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canSAR787501
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NAMES
    SMILES
    C[C@]12O[C@H]1[C@H](n1cnc3c(N)ncnc31)C[C@@H]2CO
    InChI
    InChI=1S/C12H15N5O2/c1-12-6(3-18)2-7(9(12)19-12)17-5-16-8-10(13)14-4-15-11(8)17/h4-7,9,18H,2-3H2,1H3,(H2,13,14,15)/t6-,7-,9+,12-/m1/s1
    MOLECULAR FORMULA
    C12H15N5O2
    CROSS REFERENCES
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    canSAR787501

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 261.12
    AlogP 0.12
    HBond donors 3
    HBond acceptors 7
    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 canSAR787501.