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canSAR115695
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCC(=O)O[C@@H](C)[C@@H](O)[C@@H](O)C[C@@H](O)c1coc(Cc2cnco2)n1
    InChI
    InChI=1S/C27H44N2O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-26(32)36-20(2)27(33)24(31)16-23(30)22-18-34-25(29-22)15-21-17-28-19-35-21/h17-20,23-24,27,30-31,33H,3-16H2,1-2H3/t20-,23+,24-,27+/m0/s1
    MOLECULAR FORMULA
    C27H44N2O7
    CROSS REFERENCES
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    canSAR115695

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.31
    AlogP 5.03
    HBond donors 3
    HBond acceptors 9
    Atoms 80
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR115695.