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canSAR1826139
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NAMES
    SMILES
    Cc1nnc(N/N=C/c2cc(C)n(-c3ccc(F)cc3)c2C)n1N
    InChI
    InChI=1S/C16H18FN7/c1-10-8-13(9-19-21-16-22-20-12(3)24(16)18)11(2)23(10)15-6-4-14(17)5-7-15/h4-9H,18H2,1-3H3,(H,21,22)/b19-9+
    MOLECULAR FORMULA
    C16H18FN7
    CROSS REFERENCES
    1826139 logo

    canSAR1826139

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 327.16
    AlogP 2.29
    HBond donors 3
    HBond acceptors 7
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1826139.