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canSAR1013400
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NAMES
    SMILES
    CCc1cc(=O)c2ccc(Sc3cccc(Cl)n3)c(C)c2o1
    InChI
    InChI=1S/C17H14ClNO2S/c1-3-11-9-13(20)12-7-8-14(10(2)17(12)21-11)22-16-6-4-5-15(18)19-16/h4-9H,3H2,1-2H3
    MOLECULAR FORMULA
    C17H14ClNO2S
    CROSS REFERENCES
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    canSAR1013400

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.04
    AlogP 4.86
    HBond donors 0
    HBond acceptors 3
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1013400.