canSAR1087925
FEATURES
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NAMES
    SMILES
    Cc1ccc(SCC2=C(O)C(=O)c3ccccc3C2=O)cc1
    InChI
    InChI=1S/C18H14O3S/c1-11-6-8-12(9-7-11)22-10-15-16(19)13-4-2-3-5-14(13)17(20)18(15)21/h2-9,21H,10H2,1H3
    MOLECULAR FORMULA
    C18H14O3S
    CROSS REFERENCES
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    canSAR1087925
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight310.07
    AlogP3.98
    HBond donors1
    HBond acceptors3
    Atoms36
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087925.