canSAR738742
FEATURES
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NAMES
    SMILES
    C=C(C)CC(N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C16H23N7O7S/c1-7(2)3-8(17)15(26)22-31(27,28)29-4-9-11(24)12(25)16(30-9)23-6-21-10-13(18)19-5-20-14(10)23/h5-6,8-9,11-12,16,24-25H,1,3-4,17H2,2H3,(H,22,26)(H2,18,19,20)/t8?,9-,11-,12-,16-/m1/s1
    MOLECULAR FORMULA
    C16H23N7O7S
    CROSS REFERENCES
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    canSAR738742
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight457.14
    AlogP-2.30
    HBond donors7
    HBond acceptors14
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR738742.