canSAR1503529
FEATURES
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NAMES
    SMILES
    CCCCCCCN1CCc2c(c([N+](=O)[O-])cc3[n-]c(=[OH+])c(=O)[nH]c23)C1
    InChI
    InChI=1S/C18H24N4O4/c1-2-3-4-5-6-8-21-9-7-12-13(11-21)15(22(25)26)10-14-16(12)20-18(24)17(23)19-14/h10H,2-9,11H2,1H3,(H2,19,20,23,24)
    MOLECULAR FORMULA
    C18H24N4O4
    CROSS REFERENCES
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    canSAR1503529
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight360.18
    AlogP1.73
    HBond donors2
    HBond acceptors8
    Atoms50
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503529.