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canSAR732698
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NAMES
    SMILES
    COc1ccc(-n2nc(/C=C(\C(=O)O)c3cccc(Cl)c3)cc2-c2ccc(Cl)c(Cl)c2)cc1
    InChI
    InChI=1S/C25H17Cl3N2O3/c1-33-20-8-6-19(7-9-20)30-24(16-5-10-22(27)23(28)12-16)14-18(29-30)13-21(25(31)32)15-3-2-4-17(26)11-15/h2-14H,1H3,(H,31,32)/b21-13-
    MOLECULAR FORMULA
    C25H17Cl3N2O3
    CROSS REFERENCES
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    canSAR732698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.03
    AlogP 7.13
    HBond donors 1
    HBond acceptors 5
    Atoms 50
    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 canSAR732698.