canSAR1711954
FEATURES
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NAMES
    SMILES
    C[C@@H](Cc1ccc(O)cn1)[C@H](N)C(=O)N[C@H](C(=O)O)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C20H25N5O9/c1-8(6-9-2-3-10(26)7-22-9)12(21)17(30)24-13(19(31)32)16-14(28)15(29)18(34-16)25-5-4-11(27)23-20(25)33/h2-5,7-8,12-16,18,26,28-29H,6,21H2,1H3,(H,24,30)(H,31,32)(H,23,27,33)/t8-,12-,13-,14-,15+,16+,18+/m0/s1
    MOLECULAR FORMULA
    C20H25N5O9
    CROSS REFERENCES
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    canSAR1711954
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight479.17
    AlogP-2.97
    HBond donors8
    HBond acceptors14
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1711954.