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canSAR559848
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCOCC(COC(=O)NCC[N+](C)(C)C)OC(C)=O
    InChI
    InChI=1S/C29H58N2O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-34-25-28(36-27(2)32)26-35-29(33)30-22-23-31(3,4)5/h28H,6-26H2,1-5H3/p+1
    MOLECULAR FORMULA
    C29H59N2O5+
    CROSS REFERENCES
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    canSAR559848

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.44
    AlogP 6.63
    HBond donors 1
    HBond acceptors 7
    Atoms 95
    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 canSAR559848.