canSAR158311
FEATURES
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NAMES
    SMILES
    CC(C)C(NC(=O)N(C)Cc1cccc(C(C)(C)C)n1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@H](Cc1ccccc1)NC(=O)OCc1cccnc1
    InChI
    InChI=1S/C42H54N6O5/c1-29(2)38(47-40(51)48(6)27-33-20-13-21-37(44-33)42(3,4)5)39(50)46-35(24-31-17-11-8-12-18-31)36(49)25-34(23-30-15-9-7-10-16-30)45-41(52)53-28-32-19-14-22-43-26-32/h7-22,26,29,34-36,38,49H,23-25,27-28H2,1-6H3,(H,45,52)(H,46,50)(H,47,51)/t34-,35-,36-,38?/m0/s1
    MOLECULAR FORMULA
    C42H54N6O5
    CROSS REFERENCES
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    canSAR158311
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight722.42
    AlogP5.96
    HBond donors4
    HBond acceptors11
    Atoms107
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR158311.