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canSAR1145937
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NAMES
    SMILES
    CC(Sc1cc(-c2ccc(C(=O)N3CCN(S(C)(=O)=O)CC3)cc2)cnc1N)c1c(Cl)ccc(F)c1Cl
    InChI
    InChI=1S/C25H25Cl2FN4O3S2/c1-15(22-19(26)7-8-20(28)23(22)27)36-21-13-18(14-30-24(21)29)16-3-5-17(6-4-16)25(33)31-9-11-32(12-10-31)37(2,34)35/h3-8,13-15H,9-12H2,1-2H3,(H2,29,30)
    MOLECULAR FORMULA
    C25H25Cl2FN4O3S2
    CROSS REFERENCES
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    canSAR1145937

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 582.07
    AlogP 5.35
    HBond donors 2
    HBond acceptors 7
    Atoms 62
    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 canSAR1145937.