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canSAR1828763
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NAMES
    SMILES
    COC(=O)C1=C(C)OC(N)=C(C#N)C1c1ccsc1
    InChI
    InChI=1S/C13H12N2O3S/c1-7-10(13(16)17-2)11(8-3-4-19-6-8)9(5-14)12(15)18-7/h3-4,6,11H,15H2,1-2H3
    MOLECULAR FORMULA
    C13H12N2O3S
    CROSS REFERENCES
    1828763 logo

    canSAR1828763

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 276.06
    AlogP 2.00
    HBond donors 2
    HBond acceptors 5
    Atoms 31
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1828763.