canSAR2093459
FEATURES
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NAMES
    SMILES
    CC1(C)[C@@H]2CC3OB([C@H](Cc4ccccc4)NC(=O)[C@H](Cc4ccccc4)NC(=O)C4CCc5ccccc5C4)O[C@@]3(C)[C@H]1C2
    InChI
    InChI=1S/C38H45BN2O4/c1-37(2)30-23-32(37)38(3)33(24-30)44-39(45-38)34(21-26-14-8-5-9-15-26)41-36(43)31(20-25-12-6-4-7-13-25)40-35(42)29-19-18-27-16-10-11-17-28(27)22-29/h4-17,29-34H,18-24H2,1-3H3,(H,40,42)(H,41,43)/t29?,30-,31-,32-,33?,34-,38-/m0/s1
    MOLECULAR FORMULA
    C38H45BN2O4
    CROSS REFERENCES
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    canSAR2093459
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight604.35
    AlogP5.51
    HBond donors2
    HBond acceptors6
    Atoms90
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2093459.