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canSAR1205835
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)Nc2ccccc2N)cc1OCC(=O)Nc1ccc(F)c(Cl)c1
    InChI
    InChI=1S/C24H21ClFN3O4/c1-32-21-10-6-15(7-11-23(30)29-20-5-3-2-4-19(20)27)12-22(21)33-14-24(31)28-16-8-9-18(26)17(25)13-16/h2-13H,14,27H2,1H3,(H,28,31)(H,29,30)/b11-7+
    MOLECULAR FORMULA
    C24H21ClFN3O4
    CROSS REFERENCES
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    canSAR1205835

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 469.12
    AlogP 4.74
    HBond donors 4
    HBond acceptors 7
    Atoms 54
    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 canSAR1205835.