canSAR13879
FEATURES
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NAMES
    SMILES
    COc1ccc(CC[S+]([O-])CCCN2CCc3cc(OC)c(OC)cc3CC2=O)cc1OC
    InChI
    InChI=1S/C25H33NO6S/c1-29-21-7-6-18(14-22(21)30-2)9-13-33(28)12-5-10-26-11-8-19-15-23(31-3)24(32-4)16-20(19)17-25(26)27/h6-7,14-16H,5,8-13,17H2,1-4H3
    MOLECULAR FORMULA
    C25H33NO6S
    CROSS REFERENCES
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    canSAR13879
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight475.20
    AlogP3.03
    HBond donors0
    HBond acceptors7
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR13879.