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canSAR833017
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NAMES
    SMILES
    COC(=O)[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3-c3[nH]c4ccc(C)cc4c3[C@H]21
    InChI
    InChI=1S/C28H33NO2/c1-16(2)18-9-10-21-19(15-18)24-23(20-14-17(3)8-11-22(20)29-24)25-27(21,4)12-7-13-28(25,5)26(30)31-6/h8-11,14-16,25,29H,7,12-13H2,1-6H3/t25-,27-,28-/m1/s1
    MOLECULAR FORMULA
    C28H33NO2
    CROSS REFERENCES
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    canSAR833017

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.25
    AlogP 6.98
    HBond donors 1
    HBond acceptors 3
    Atoms 64
    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 canSAR833017.