canSAR1810153
FEATURES
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NAMES
    SMILES
    CC12CCC(=O)C=C1CCC1C3CC[C@](O)(C(=O)CO)C3(C)CC[C@@H]12
    InChI
    InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15?,16-,17?,19?,20?,21-/m0/s1
    MOLECULAR FORMULA
    C21H30O4
    CROSS REFERENCES
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    canSAR1810153
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight346.21
    AlogP2.81
    HBond donors2
    HBond acceptors4
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1810153.