canSAR2147816
FEATURES
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NAMES
    SMILES
    CCS(=O)(=O)c1ccc(Cl)cc1CNC(=O)c1cc(Br)cc(CN2CCN(C)CC2)c1
    InChI
    InChI=1S/C22H27BrClN3O3S/c1-3-31(29,30)21-5-4-20(24)13-18(21)14-25-22(28)17-10-16(11-19(23)12-17)15-27-8-6-26(2)7-9-27/h4-5,10-13H,3,6-9,14-15H2,1-2H3,(H,25,28)
    MOLECULAR FORMULA
    C22H27BrClN3O3S
    CROSS REFERENCES
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    canSAR2147816
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight527.06
    AlogP3.57
    HBond donors1
    HBond acceptors6
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2147816.