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canSAR1972757
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NAMES
    SMILES
    CC(Nc1nccc(N2C(=O)OC[C@@H]2C(C)C)n1)c1nncn1C
    InChI
    InChI=1S/C15H21N7O2/c1-9(2)11-7-24-15(23)22(11)12-5-6-16-14(19-12)18-10(3)13-20-17-8-21(13)4/h5-6,8-11H,7H2,1-4H3,(H,16,18,19)/t10?,11-/m1/s1
    MOLECULAR FORMULA
    C15H21N7O2
    CROSS REFERENCES
    1972757 logo

    canSAR1972757

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.18
    AlogP 1.76
    HBond donors 1
    HBond acceptors 9
    Atoms 45
    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 canSAR1972757.