canSAR2158564
FEATURES
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NAMES
    SMILES
    COCCOCCOCCOc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)cc(NS(=O)(=O)N5CCCCC5)c4OC)c4ccccc34)n2)cc(OC)c1
    InChI
    InChI=1S/C45H57N7O10S/c1-45(2,3)31-26-38(42(58-6)39(27-31)51-63(54,55)52-18-10-7-11-19-52)49-44(53)48-37-14-15-40(36-13-9-8-12-35(36)37)62-41-16-17-46-43(50-41)47-32-28-33(57-5)30-34(29-32)61-25-24-60-23-22-59-21-20-56-4/h8-9,12-17,26-30,51H,7,10-11,18-25H2,1-6H3,(H,46,47,50)(H2,48,49,53)
    MOLECULAR FORMULA
    C45H57N7O10S
    CROSS REFERENCES
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    canSAR2158564
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight887.39
    AlogP8.33
    HBond donors4
    HBond acceptors17
    Atoms120
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2158564.