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canSAR1718729
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NAMES
    SMILES
    COc1ccc(C[C@@H](N)c2ccc(OC)cc2)cc1
    InChI
    InChI=1S/C16H19NO2/c1-18-14-7-3-12(4-8-14)11-16(17)13-5-9-15(19-2)10-6-13/h3-10,16H,11,17H2,1-2H3/t16-/m1/s1
    MOLECULAR FORMULA
    C16H19NO2
    CROSS REFERENCES
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    canSAR1718729

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 257.14
    AlogP 2.95
    HBond donors 2
    HBond acceptors 3
    Atoms 38
    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 canSAR1718729.