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canSAR1150112
FEATURES
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NAMES
    SMILES
    COc1ccc(-c2cc(NC(=O)N[C@@H](C)C(=O)O)c(C(=O)O)s2)cc1
    InChI
    InChI=1S/C16H16N2O6S/c1-8(14(19)20)17-16(23)18-11-7-12(25-13(11)15(21)22)9-3-5-10(24-2)6-4-9/h3-8H,1-2H3,(H,19,20)(H,21,22)(H2,17,18,23)/t8-/m0/s1
    MOLECULAR FORMULA
    C16H16N2O6S
    CROSS REFERENCES
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    canSAR1150112

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.07
    AlogP 2.72
    HBond donors 4
    HBond acceptors 8
    Atoms 41
    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 canSAR1150112.