canSAR2165034
FEATURES
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NAMES
    SMILES
    O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(OCC2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)cc1F
    InChI
    InChI=1S/C29H31FN2O6S2/c30-27-17-28(25(21-5-6-21)16-26(27)29(33)31-39(34,35)23-9-10-23)38-18-19-11-13-32(14-12-19)40(36,37)24-8-7-20-3-1-2-4-22(20)15-24/h1-4,7-8,15-17,19,21,23H,5-6,9-14,18H2,(H,31,33)
    MOLECULAR FORMULA
    C29H31FN2O6S2
    CROSS REFERENCES
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    canSAR2165034
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight586.16
    AlogP4.56
    HBond donors1
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2165034.