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canSAR1130584
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NAMES
    SMILES
    CN(C)CCCNc1nc(-c2ccccc2NC(=O)c2ccc(NC(=O)CN3CCN(C)CC3)cc2)nc2ccccc12
    InChI
    InChI=1S/C33H40N8O2/c1-39(2)18-8-17-34-31-26-9-4-6-11-28(26)36-32(38-31)27-10-5-7-12-29(27)37-33(43)24-13-15-25(16-14-24)35-30(42)23-41-21-19-40(3)20-22-41/h4-7,9-16H,8,17-23H2,1-3H3,(H,35,42)(H,37,43)(H,34,36,38)
    MOLECULAR FORMULA
    C33H40N8O2
    CROSS REFERENCES
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    canSAR1130584

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 580.33
    AlogP 4.10
    HBond donors 3
    HBond acceptors 10
    Atoms 83
    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 canSAR1130584.