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canSAR1270137
FEATURES
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NAMES
    SMILES
    CCOc1cccc2c1OCC(C(=O)NS(=O)(=O)c1ccc(Br)s1)=C2
    InChI
    InChI=1S/C16H14BrNO5S2/c1-2-22-12-5-3-4-10-8-11(9-23-15(10)12)16(19)18-25(20,21)14-7-6-13(17)24-14/h3-8H,2,9H2,1H3,(H,18,19)
    MOLECULAR FORMULA
    C16H14BrNO5S2
    CROSS REFERENCES
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    canSAR1270137

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.95
    AlogP 3.19
    HBond donors 1
    HBond acceptors 6
    Atoms 39
    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 canSAR1270137.