canSAR633591
FEATURES
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NAMES
    SMILES
    CCSc1cc2c(cc1O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12
    InChI
    InChI=1S/C20H28O2S/c1-3-23-18-11-15-12(10-17(18)21)4-5-14-13(15)8-9-20(2)16(14)6-7-19(20)22/h10-11,13-14,16,19,21-22H,3-9H2,1-2H3/t13-,14+,16-,19-,20-/m0/s1
    MOLECULAR FORMULA
    C20H28O2S
    CROSS REFERENCES
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    canSAR633591
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight332.18
    AlogP4.72
    HBond donors2
    HBond acceptors2
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633591.