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canSAR984765
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NAMES
    SMILES
    Cc1c(C(=O)N/N=C/c2ccccc2)nnn1Nc1ccc(Br)cc1
    InChI
    InChI=1S/C17H15BrN6O/c1-12-16(17(25)21-19-11-13-5-3-2-4-6-13)20-23-24(12)22-15-9-7-14(18)8-10-15/h2-11,22H,1H3,(H,21,25)/b19-11+
    MOLECULAR FORMULA
    C17H15BrN6O
    CROSS REFERENCES
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    canSAR984765

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.05
    AlogP 2.99
    HBond donors 2
    HBond acceptors 7
    Atoms 40
    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 canSAR984765.