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canSAR655934
FEATURES
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NAMES
    SMILES
    CC(C)=CCC/C(C)=C/CC/C(C)=C/CC[C@]1(C)CCc2cc(OC(=O)NS(=O)(=O)c3ccccc3)c(C)c(C)c2O1
    InChI
    InChI=1S/C35H47NO5S/c1-25(2)14-11-15-26(3)16-12-17-27(4)18-13-22-35(7)23-21-30-24-32(28(5)29(6)33(30)41-35)40-34(37)36-42(38,39)31-19-9-8-10-20-31/h8-10,14,16,18-20,24H,11-13,15,17,21-23H2,1-7H3,(H,36,37)/b26-16+,27-18+/t35-/m1/s1
    MOLECULAR FORMULA
    C35H47NO5S
    CROSS REFERENCES
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    canSAR655934

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 593.32
    AlogP 9.06
    HBond donors 1
    HBond acceptors 6
    Atoms 89
    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 canSAR655934.