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canSAR785939
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NAMES
    SMILES
    CCOc1ccc(Br)cc1C=C1SC(=Nc2ccccc2CC)N(c2ccccc2CC)C1=O
    InChI
    InChI=1S/C28H27BrN2O2S/c1-4-19-11-7-9-13-23(19)30-28-31(24-14-10-8-12-20(24)5-2)27(32)26(34-28)18-21-17-22(29)15-16-25(21)33-6-3/h7-18H,4-6H2,1-3H3
    MOLECULAR FORMULA
    C28H27BrN2O2S
    CROSS REFERENCES
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    canSAR785939

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.10
    AlogP 7.78
    HBond donors 0
    HBond acceptors 4
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR785939.