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canSAR99225
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NAMES
    SMILES
    COc1cccc(/C(=C\c2c(C(=O)O)[nH]c3cc(Cl)cc(Cl)c23)C(=O)O)c1
    InChI
    InChI=1S/C19H13Cl2NO5/c1-27-11-4-2-3-9(5-11)12(18(23)24)8-13-16-14(21)6-10(20)7-15(16)22-17(13)19(25)26/h2-8,22H,1H3,(H,23,24)(H,25,26)/b12-8+
    MOLECULAR FORMULA
    C19H13Cl2NO5
    CROSS REFERENCES
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    canSAR99225

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.02
    AlogP 4.81
    HBond donors 3
    HBond acceptors 6
    Atoms 40
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR99225.