canSAR163230
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCNC(=O)[C@H]1CSC(c2c(Cl)cccc2Cl)N1
    InChI
    InChI=1S/C28H46Cl2N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-31-27(33)25-22-34-28(32-25)26-23(29)19-18-20-24(26)30/h18-20,25,28,32H,2-17,21-22H2,1H3,(H,31,33)/t25-,28?/m1/s1
    MOLECULAR FORMULA
    C28H46Cl2N2OS
    CROSS REFERENCES
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    canSAR163230
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight528.27
    AlogP9.07
    HBond donors2
    HBond acceptors3
    Atoms80
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR163230.