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canSAR1064830
FEATURES
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NAMES
    SMILES
    CCN1[C@H](C(=O)NCc2ccccc2Cl)CCS1(=O)=O
    InChI
    InChI=1S/C13H17ClN2O3S/c1-2-16-12(7-8-20(16,18)19)13(17)15-9-10-5-3-4-6-11(10)14/h3-6,12H,2,7-9H2,1H3,(H,15,17)/t12-/m0/s1
    MOLECULAR FORMULA
    C13H17ClN2O3S
    CROSS REFERENCES
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    canSAR1064830

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 316.06
    AlogP 1.38
    HBond donors 1
    HBond acceptors 5
    Atoms 37
    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 canSAR1064830.