canSAR736418
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cccc(-c2nc3ccc(Br)cn3c2NC2CCCC2)c1
    InChI
    InChI=1S/C18H17BrN4O2/c19-13-8-9-16-21-17(12-4-3-7-15(10-12)23(24)25)18(22(16)11-13)20-14-5-1-2-6-14/h3-4,7-11,14,20H,1-2,5-6H2
    MOLECULAR FORMULA
    C18H17BrN4O2
    CROSS REFERENCES
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    canSAR736418
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight400.05
    AlogP5.03
    HBond donors1
    HBond acceptors6
    Atoms42
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR736418.