canSAR28185
FEATURES
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NAMES
    SMILES
    COCC#CCC(NS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1)C(=O)O
    InChI
    InChI=1S/C20H19BrN2O6S/c1-29-13-3-2-4-18(20(25)26)23-30(27,28)17-11-9-16(10-12-17)22-19(24)14-5-7-15(21)8-6-14/h5-12,18,23H,4,13H2,1H3,(H,22,24)(H,25,26)
    MOLECULAR FORMULA
    C20H19BrN2O6S
    CROSS REFERENCES
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    canSAR28185
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight494.01
    AlogP2.47
    HBond donors3
    HBond acceptors8
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR28185.