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canSAR1409144
FEATURES
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NAMES
    SMILES
    CCc1ccc(C2CC(=O)NC(SCC(=O)OC(C)C)=C2C#N)cc1
    InChI
    InChI=1S/C19H22N2O3S/c1-4-13-5-7-14(8-6-13)15-9-17(22)21-19(16(15)10-20)25-11-18(23)24-12(2)3/h5-8,12,15H,4,9,11H2,1-3H3,(H,21,22)
    MOLECULAR FORMULA
    C19H22N2O3S
    CROSS REFERENCES
    1409144 logo

    canSAR1409144

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.14
    AlogP 3.27
    HBond donors 1
    HBond acceptors 5
    Atoms 47
    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 canSAR1409144.