canSAR2096158
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)n1cc(COCCCCCCCCCCCCOCCOCc2ccccc2)nn1
    InChI
    InChI=1S/C48H85N3O11/c1-2-3-4-5-6-7-8-9-12-15-18-24-29-42(53)44(54)41(38-61-48-47(57)46(56)45(55)43(35-52)62-48)51-34-40(49-50-51)37-59-31-26-20-17-14-11-10-13-16-19-25-30-58-32-33-60-36-39-27-22-21-23-28-39/h21-23,27-28,34,41-48,52-57H,2-20,24-26,29-33,35-38H2,1H3/t41-,42+,43+,44-,45-,46-,47+,48-/m0/s1
    MOLECULAR FORMULA
    C48H85N3O11
    CROSS REFERENCES
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    canSAR2096158
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight879.62
    AlogP7.10
    HBond donors6
    HBond acceptors14
    Atoms147
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096158.