canSAR1846491
FEATURES
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NAMES
    SMILES
    COc1ccc(CNC(=O)Cn2nc([N+](=O)[O-])c(Br)c2C)cc1OC
    InChI
    InChI=1S/C15H17BrN4O5/c1-9-14(16)15(20(22)23)18-19(9)8-13(21)17-7-10-4-5-11(24-2)12(6-10)25-3/h4-6H,7-8H2,1-3H3,(H,17,21)
    MOLECULAR FORMULA
    C15H17BrN4O5
    CROSS REFERENCES
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    canSAR1846491
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight412.04
    AlogP2.20
    HBond donors1
    HBond acceptors9
    Atoms42
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846491.