canSAR824535
FEATURES
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NAMES
    SMILES
    COc1cccc(OC)c1-c1ccc(C[C@H](NC(=O)[C@@H]2CCN2S(=O)(=O)c2ccccc2)C(=O)O)cc1
    InChI
    InChI=1S/C27H28N2O7S/c1-35-23-9-6-10-24(36-2)25(23)19-13-11-18(12-14-19)17-21(27(31)32)28-26(30)22-15-16-29(22)37(33,34)20-7-4-3-5-8-20/h3-14,21-22H,15-17H2,1-2H3,(H,28,30)(H,31,32)/t21-,22-/m0/s1
    MOLECULAR FORMULA
    C27H28N2O7S
    CROSS REFERENCES
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    canSAR824535
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight524.16
    AlogP2.95
    HBond donors2
    HBond acceptors9
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824535.