canSAR541627
FEATURES
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NAMES
    SMILES
    Cc1cccc(C)c1Nc1ncc(C2=CCC(CN3CCCC3)=[S+]2)n2cncc12
    InChI
    InChI=1S/C23H26N5S/c1-16-6-5-7-17(2)22(16)26-23-20-12-24-15-28(20)19(13-25-23)21-9-8-18(29-21)14-27-10-3-4-11-27/h5-7,9,12-13,15H,3-4,8,10-11,14H2,1-2H3,(H,25,26)/q+1
    MOLECULAR FORMULA
    C23H26N5S+
    CROSS REFERENCES
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    canSAR541627
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight404.19
    AlogP4.19
    HBond donors1
    HBond acceptors5
    Atoms55
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR541627.