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canSAR5598
FEATURES
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NAMES
    SMILES
    CCCCC(=O)/C(C)=C(/C)C(=O)O
    InChI
    InChI=1S/C10H16O3/c1-4-5-6-9(11)7(2)8(3)10(12)13/h4-6H2,1-3H3,(H,12,13)/b8-7-
    MOLECULAR FORMULA
    C10H16O3
    CROSS REFERENCES
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    canSAR5598

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 184.11
    AlogP 2.17
    HBond donors 1
    HBond acceptors 3
    Atoms 29
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR5598.