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canSAR387005
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NAMES
    SMILES
    C[C@@H](NCc1cc(Br)cc2nc(O)c(O)nc12)P(=O)(O)O
    InChI
    InChI=1S/C11H13BrN3O5P/c1-5(21(18,19)20)13-4-6-2-7(12)3-8-9(6)15-11(17)10(16)14-8/h2-3,5,13H,4H2,1H3,(H,14,16)(H,15,17)(H2,18,19,20)/t5-/m0/s1
    MOLECULAR FORMULA
    C11H13BrN3O5P
    CROSS REFERENCES
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    canSAR387005

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.98
    AlogP 1.42
    HBond donors 5
    HBond acceptors 8
    Atoms 34
    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 canSAR387005.