canSAR1603138
FEATURES
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NAMES
    SMILES
    CC(=O)Nc1cc(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(OC(C)=O)c12
    InChI
    InChI=1S/C14H13NO9S2/c1-7(16)15-12-5-10(25(18,19)20)3-9-4-11(26(21,22)23)6-13(14(9)12)24-8(2)17/h3-6H,1-2H3,(H,15,16)(H,18,19,20)(H,21,22,23)/p-2
    MOLECULAR FORMULA
    C14H11NO9S2-2
    CROSS REFERENCES
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    canSAR1603138
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight400.99
    AlogP0.53
    HBond donors1
    HBond acceptors10
    Atoms37
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1603138.