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canSAR1616219
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NAMES
    SMILES
    CC(=NOCc1ccc(Cl)cc1)c1ccc(CC#N)s1
    InChI
    InChI=1S/C15H13ClN2OS/c1-11(15-7-6-14(20-15)8-9-17)18-19-10-12-2-4-13(16)5-3-12/h2-7H,8,10H2,1H3
    MOLECULAR FORMULA
    C15H13ClN2OS
    CROSS REFERENCES
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    canSAR1616219

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 304.04
    AlogP 4.41
    HBond donors 0
    HBond acceptors 3
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1616219.