canSAR868837
FEATURES
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NAMES
    SMILES
    C=C1CC[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]1/C=C/C1=CCOC1=O
    InChI
    InChI=1S/C20H28O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h5-6,9,15-17,21-22H,1,4,7-8,10-12H2,2-3H3/b6-5+/t15-,16+,17-,19+,20+/m1/s1
    MOLECULAR FORMULA
    C20H28O4
    CROSS REFERENCES
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    canSAR868837
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight332.20
    AlogP2.77
    HBond donors2
    HBond acceptors4
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR868837.