canSAR2097649
FEATURES
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NAMES
    SMILES
    CCOC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](NC(=S)Nc4ccccc4)[C@@](C)(CC[C@@H]21)C3
    InChI
    InChI=1S/C29H42N2O2S/c1-5-33-24(32)28(4)15-9-14-27(3)21(28)13-17-29-18-23(26(2,19-29)16-12-22(27)29)31-25(34)30-20-10-7-6-8-11-20/h6-8,10-11,21-23H,5,9,12-19H2,1-4H3,(H2,30,31,34)/t21-,22-,23+,26-,27+,28+,29-/m0/s1
    MOLECULAR FORMULA
    C29H42N2O2S
    CROSS REFERENCES
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    canSAR2097649
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight482.30
    AlogP6.71
    HBond donors2
    HBond acceptors4
    Atoms76
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2097649.