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canSAR1592246
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NAMES
    SMILES
    COc1ccc(CN2C(=NC(=O)c3ccccc3)SC3CS(=O)(=O)CC32)cc1
    InChI
    InChI=1S/C20H20N2O4S2/c1-26-16-9-7-14(8-10-16)11-22-17-12-28(24,25)13-18(17)27-20(22)21-19(23)15-5-3-2-4-6-15/h2-10,17-18H,11-13H2,1H3
    MOLECULAR FORMULA
    C20H20N2O4S2
    CROSS REFERENCES
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    canSAR1592246

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.09
    AlogP 2.61
    HBond donors 0
    HBond acceptors 6
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1592246.