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canSAR54992
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NAMES
    SMILES
    COc1ccc(C#Cc2ccc(C(C)C)cc2)c(CC(C)N(C)CCc2ccc(OC)c(OC)c2)c1
    InChI
    InChI=1S/C32H39NO3/c1-23(2)27-12-8-25(9-13-27)10-14-28-15-16-30(34-5)22-29(28)20-24(3)33(4)19-18-26-11-17-31(35-6)32(21-26)36-7/h8-9,11-13,15-17,21-24H,18-20H2,1-7H3
    MOLECULAR FORMULA
    C32H39NO3
    CROSS REFERENCES
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    canSAR54992

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.29
    AlogP 6.34
    HBond donors 0
    HBond acceptors 4
    Atoms 75
    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 canSAR54992.