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canSAR2089320
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NAMES
    SMILES
    c1ccc([C@H]2Nc3ccccc3[C@H]3OCC[C@@H]23)cc1
    InChI
    InChI=1S/C17H17NO/c1-2-6-12(7-3-1)16-14-10-11-19-17(14)13-8-4-5-9-15(13)18-16/h1-9,14,16-18H,10-11H2/t14-,16+,17+/m0/s1
    MOLECULAR FORMULA
    C17H17NO
    CROSS REFERENCES
    2089320 logo

    canSAR2089320

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 251.13
    AlogP 3.93
    HBond donors 1
    HBond acceptors 2
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2089320.