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canSAR1127398
FEATURES
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NAMES
    SMILES
    O=C(O)C(=O)Nc1ccc(C[C@H](c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1
    InChI
    InChI=1S/C31H25Cl2N3O6S/c32-23-11-5-21(6-12-23)18-36(19-22-7-13-24(33)14-8-22)43(40,41)28(30-35-26-3-1-2-4-27(26)42-30)17-20-9-15-25(16-10-20)34-29(37)31(38)39/h1-16,28H,17-19H2,(H,34,37)(H,38,39)/t28-/m1/s1
    MOLECULAR FORMULA
    C31H25Cl2N3O6S
    CROSS REFERENCES
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    canSAR1127398

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 637.08
    AlogP 6.47
    HBond donors 2
    HBond acceptors 9
    Atoms 68
    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 canSAR1127398.