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canSAR550500
FEATURES
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NAMES
    SMILES
    Cc1cn([C@H]2CO[C@@H](COC(=O)[C@@H](N)CCC(=O)O)O2)c(=O)[nH]c1=O
    InChI
    InChI=1S/C14H19N3O8/c1-7-4-17(14(22)16-12(7)20)9-5-23-11(25-9)6-24-13(21)8(15)2-3-10(18)19/h4,8-9,11H,2-3,5-6,15H2,1H3,(H,18,19)(H,16,20,22)/t8-,9+,11+/m0/s1
    MOLECULAR FORMULA
    C14H19N3O8
    CROSS REFERENCES
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    canSAR550500

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.12
    AlogP -1.55
    HBond donors 4
    HBond acceptors 11
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR550500.