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canSAR784764
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NAMES
    SMILES
    N[C@@H](C/C(=C\CCC(c1ccccc1)c1ccccc1)C(=O)O)C(=O)O
    InChI
    InChI=1S/C21H23NO4/c22-19(21(25)26)14-17(20(23)24)12-7-13-18(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-12,18-19H,7,13-14,22H2,(H,23,24)(H,25,26)/b17-12+/t19-/m0/s1
    MOLECULAR FORMULA
    C21H23NO4
    CROSS REFERENCES
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    canSAR784764

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.16
    AlogP 3.41
    HBond donors 4
    HBond acceptors 5
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR784764.