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canSAR2083341
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NAMES
    SMILES
    Cc1nc(NC(C)c2cccc(-c3cnn(C)c3)c2)cc(-c2ccc3c(c2)CCO3)n1
    InChI
    InChI=1S/C25H25N5O/c1-16(18-5-4-6-19(11-18)22-14-26-30(3)15-22)27-25-13-23(28-17(2)29-25)20-7-8-24-21(12-20)9-10-31-24/h4-8,11-16H,9-10H2,1-3H3,(H,27,28,29)
    MOLECULAR FORMULA
    C25H25N5O
    CROSS REFERENCES
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    canSAR2083341

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.21
    AlogP 4.96
    HBond donors 1
    HBond acceptors 6
    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 canSAR2083341.