canSAR2096628
FEATURES
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NAMES
    SMILES
    CC(C)n1ncnc1-c1cn2c(n1)-c1ccc(N3CCC[C@H]3C(N)=O)cc1OCC2
    InChI
    InChI=1S/C21H25N7O2/c1-13(2)28-21(23-12-24-28)16-11-26-8-9-30-18-10-14(5-6-15(18)20(26)25-16)27-7-3-4-17(27)19(22)29/h5-6,10-13,17H,3-4,7-9H2,1-2H3,(H2,22,29)/t17-/m0/s1
    MOLECULAR FORMULA
    C21H25N7O2
    CROSS REFERENCES
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    canSAR2096628
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight407.21
    AlogP2.24
    HBond donors2
    HBond acceptors9
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096628.