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canSAR745889
FEATURES
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NAMES
    SMILES
    Cn1cc(NC(=O)c2cc(NC(=O)CCCC(=O)Nc3cc(C(=O)Nc4cc(C(=O)NCCC(=N)N)n(C)c4)n(C)c3)cn2C)cc1C(=O)NCCC(=N)N
    InChI
    InChI=1S/C35H46N14O6/c1-46-18-22(14-24(46)32(52)40-10-8-28(36)37)44-34(54)26-12-20(16-48(26)3)42-30(50)6-5-7-31(51)43-21-13-27(49(4)17-21)35(55)45-23-15-25(47(2)19-23)33(53)41-11-9-29(38)39/h12-19H,5-11H2,1-4H3,(H3,36,37)(H3,38,39)(H,40,52)(H,41,53)(H,42,50)(H,43,51)(H,44,54)(H,45,55)
    MOLECULAR FORMULA
    C35H46N14O6
    CROSS REFERENCES
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    canSAR745889

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 758.37
    AlogP 1.40
    HBond donors 12
    HBond acceptors 20
    Atoms 101
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR745889.