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canSAR1003416
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(N2CCc3c(cccc3[N+](=O)[O-])C2)c([N+](=O)[O-])c1
    InChI
    InChI=1S/C15H12N4O6/c20-17(21)11-4-5-14(15(8-11)19(24)25)16-7-6-12-10(9-16)2-1-3-13(12)18(22)23/h1-5,8H,6-7,9H2
    MOLECULAR FORMULA
    C15H12N4O6
    CROSS REFERENCES
    1003416 logo

    canSAR1003416

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 344.08
    AlogP 2.97
    HBond donors 0
    HBond acceptors 10
    Atoms 37
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1003416.