canSAR2079840
FEATURES
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NAMES
    SMILES
    Cc1nc(NC2CCNc3ccccc32)cc(-c2ccc3ncsc3c2)n1
    InChI
    InChI=1S/C21H19N5S/c1-13-24-19(14-6-7-18-20(10-14)27-12-23-18)11-21(25-13)26-17-8-9-22-16-5-3-2-4-15(16)17/h2-7,10-12,17,22H,8-9H2,1H3,(H,24,25,26)
    MOLECULAR FORMULA
    C21H19N5S
    CROSS REFERENCES
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    canSAR2079840
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight373.14
    AlogP5.03
    HBond donors2
    HBond acceptors5
    Atoms46
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2079840.