canSAR20997
FEATURES
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NAMES
    SMILES
    CCCCCC(=O)N[C@H](C(=O)NCCCCCCCCCCC[C@@H]1Cc2cc(O)ccc2C2CC[C@@]3(C)C(CC[C@@H]3O)C21)C(C)CC
    InChI
    InChI=1S/C41H68N2O4/c1-5-7-15-19-37(46)43-39(29(3)6-2)40(47)42-26-17-14-12-10-8-9-11-13-16-18-30-27-31-28-32(44)20-21-33(31)34-24-25-41(4)35(38(30)34)22-23-36(41)45/h20-21,28-30,34-36,38-39,44-45H,5-19,22-27H2,1-4H3,(H,42,47)(H,43,46)/t29?,30-,34?,35?,36+,38?,39+,41+/m1/s1
    MOLECULAR FORMULA
    C41H68N2O4
    CROSS REFERENCES
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    canSAR20997
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight652.52
    AlogP8.96
    HBond donors4
    HBond acceptors6
    Atoms115
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR20997.