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canSAR1270557
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NAMES
    SMILES
    Cn1c(=O)c2c(nc(CN3CCC(C(N)=O)CC3)n2CCCc2ccccc2)n(C)c1=O
    InChI
    InChI=1S/C23H30N6O3/c1-26-21-19(22(31)27(2)23(26)32)29(12-6-9-16-7-4-3-5-8-16)18(25-21)15-28-13-10-17(11-14-28)20(24)30/h3-5,7-8,17H,6,9-15H2,1-2H3,(H2,24,30)
    MOLECULAR FORMULA
    C23H30N6O3
    CROSS REFERENCES
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    canSAR1270557

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.24
    AlogP 0.76
    HBond donors 2
    HBond acceptors 9
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1270557.