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canSAR1596665
FEATURES
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NAMES
    SMILES
    O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(O)c(O)c1
    InChI
    InChI=1S/C15H11NO6S/c17-11-6-5-9(7-12(11)18)13(19)8-16-15(20)10-3-1-2-4-14(10)23(16,21)22/h1-7,17-18H,8H2
    MOLECULAR FORMULA
    C15H11NO6S
    CROSS REFERENCES
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    canSAR1596665

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 333.03
    AlogP 1.13
    HBond donors 2
    HBond acceptors 7
    Atoms 34
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1596665.