canSAR418050
FEATURES
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NAMES
    SMILES
    O=C(O)CCc1cc(O)c(O)c(O)c1
    InChI
    InChI=1S/C9H10O5/c10-6-3-5(1-2-8(12)13)4-7(11)9(6)14/h3-4,10-11,14H,1-2H2,(H,12,13)
    MOLECULAR FORMULA
    C9H10O5
    CROSS REFERENCES
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    canSAR418050
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight198.05
    AlogP0.82
    HBond donors4
    HBond acceptors5
    Atoms24
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR418050.