canSAR739694
FEATURES
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NAMES
    SMILES
    C[C@]1(O)C(n2ccc3c(N)nc(N)nc32)O[C@H](CO)[C@H]1O
    InChI
    InChI=1S/C12H17N5O4/c1-12(20)7(19)6(4-18)21-10(12)17-3-2-5-8(13)15-11(14)16-9(5)17/h2-3,6-7,10,18-20H,4H2,1H3,(H4,13,14,15,16)/t6-,7-,10?,12-/m1/s1
    MOLECULAR FORMULA
    C12H17N5O4
    CROSS REFERENCES
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    canSAR739694
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight295.13
    AlogP-1.40
    HBond donors7
    HBond acceptors9
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739694.