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canSAR668987
FEATURES
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NAMES
    SMILES
    NC(=O)NCCCC(N)C(=O)NC(C(=O)O)[C@H]1OC(n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C16H24N6O9/c17-6(2-1-4-19-15(18)29)12(26)21-8(14(27)28)11-9(24)10(25)13(31-11)22-5-3-7(23)20-16(22)30/h3,5-6,8-11,13,24-25H,1-2,4,17H2,(H,21,26)(H,27,28)(H3,18,19,29)(H,20,23,30)/t6?,8?,9-,10+,11+,13?/m0/s1
    MOLECULAR FORMULA
    C16H24N6O9
    CROSS REFERENCES
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    canSAR668987

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.16
    AlogP -4.50
    HBond donors 10
    HBond acceptors 15
    Atoms 55
    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 canSAR668987.