canSAR863817
FEATURES
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NAMES
    SMILES
    CC(=O)c1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCCCCCCCCCC[C@@H]2Cc3cc(O)ccc3[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]32)cc1
    InChI
    InChI=1S/C47H62N2O5/c1-32(50)34-18-20-35(21-19-34)45(53)49-42(29-33-15-11-10-12-16-33)46(54)48-28-14-9-7-5-3-4-6-8-13-17-36-30-37-31-38(51)22-23-39(37)40-26-27-47(2)41(44(36)40)24-25-43(47)52/h10-12,15-16,18-23,31,36,40-44,51-52H,3-9,13-14,17,24-30H2,1-2H3,(H,48,54)(H,49,53)/t36-,40-,41+,42+,43+,44-,47+/m1/s1
    MOLECULAR FORMULA
    C47H62N2O5
    CROSS REFERENCES
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    canSAR863817
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight734.47
    AlogP9.10
    HBond donors4
    HBond acceptors7
    Atoms116
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR863817.