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canSAR838437
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NAMES
    SMILES
    COc1ccc2c(cc1=O)[C@H]1CC[C@]3(C)[C@@H](O)CC[C@H]3[C@@H]1CC2
    InChI
    InChI=1S/C20H26O3/c1-20-10-9-13-14(16(20)6-8-19(20)22)5-3-12-4-7-18(23-2)17(21)11-15(12)13/h4,7,11,13-14,16,19,22H,3,5-6,8-10H2,1-2H3/t13-,14+,16-,19-,20-/m0/s1
    MOLECULAR FORMULA
    C20H26O3
    CROSS REFERENCES
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    canSAR838437

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.19
    AlogP 3.27
    HBond donors 1
    HBond acceptors 3
    Atoms 49
    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 canSAR838437.