canSAR1083842
FEATURES
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NAMES
    SMILES
    COC(=O)c1cc(NC(=O)c2cc(-c3ccc(NC(=O)CCCOc4cc5c(cc4OC)C(=O)N4CCC[C@H]4C=N5)cc3)cn2C)cn1C
    InChI
    InChI=1S/C36H38N6O7/c1-40-20-23(15-29(40)34(44)39-25-16-30(36(46)48-4)41(2)21-25)22-9-11-24(12-10-22)38-33(43)8-6-14-49-32-18-28-27(17-31(32)47-3)35(45)42-13-5-7-26(42)19-37-28/h9-12,15-21,26H,5-8,13-14H2,1-4H3,(H,38,43)(H,39,44)/t26-/m0/s1
    MOLECULAR FORMULA
    C36H38N6O7
    CROSS REFERENCES
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    canSAR1083842
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight666.28
    AlogP5.20
    HBond donors2
    HBond acceptors13
    Atoms87
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1083842.