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canSAR672513
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NAMES
    SMILES
    CCOc1nc(-c2ccc(Cl)cc2)c(Sc2ccc(Cl)cc2)c(-c2ccccc2)c1C#N
    InChI
    InChI=1S/C26H18Cl2N2OS/c1-2-31-26-22(16-29)23(17-6-4-3-5-7-17)25(32-21-14-12-20(28)13-15-21)24(30-26)18-8-10-19(27)11-9-18/h3-15H,2H2,1H3
    MOLECULAR FORMULA
    C26H18Cl2N2OS
    CROSS REFERENCES
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    canSAR672513

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 476.05
    AlogP 8.14
    HBond donors 0
    HBond acceptors 3
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR672513.