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canSAR1067896
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(SC(=S)N2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1
    InChI
    InChI=1S/C18H18N4O4S2/c23-21(24)15-6-7-17(16(12-15)22(25)26)28-18(27)20-10-8-19(9-11-20)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2
    MOLECULAR FORMULA
    C18H18N4O4S2
    CROSS REFERENCES
    1067896 logo

    canSAR1067896

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.08
    AlogP 3.70
    HBond donors 0
    HBond acceptors 8
    Atoms 46
    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 canSAR1067896.