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canSAR989637
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NAMES
    SMILES
    CC(=O)N[C@@H](CSC/C=C(/Cc1ccccc1)c1ccccc1)C(=O)O
    InChI
    InChI=1S/C21H23NO3S/c1-16(23)22-20(21(24)25)15-26-13-12-19(18-10-6-3-7-11-18)14-17-8-4-2-5-9-17/h2-12,20H,13-15H2,1H3,(H,22,23)(H,24,25)/b19-12-/t20-/m0/s1
    MOLECULAR FORMULA
    C21H23NO3S
    CROSS REFERENCES
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    canSAR989637

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 369.14
    AlogP 3.64
    HBond donors 2
    HBond acceptors 4
    Atoms 49
    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 canSAR989637.