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canSAR1001468
FEATURES
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NAMES
    SMILES
    Nc1ccc(C(=O)Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)cc1O
    InChI
    InChI=1S/C22H15NO9/c23-12-3-1-10(6-14(12)26)22(30)32-21-19(29)18-16(28)7-11(24)8-17(18)31-20(21)9-2-4-13(25)15(27)5-9/h1-8,24-28H,23H2
    MOLECULAR FORMULA
    C22H15NO9
    CROSS REFERENCES
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    canSAR1001468

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.07
    AlogP 2.79
    HBond donors 7
    HBond acceptors 10
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1001468.