canSAR633325
FEATURES
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NAMES
    SMILES
    CC(=O)N(O)[C@@H]1CC[C@H](n2cnc3c(N)ncnc32)C1
    InChI
    InChI=1S/C12H16N6O2/c1-7(19)18(20)9-3-2-8(4-9)17-6-16-10-11(13)14-5-15-12(10)17/h5-6,8-9,20H,2-4H2,1H3,(H2,13,14,15)/t8-,9+/m0/s1
    MOLECULAR FORMULA
    C12H16N6O2
    CROSS REFERENCES
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    canSAR633325
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight276.13
    AlogP0.74
    HBond donors3
    HBond acceptors8
    Atoms36
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633325.