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canSAR987802
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NAMES
    SMILES
    O=C(O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)CO)[C@@H]23
    InChI
    InChI=1S/C17H28N2O4/c20-11-15(21)19-10-12-4-2-8-18-9-3-5-13(17(12)18)14(19)6-1-7-16(22)23/h12-14,17,20H,1-11H2,(H,22,23)/t12-,13+,14+,17-/m0/s1
    MOLECULAR FORMULA
    C17H28N2O4
    CROSS REFERENCES
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    canSAR987802

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.20
    AlogP 0.94
    HBond donors 2
    HBond acceptors 6
    Atoms 51
    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 canSAR987802.