canSAR2095655
FEATURES
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NAMES
    SMILES
    Cc1cccc(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)c1
    InChI
    InChI=1S/C21H17N3OS/c1-15-6-5-9-18(12-15)23-20(25)14-26-21-17(13-22)10-11-19(24-21)16-7-3-2-4-8-16/h2-12H,14H2,1H3,(H,23,25)
    MOLECULAR FORMULA
    C21H17N3OS
    CROSS REFERENCES
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    canSAR2095655
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight359.11
    AlogP4.66
    HBond donors1
    HBond acceptors4
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095655.