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canSAR349704
FEATURES
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NAMES
    SMILES
    O=C(N/C(C(=O)N1CCCCC1)=C(/Br)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C21H19BrFN3O4/c22-18(14-4-8-16(23)9-5-14)19(21(28)25-12-2-1-3-13-25)24-20(27)15-6-10-17(11-7-15)26(29)30/h4-11H,1-3,12-13H2,(H,24,27)/b19-18+
    MOLECULAR FORMULA
    C21H19BrFN3O4
    CROSS REFERENCES
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    canSAR349704

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.05
    AlogP 4.24
    HBond donors 1
    HBond acceptors 7
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR349704.