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canSAR1510345
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NAMES
    SMILES
    CNC(=O)c1c(NC(=O)c2nc(C3CC3)ccc2Nc2cncnc2)cnn1CCOC
    InChI
    InChI=1S/C21H24N8O3/c1-22-21(31)19-17(11-25-29(19)7-8-32-2)28-20(30)18-16(26-14-9-23-12-24-10-14)6-5-15(27-18)13-3-4-13/h5-6,9-13,26H,3-4,7-8H2,1-2H3,(H,22,31)(H,28,30)
    MOLECULAR FORMULA
    C21H24N8O3
    CROSS REFERENCES
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    canSAR1510345

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.20
    AlogP 1.95
    HBond donors 3
    HBond acceptors 11
    Atoms 56
    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 canSAR1510345.