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canSAR385931
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NAMES
    SMILES
    CC1=C(O)C(C)(C2CCCCC2)SC1=O
    InChI
    InChI=1S/C12H18O2S/c1-8-10(13)12(2,15-11(8)14)9-6-4-3-5-7-9/h9,13H,3-7H2,1-2H3
    MOLECULAR FORMULA
    C12H18O2S
    CROSS REFERENCES
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    canSAR385931

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 226.10
    AlogP 3.43
    HBond donors 1
    HBond acceptors 2
    Atoms 33
    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 canSAR385931.