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canSAR779605
FEATURES
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NAMES
    SMILES
    Cc1ccc(S(=O)(=O)/C(=C/c2c(O)cc(O)cc2O)C(=O)c2ccc(Br)cc2)cc1
    InChI
    InChI=1S/C22H17BrO6S/c1-13-2-8-17(9-3-13)30(28,29)21(22(27)14-4-6-15(23)7-5-14)12-18-19(25)10-16(24)11-20(18)26/h2-12,24-26H,1H3/b21-12+
    MOLECULAR FORMULA
    C22H17BrO6S
    CROSS REFERENCES
    779605 logo

    canSAR779605

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 487.99
    AlogP 4.57
    HBond donors 3
    HBond acceptors 6
    Atoms 47
    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 canSAR779605.