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canSAR743531
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NAMES
    SMILES
    Br.CN(C)C(=N)N/N=C/c1ccc(OCc2cn3ccccc3[n+]2C)cc1.[Br-]
    InChI
    InChI=1S/C19H23N6O.2BrH/c1-23(2)19(20)22-21-12-15-7-9-17(10-8-15)26-14-16-13-25-11-5-4-6-18(25)24(16)3;;/h4-13H,14H2,1-3H3,(H2,20,22);2*1H/q+1;;/p-1/b21-12+;;
    MOLECULAR FORMULA
    C19H24Br2N6O
    CROSS REFERENCES
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    canSAR743531

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.04
    AlogP -0.66
    HBond donors 2
    HBond acceptors 7
    Atoms 52
    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 canSAR743531.