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canSAR2085446
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NAMES
    SMILES
    Nc1ncc(Br)c2c1ncn2C1=C[C@H](CO)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C12H13BrN4O3/c13-6-2-15-12(14)8-9(6)17(4-16-8)7-1-5(3-18)10(19)11(7)20/h1-2,4-5,10-11,18-20H,3H2,(H2,14,15)/t5-,10-,11+/m1/s1
    MOLECULAR FORMULA
    C12H13BrN4O3
    CROSS REFERENCES
    2085446 logo

    canSAR2085446

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.02
    AlogP -0.04
    HBond donors 5
    HBond acceptors 7
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2085446.