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canSAR1991224
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NAMES
    SMILES
    C/C(C=NNC(=O)c1nn(C)c(C)c1Br)=C\c1ccccc1
    InChI
    InChI=1S/C16H17BrN4O/c1-11(9-13-7-5-4-6-8-13)10-18-19-16(22)15-14(17)12(2)21(3)20-15/h4-10H,1-3H3,(H,19,22)/b11-9+,18-10?
    MOLECULAR FORMULA
    C16H17BrN4O
    CROSS REFERENCES
    1991224 logo

    canSAR1991224

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.06
    AlogP 3.31
    HBond donors 1
    HBond acceptors 5
    Atoms 39
    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 canSAR1991224.