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canSAR2018254
FEATURES
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NAMES
    SMILES
    CCOc1ccc(NC(=O)c2c(NC(=O)c3ccccc3Br)sc3c2CCC(C)C3)cc1
    InChI
    InChI=1S/C25H25BrN2O3S/c1-3-31-17-11-9-16(10-12-17)27-24(30)22-19-13-8-15(2)14-21(19)32-25(22)28-23(29)18-6-4-5-7-20(18)26/h4-7,9-12,15H,3,8,13-14H2,1-2H3,(H,27,30)(H,28,29)
    MOLECULAR FORMULA
    C25H25BrN2O3S
    CROSS REFERENCES
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    canSAR2018254

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 512.08
    AlogP 6.54
    HBond donors 2
    HBond acceptors 5
    Atoms 57
    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 canSAR2018254.