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canSAR112854
FEATURES
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NAMES
    SMILES
    O=C(O)c1ccccc1SC1=CC(=O)c2c(Cl)ccc(O)c2C1=O
    InChI
    InChI=1S/C17H9ClO5S/c18-9-5-6-10(19)15-14(9)11(20)7-13(16(15)21)24-12-4-2-1-3-8(12)17(22)23/h1-7,19H,(H,22,23)
    MOLECULAR FORMULA
    C17H9ClO5S
    CROSS REFERENCES
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    canSAR112854

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.99
    AlogP 3.80
    HBond donors 2
    HBond acceptors 5
    Atoms 33
    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 canSAR112854.