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canSAR343716
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NAMES
    SMILES
    C/C(=C(\F)C(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)NC#N)c1
    InChI
    InChI=1S/C24H20FN5O3S/c1-15(17-5-4-6-18(13-17)23(27)29-14-26)22(25)24(31)30-19-11-9-16(10-12-19)20-7-2-3-8-21(20)34(28,32)33/h2-13H,1H3,(H2,27,29)(H,30,31)(H2,28,32,33)/b22-15+
    MOLECULAR FORMULA
    C24H20FN5O3S
    CROSS REFERENCES
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    canSAR343716

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.13
    AlogP 3.74
    HBond donors 5
    HBond acceptors 8
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR343716.