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canSAR100514
FEATURES
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NAMES
    SMILES
    NC[C@H](CC(=O)O)c1ccc(Br)s1
    InChI
    InChI=1S/C8H10BrNO2S/c9-7-2-1-6(13-7)5(4-10)3-8(11)12/h1-2,5H,3-4,10H2,(H,11,12)/t5-/m0/s1
    MOLECULAR FORMULA
    C8H10BrNO2S
    CROSS REFERENCES
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    canSAR100514

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 262.96
    AlogP 2.03
    HBond donors 3
    HBond acceptors 3
    Atoms 23
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR100514.