canSAR1932192
FEATURES
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NAMES
    SMILES
    O=C1C=CC(=O)c2c(O)c(N3CCN(CCOCCO)CC3)c(Br)c(O)c21
    InChI
    InChI=1S/C18H21BrN2O6/c19-15-16(21-5-3-20(4-6-21)7-9-27-10-8-22)18(26)14-12(24)2-1-11(23)13(14)17(15)25/h1-2,22,25-26H,3-10H2
    MOLECULAR FORMULA
    C18H21BrN2O6
    CROSS REFERENCES
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    canSAR1932192
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight440.06
    AlogP0.93
    HBond donors3
    HBond acceptors8
    Atoms48
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932192.