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canSAR1201327
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NAMES
    SMILES
    Cc1cc(F)c2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn3)n(C3CCC3)c2c1
    InChI
    InChI=1S/C22H20F4N4O2S/c1-12-8-17(23)20-16(10-27)21(30(19(20)9-12)14-4-3-5-14)18-7-6-15(11-28-18)33(31,32)29-13(2)22(24,25)26/h6-9,11,13-14,29H,3-5H2,1-2H3/t13-/m0/s1
    MOLECULAR FORMULA
    C22H20F4N4O2S
    CROSS REFERENCES
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    canSAR1201327

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.12
    AlogP 4.98
    HBond donors 1
    HBond acceptors 6
    Atoms 53
    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 canSAR1201327.