canSAR633633
FEATURES
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NAMES
    SMILES
    COC(=O)C1(N2CCOCC2)CCC([C@@H](c2ccccc2)C(C)[N+](=O)[O-])C1
    InChI
    InChI=1S/C20H28N2O5/c1-15(22(24)25)18(16-6-4-3-5-7-16)17-8-9-20(14-17,19(23)26-2)21-10-12-27-13-11-21/h3-7,15,17-18H,8-14H2,1-2H3/t15?,17?,18-,20?/m1/s1
    MOLECULAR FORMULA
    C20H28N2O5
    CROSS REFERENCES
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    canSAR633633
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight376.20
    AlogP2.48
    HBond donors0
    HBond acceptors7
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633633.