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canSAR837603
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NAMES
    SMILES
    N=C(N)NCc1cn(CC(=O)N[C@@H](C(=O)O)c2ccccc2)nn1
    InChI
    InChI=1S/C14H17N7O3/c15-14(16)17-6-10-7-21(20-19-10)8-11(22)18-12(13(23)24)9-4-2-1-3-5-9/h1-5,7,12H,6,8H2,(H,18,22)(H,23,24)(H4,15,16,17)/t12-/m1/s1
    MOLECULAR FORMULA
    C14H17N7O3
    CROSS REFERENCES
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    canSAR837603

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.14
    AlogP -0.80
    HBond donors 6
    HBond acceptors 10
    Atoms 41
    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 canSAR837603.