)nc3ccccc23)cc1
    InChI
    InChI=1S/C38H51N7O2/c1-5-44(6-2)27-15-13-21-35(46)39-29-23-25-30(26-24-29)40-37-32-18-10-12-20-34(32)42-38(43-37)31-17-9-11-19-33(31)41-36(47)22-14-16-28-45(7-3)8-4/h9-12,17-20,23-26H,5-8,13-16,21-22,27-28H2,1-4H3,(H,39,46)(H,41,47)(H,40,42,43)
    MOLECULAR FORMULA
    C38H51N7O2
    CROSS REFERENCES
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    canSAR2161274
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight637.41
    AlogP7.94
    HBond donors3
    HBond acceptors9
    Atoms98
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2161274.