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canSAR1726042
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NAMES
    SMILES
    CCS(=O)(=O)Nc1ccc(C2=NN(S(=O)(=O)CC)C(c3cccs3)C2)cc1
    InChI
    InChI=1S/C17H21N3O4S3/c1-3-26(21,22)19-14-9-7-13(8-10-14)15-12-16(17-6-5-11-25-17)20(18-15)27(23,24)4-2/h5-11,16,19H,3-4,12H2,1-2H3
    MOLECULAR FORMULA
    C17H21N3O4S3
    CROSS REFERENCES
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    canSAR1726042

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.07
    AlogP 3.01
    HBond donors 1
    HBond acceptors 7
    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 canSAR1726042.