canSAR2191293
FEATURES
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NAMES
    SMILES
    CC(C)(O)[C@H]1C[C@H](C#Cc2ccc(C3=NO[C@@H](C[C@](C)(C(=O)NO)S(C)(=O)=O)C3)cc2)C1
    InChI
    InChI=1S/C23H30N2O6S/c1-22(2,27)18-11-16(12-18)6-5-15-7-9-17(10-8-15)20-13-19(31-25-20)14-23(3,21(26)24-28)32(4,29)30/h7-10,16,18-19,27-28H,11-14H2,1-4H3,(H,24,26)/t16-,18-,19-,23-/m1/s1
    MOLECULAR FORMULA
    C23H30N2O6S
    CROSS REFERENCES
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    canSAR2191293
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight462.18
    AlogP2.03
    HBond donors3
    HBond acceptors8
    Atoms62
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2191293.