canSAR1600345
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)N1CC(C(=O)N2C[C@H](S(=O)(=O)c3ccccc3Cl)C[C@H]2C(=O)NC2(C#N)CC2)(c2ncc(Cl)cc2F)C1
    InChI
    InChI=1S/C29H30Cl2FN5O6S/c1-27(2,3)43-26(40)36-15-29(16-36,23-20(32)10-17(30)12-34-23)25(39)37-13-18(44(41,42)22-7-5-4-6-19(22)31)11-21(37)24(38)35-28(14-33)8-9-28/h4-7,10,12,18,21H,8-9,11,13,15-16H2,1-3H3,(H,35,38)/t18-,21+/m1/s1
    MOLECULAR FORMULA
    C29H30Cl2FN5O6S
    CROSS REFERENCES
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    canSAR1600345
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight665.13
    AlogP3.63
    HBond donors1
    HBond acceptors11
    Atoms74
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1600345.