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canSAR670644
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NAMES
    SMILES
    CC(C)=CCCOc1c(CCC=C(C)C)c(O)nc2ccccc12
    InChI
    InChI=1S/C21H27NO2/c1-15(2)9-7-12-18-20(24-14-8-10-16(3)4)17-11-5-6-13-19(17)22-21(18)23/h5-6,9-11,13H,7-8,12,14H2,1-4H3,(H,22,23)
    MOLECULAR FORMULA
    C21H27NO2
    CROSS REFERENCES
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    canSAR670644

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.20
    AlogP 5.57
    HBond donors 1
    HBond acceptors 3
    Atoms 51
    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 canSAR670644.