canSAR382993
FEATURES
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NAMES
    SMILES
    CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4cc(C)on4)nc(Cl)nc32)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C17H19ClN8O6/c1-3-19-15(30)11-9(27)10(28)16(31-11)26-5-20-8-12(21-17(18)22-13(8)26)23-24-14(29)7-4-6(2)32-25-7/h4-5,9-11,16,27-28H,3H2,1-2H3,(H,19,30)(H,24,29)(H,21,22,23)/t9-,10+,11-,16+/m0/s1
    MOLECULAR FORMULA
    C17H19ClN8O6
    CROSS REFERENCES
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    canSAR382993
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight466.11
    AlogP-0.71
    HBond donors5
    HBond acceptors14
    Atoms51
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR382993.