canSAR606997
FEATURES
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NAMES
    SMILES
    CCCCOC(=O)NC(=O)c1cn(CCSCCOC(=O)NCCCCCCNC(=O)OCCSCCn2cc(C(=O)NC(=O)OCCCC)c(=O)[nH]c2=O)c(=O)[nH]c1=O
    InChI
    InChI=1S/C36H54N8O14S2/c1-3-5-15-55-35(53)41-29(47)25-23-43(31(49)39-27(25)45)13-19-59-21-17-57-33(51)37-11-9-7-8-10-12-38-34(52)58-18-22-60-20-14-44-24-26(28(46)40-32(44)50)30(48)42-36(54)56-16-6-4-2/h23-24H,3-22H2,1-2H3,(H,37,51)(H,38,52)(H,39,45,49)(H,40,46,50)(H,41,47,53)(H,42,48,54)
    MOLECULAR FORMULA
    C36H54N8O14S2
    CROSS REFERENCES
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    canSAR606997
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight886.32
    AlogP1.90
    HBond donors6
    HBond acceptors22
    Atoms114
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR606997.