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canSAR672773
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc2c(c1)CCN(c1ncnc3c1ncn3C1O[C@H](CO)[C@@H](O)[C@H]1O)C2
    InChI
    InChI=1S/C19H20N6O6/c26-7-13-15(27)16(28)19(31-13)24-9-22-14-17(20-8-21-18(14)24)23-4-3-10-5-12(25(29)30)2-1-11(10)6-23/h1-2,5,8-9,13,15-16,19,26-28H,3-4,6-7H2/t13-,15-,16-,19?/m1/s1
    MOLECULAR FORMULA
    C19H20N6O6
    CROSS REFERENCES
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    canSAR672773

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.14
    AlogP -0.09
    HBond donors 3
    HBond acceptors 12
    Atoms 51
    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 canSAR672773.