canSAR1417564
FEATURES
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NAMES
    SMILES
    Nc1nc(=O)c2nc(Br)n([C@@H]3O[C@H]4COP(=O)(O)O[C@H]4[C@@H]3O)c2[nH]1
    InChI
    InChI=1S/C10H11BrN5O7P/c11-9-13-3-6(14-10(12)15-7(3)18)16(9)8-4(17)5-2(22-8)1-21-24(19,20)23-5/h2,4-5,8,17H,1H2,(H,19,20)(H3,12,14,15,18)/t2-,4-,5+,8+/m0/s1
    MOLECULAR FORMULA
    C10H11BrN5O7P
    CROSS REFERENCES
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    canSAR1417564
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight422.96
    AlogP-0.76
    HBond donors5
    HBond acceptors12
    Atoms35
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417564.