canSAR1087677
FEATURES
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NAMES
    SMILES
    C[C@@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccc(Nc2ccc(O)c(CN3CCCC3)c2)cc1)c1ccccc1
    InChI
    InChI=1S/C36H42N4O3/c1-26(28-12-6-3-7-13-28)37-24-35(42)33(22-27-10-4-2-5-11-27)39-36(43)29-14-16-31(17-15-29)38-32-18-19-34(41)30(23-32)25-40-20-8-9-21-40/h2-7,10-19,23,26,33,35,37-38,41-42H,8-9,20-22,24-25H2,1H3,(H,39,43)/t26-,33+,35-/m1/s1
    MOLECULAR FORMULA
    C36H42N4O3
    CROSS REFERENCES
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    canSAR1087677
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight578.33
    AlogP5.78
    HBond donors5
    HBond acceptors7
    Atoms85
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087677.