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canSAR1489741
FEATURES
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NAMES
    SMILES
    COc1ccccc1NC(=O)CSc1oc(-c2ccco2)nc1S(=O)(=O)c1ccc(Br)cc1
    InChI
    InChI=1S/C22H17BrN2O6S2/c1-29-17-6-3-2-5-16(17)24-19(26)13-32-22-21(25-20(31-22)18-7-4-12-30-18)33(27,28)15-10-8-14(23)9-11-15/h2-12H,13H2,1H3,(H,24,26)
    MOLECULAR FORMULA
    C22H17BrN2O6S2
    CROSS REFERENCES
    1489741 logo

    canSAR1489741

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 547.97
    AlogP 5.27
    HBond donors 1
    HBond acceptors 8
    Atoms 50
    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 canSAR1489741.