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canSAR1966146
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)CC2C(=O)N(c3ccc(Br)cc3)CC2CSC)cc1
    InChI
    InChI=1S/C21H23BrN2O3S/c1-27-18-9-5-16(6-10-18)23-20(25)11-19-14(13-28-2)12-24(21(19)26)17-7-3-15(22)4-8-17/h3-10,14,19H,11-13H2,1-2H3,(H,23,25)
    MOLECULAR FORMULA
    C21H23BrN2O3S
    CROSS REFERENCES
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    canSAR1966146

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.06
    AlogP 4.43
    HBond donors 1
    HBond acceptors 5
    Atoms 51
    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 canSAR1966146.