canSAR939168
FEATURES
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NAMES
    SMILES
    CCCCCCCC[n+]1c(-c2ccc(SC)cc2)cn2cccnc21
    InChI
    InChI=1S/C21H28N3S/c1-3-4-5-6-7-8-16-24-20(17-23-15-9-14-22-21(23)24)18-10-12-19(25-2)13-11-18/h9-15,17H,3-8,16H2,1-2H3/q+1
    MOLECULAR FORMULA
    C21H28N3S+
    CROSS REFERENCES
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    canSAR939168
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight354.20
    AlogP5.37
    HBond donors0
    HBond acceptors3
    Atoms53
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR939168.