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canSAR501780
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NAMES
    SMILES
    CC(C)(C)c1ccc(OCc2ccccc2)c(/C=C2\SC(=O)NC2=O)c1
    InChI
    InChI=1S/C21H21NO3S/c1-21(2,3)16-9-10-17(25-13-14-7-5-4-6-8-14)15(11-16)12-18-19(23)22-20(24)26-18/h4-12H,13H2,1-3H3,(H,22,23,24)/b18-12-
    MOLECULAR FORMULA
    C21H21NO3S
    CROSS REFERENCES
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    canSAR501780

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.12
    AlogP 4.89
    HBond donors 1
    HBond acceptors 4
    Atoms 47
    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 canSAR501780.