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canSAR1769130
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NAMES
    SMILES
    COCc1cncc(C#Cc2csc(C)n2)c1
    InChI
    InChI=1S/C13H12N2OS/c1-10-15-13(9-17-10)4-3-11-5-12(8-16-2)7-14-6-11/h5-7,9H,8H2,1-2H3
    MOLECULAR FORMULA
    C13H12N2OS
    CROSS REFERENCES
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    canSAR1769130

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 244.07
    AlogP 2.39
    HBond donors 0
    HBond acceptors 3
    Atoms 29
    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 canSAR1769130.