canSAR589947
FEATURES
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NAMES
    SMILES
    C[N+](C)(CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21)Cc1ccccc1Cl
    InChI
    InChI=1S/C25H25ClF3N2S/c1-31(2,17-18-8-3-4-9-20(18)26)15-7-14-30-21-10-5-6-11-23(21)32-24-13-12-19(16-22(24)30)25(27,28)29/h3-6,8-13,16H,7,14-15,17H2,1-2H3/q+1
    MOLECULAR FORMULA
    C25H25ClF3N2S+
    CROSS REFERENCES
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    canSAR589947
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight477.14
    AlogP7.63
    HBond donors0
    HBond acceptors2
    Atoms57
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR589947.