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canSAR834470
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NAMES
    SMILES
    CS(=O)(=O)c1ccc(-c2ccc([C@H](N[C@@H](CC(Cl)Cl)C(=O)N[C@H](C#N)Cc3ccccc3)C(F)(F)F)cc2)cc1
    InChI
    InChI=1S/C28H26Cl2F3N3O3S/c1-40(38,39)23-13-11-20(12-14-23)19-7-9-21(10-8-19)26(28(31,32)33)36-24(16-25(29)30)27(37)35-22(17-34)15-18-5-3-2-4-6-18/h2-14,22,24-26,36H,15-16H2,1H3,(H,35,37)/t22-,24-,26-/m0/s1
    MOLECULAR FORMULA
    C28H26Cl2F3N3O3S
    CROSS REFERENCES
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    canSAR834470

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 611.10
    AlogP 5.76
    HBond donors 2
    HBond acceptors 6
    Atoms 66
    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 canSAR834470.