canSAR701974
FEATURES
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NAMES
    SMILES
    CCc1c(CC)c2cc3nc(cc4[nH]c(c(C)c4CC)c4[nH]c(cc5nc(cc1[nH]2)C(CCC(=O)NCCOCCOCCO)=C5C)c(CC)c4C)C(C)=C3CCC(=O)NCCOCCOCCO
    InChI
    InChI=1S/C54H75N7O8/c1-9-37-35(7)53-54-36(8)38(10-2)46(61-54)30-44-34(6)42(14-16-52(65)56-18-22-67-26-28-69-24-20-63)50(58-44)32-48-40(12-4)39(11-3)47(59-48)31-49-41(33(5)43(57-49)29-45(37)60-53)13-15-51(64)55-17-21-66-25-27-68-23-19-62/h29-32,59-63H,9-28H2,1-8H3,(H,55,64)(H,56,65)/b43-29-,44-30-,45-29-,46-30-,47-31-,48-32-,49-31-,50-32-,54-53-
    MOLECULAR FORMULA
    C54H75N7O8
    CROSS REFERENCES
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    canSAR701974
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight949.57
    AlogP7.93
    HBond donors7
    HBond acceptors15
    Atoms144
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR701974.