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canSAR79219
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NAMES
    SMILES
    C=CCN1CCC2c3cccc(OC)c3CC[C@H]21
    InChI
    InChI=1S/C16H21NO/c1-3-10-17-11-9-13-12-5-4-6-16(18-2)14(12)7-8-15(13)17/h3-6,13,15H,1,7-11H2,2H3/t13?,15-/m1/s1
    MOLECULAR FORMULA
    C16H21NO
    CROSS REFERENCES
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    canSAR79219

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 243.16
    AlogP 2.99
    HBond donors 0
    HBond acceptors 2
    Atoms 39
    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 canSAR79219.