canSAR1631843
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(NC2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1
    InChI
    InChI=1S/C18H20N4O4/c23-21(24)16-6-7-17(18(12-16)22(25)26)19-15-8-10-20(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,15,19H,8-11,13H2
    MOLECULAR FORMULA
    C18H20N4O4
    CROSS REFERENCES
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    canSAR1631843
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight356.15
    AlogP3.58
    HBond donors1
    HBond acceptors8
    Atoms46
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1631843.