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canSAR38570
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NAMES
    SMILES
    CCOC(=O)c1cc(-c2ccc(Cl)cc2)nn1CC(O)COc1ccccc1[N+](=O)[O-]
    InChI
    InChI=1S/C21H20ClN3O6/c1-2-30-21(27)19-11-17(14-7-9-15(22)10-8-14)23-24(19)12-16(26)13-31-20-6-4-3-5-18(20)25(28)29/h3-11,16,26H,2,12-13H2,1H3
    MOLECULAR FORMULA
    C21H20ClN3O6
    CROSS REFERENCES
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    canSAR38570

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.10
    AlogP 3.73
    HBond donors 1
    HBond acceptors 9
    Atoms 51
    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 canSAR38570.