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canSAR1716758
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NAMES
    SMILES
    C=CCN1[C@@H](Cc2ccccc2)COCCS1(=O)=O
    InChI
    InChI=1S/C14H19NO3S/c1-2-8-15-14(11-13-6-4-3-5-7-13)12-18-9-10-19(15,16)17/h2-7,14H,1,8-12H2/t14-/m0/s1
    MOLECULAR FORMULA
    C14H19NO3S
    CROSS REFERENCES
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    canSAR1716758

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 281.11
    AlogP 1.45
    HBond donors 0
    HBond acceptors 4
    Atoms 38
    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 canSAR1716758.