canSAR947360
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)CN(CCNC(=O)Nc2cccc3ccccc23)[C@H](C)[C@@H](O)[C@]1(C)O
    InChI
    InChI=1S/C50H82N4O13/c1-14-38-50(10,61)42(56)32(6)54(23-22-51-47(59)52-36-21-17-19-34-18-15-16-20-35(34)36)27-28(2)25-48(8,60)44(67-46-40(55)37(53(11)12)24-29(3)63-46)30(4)41(31(5)45(58)65-38)66-39-26-49(9,62-13)43(57)33(7)64-39/h15-21,28-33,37-44,46,55-57,60-61H,14,22-27H2,1-13H3,(H2,51,52,59)/t28-,29-,30+,31-,32-,33+,37+,38-,39+,40-,41+,42-,43+,44-,46+,48-,49-,50-/m1/s1
    MOLECULAR FORMULA
    C50H82N4O13
    CROSS REFERENCES
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    canSAR947360
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight946.59
    AlogP4.25
    HBond donors7
    HBond acceptors17
    Atoms149
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR947360.