canSAR2092834
FEATURES
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NAMES
    SMILES
    Cc1ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)B2OC3C[C@@H]4C[C@@H](C4(C)C)[C@]3(C)O2)cc1
    InChI
    InChI=1S/C30H47BN2O5/c1-18(2)14-22(32-27(35)36-28(4,5)6)26(34)33-25(15-20-12-10-19(3)11-13-20)31-37-24-17-21-16-23(29(21,7)8)30(24,9)38-31/h10-13,18,21-25H,14-17H2,1-9H3,(H,32,35)(H,33,34)/t21-,22-,23-,24?,25-,30-/m0/s1
    MOLECULAR FORMULA
    C30H47BN2O5
    CROSS REFERENCES
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    canSAR2092834
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight526.36
    AlogP5.23
    HBond donors2
    HBond acceptors7
    Atoms85
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2092834.