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canSAR565190
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NAMES
    SMILES
    C=C1CC(COc2cc(C(=O)Nc3cc(C(=O)Nc4cc(C(=O)Nc5cc(C(=O)NCCC(=N)N)n(C)c5)n(C)c4)n(C)c3)n(C)n2)(c2ccc(Cl)cc2)OC1=O
    InChI
    InChI=1S/C38H40ClN11O7/c1-21-16-38(57-37(21)55,22-6-8-23(39)9-7-22)20-56-32-15-30(50(5)46-32)36(54)45-26-14-29(49(4)19-26)35(53)44-25-13-28(48(3)18-25)34(52)43-24-12-27(47(2)17-24)33(51)42-11-10-31(40)41/h6-9,12-15,17-19H,1,10-11,16,20H2,2-5H3,(H3,40,41)(H,42,51)(H,43,52)(H,44,53)(H,45,54)
    MOLECULAR FORMULA
    C38H40ClN11O7
    CROSS REFERENCES
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    canSAR565190

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 797.28
    AlogP 3.68
    HBond donors 7
    HBond acceptors 18
    Atoms 97
    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 canSAR565190.