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canSAR1066196
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NAMES
    SMILES
    COc1cc2c(cc1C)[C@@](O)(C(C)C)C(=O)C(=O)[C@@]2(C)O
    InChI
    InChI=1S/C16H20O5/c1-8(2)16(20)11-6-9(3)12(21-5)7-10(11)15(4,19)13(17)14(16)18/h6-8,19-20H,1-5H3/t15-,16-/m0/s1
    MOLECULAR FORMULA
    C16H20O5
    CROSS REFERENCES
    1066196 logo

    canSAR1066196

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 292.13
    AlogP 1.21
    HBond donors 2
    HBond acceptors 5
    Atoms 41
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1066196.