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canSAR779958
FEATURES
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NAMES
    SMILES
    O=C(CCC(=O)N[C@@H](CCC(=O)OCC1CCCCC1)C(=O)OCc1ccccc1)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1
    InChI
    InChI=1S/C42H50N2O10/c45-37(43-35(41(49)53-29-33-17-9-3-10-18-33)21-25-39(47)51-27-31-13-5-1-6-14-31)23-24-38(46)44-36(42(50)54-30-34-19-11-4-12-20-34)22-26-40(48)52-28-32-15-7-2-8-16-32/h1,3-6,9-14,17-20,32,35-36H,2,7-8,15-16,21-30H2,(H,43,45)(H,44,46)/t35-,36-/m0/s1
    MOLECULAR FORMULA
    C42H50N2O10
    CROSS REFERENCES
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    canSAR779958

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 742.35
    AlogP 5.65
    HBond donors 2
    HBond acceptors 12
    Atoms 104
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR779958.