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canSAR2281332
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NAMES
    SMILES
    Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3cc(-c4ccccc4)n[nH]3)cc2)n1
    InChI
    InChI=1S/C22H20N6O3S/c1-14-12-15(2)24-22(23-14)28-32(30,31)18-10-8-17(9-11-18)25-21(29)20-13-19(26-27-20)16-6-4-3-5-7-16/h3-13H,1-2H3,(H,25,29)(H,26,27)(H,23,24,28)
    MOLECULAR FORMULA
    C22H20N6O3S
    CROSS REFERENCES
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    canSAR2281332

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.13
    AlogP 3.54
    HBond donors 3
    HBond acceptors 9
    Atoms 52
    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 canSAR2281332.