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canSAR1206955
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NAMES
    SMILES
    COc1cc2c(cc1[C@H](C)NCc1ccccc1)C=CC(C)(C)O2
    InChI
    InChI=1S/C21H25NO2/c1-15(22-14-16-8-6-5-7-9-16)18-12-17-10-11-21(2,3)24-19(17)13-20(18)23-4/h5-13,15,22H,14H2,1-4H3/t15-/m0/s1
    MOLECULAR FORMULA
    C21H25NO2
    CROSS REFERENCES
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    canSAR1206955

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 323.19
    AlogP 4.73
    HBond donors 1
    HBond acceptors 3
    Atoms 49
    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 canSAR1206955.