canSAR2165316
FEATURES
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NAMES
    SMILES
    O=S(=O)(c1ccc2ccccc2c1)N1CCN(c2nc(N3CCOCC3)ncc2Br)CC1
    InChI
    InChI=1S/C22H24BrN5O3S/c23-20-16-24-22(27-11-13-31-14-12-27)25-21(20)26-7-9-28(10-8-26)32(29,30)19-6-5-17-3-1-2-4-18(17)15-19/h1-6,15-16H,7-14H2
    MOLECULAR FORMULA
    C22H24BrN5O3S
    CROSS REFERENCES
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    canSAR2165316
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight517.08
    AlogP2.74
    HBond donors0
    HBond acceptors8
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2165316.