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canSAR98978
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NAMES
    SMILES
    CN(C)CCOc1ccc(C2=CC3(CCc4cc(O)ccc43)c3ccc(O)cc32)cc1
    InChI
    InChI=1S/C27H27NO3/c1-28(2)13-14-31-22-7-3-18(4-8-22)24-17-27(26-10-6-21(30)16-23(24)26)12-11-19-15-20(29)5-9-25(19)27/h3-10,15-17,29-30H,11-14H2,1-2H3
    MOLECULAR FORMULA
    C27H27NO3
    CROSS REFERENCES
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    canSAR98978

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.20
    AlogP 4.72
    HBond donors 2
    HBond acceptors 4
    Atoms 58
    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 canSAR98978.