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canSAR830177
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NAMES
    SMILES
    CC(C)c1cc2c(cc1NC(=O)c1ccccc1)[C@@]1(C)CCC[C@@](C)(C(=O)O)[C@@H]1CC2
    InChI
    InChI=1S/C27H33NO3/c1-17(2)20-15-19-11-12-23-26(3,13-8-14-27(23,4)25(30)31)21(19)16-22(20)28-24(29)18-9-6-5-7-10-18/h5-7,9-10,15-17,23H,8,11-14H2,1-4H3,(H,28,29)(H,30,31)/t23-,26-,27-/m1/s1
    MOLECULAR FORMULA
    C27H33NO3
    CROSS REFERENCES
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    canSAR830177

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.25
    AlogP 6.16
    HBond donors 2
    HBond acceptors 4
    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 canSAR830177.