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canSAR2208720
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NAMES
    SMILES
    [C-]#[N+]c1c(F)ccc([C@H]2CN3CCN(C(=O)Cc4cnc(-n5cnnn5)nc4C)C[C@@H]3CO2)c1C
    InChI
    InChI=1S/C23H24FN9O2/c1-14-18(4-5-19(24)22(14)25-3)20-11-31-6-7-32(10-17(31)12-35-20)21(34)8-16-9-26-23(28-15(16)2)33-13-27-29-30-33/h4-5,9,13,17,20H,6-8,10-12H2,1-2H3/t17-,20-/m1/s1
    MOLECULAR FORMULA
    C23H24FN9O2
    CROSS REFERENCES
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    canSAR2208720

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.20
    AlogP 1.59
    HBond donors 0
    HBond acceptors 11
    Atoms 59
    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 canSAR2208720.