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canSAR660720
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NAMES
    SMILES
    CN1CCc2c(sc(N)c2C(=O)NCc2ccccc2)C1.Cl
    InChI
    InChI=1S/C16H19N3OS.ClH/c1-19-8-7-12-13(10-19)21-15(17)14(12)16(20)18-9-11-5-3-2-4-6-11;/h2-6H,7-10,17H2,1H3,(H,18,20);1H
    MOLECULAR FORMULA
    C16H20ClN3OS
    CROSS REFERENCES
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    canSAR660720

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 337.10
    AlogP 2.67
    HBond donors 3
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR660720.