canSAR20957
FEATURES
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NAMES
    SMILES
    CC(C)C[C@@H](C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C)N(C)C
    InChI
    InChI=1S/C28H39N3O4/c1-19(2)17-24(31(6)7)26(33)29-23(25(32)30-28(3,4)5)18-20-13-15-22(16-14-20)35-27(34)21-11-9-8-10-12-21/h8-16,19,23-24H,17-18H2,1-7H3,(H,29,33)(H,30,32)/t23-,24-/m0/s1
    MOLECULAR FORMULA
    C28H39N3O4
    CROSS REFERENCES
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    canSAR20957
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight481.29
    AlogP3.82
    HBond donors2
    HBond acceptors7
    Atoms74
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR20957.