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canSAR171459
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NAMES
    SMILES
    C=CC[C@H]1Cc2cccc(OC)c2C[C@@H]1NCCC
    InChI
    InChI=1S/C17H25NO/c1-4-7-14-11-13-8-6-9-17(19-3)15(13)12-16(14)18-10-5-2/h4,6,8-9,14,16,18H,1,5,7,10-12H2,2-3H3/t14-,16-/m0/s1
    MOLECULAR FORMULA
    C17H25NO
    CROSS REFERENCES
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    canSAR171459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 259.19
    AlogP 3.35
    HBond donors 1
    HBond acceptors 2
    Atoms 44
    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 canSAR171459.