canSAR1746274
FEATURES
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NAMES
    SMILES
    N#CC1(NC(=O)[C@@H]2CCCC[C@H]2c2nc(C3CC(F)(F)C3)sc2-c2ccc(N3CCS(=O)(=O)CC3)cc2)CC1
    InChI
    InChI=1S/C28H32F2N4O3S2/c29-28(30)15-19(16-28)26-32-23(21-3-1-2-4-22(21)25(35)33-27(17-31)9-10-27)24(38-26)18-5-7-20(8-6-18)34-11-13-39(36,37)14-12-34/h5-8,19,21-22H,1-4,9-16H2,(H,33,35)/t21-,22-/m1/s1
    MOLECULAR FORMULA
    C28H32F2N4O3S2
    CROSS REFERENCES
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    canSAR1746274
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight574.19
    AlogP5.00
    HBond donors1
    HBond acceptors7
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746274.