canSAR1644463
FEATURES
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NAMES
    SMILES
    COc1cccc(C=NN(C)c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])c1O
    InChI
    InChI=1S/C16H13F3N4O6/c1-21(20-8-9-4-3-5-13(29-2)15(9)24)14-11(22(25)26)6-10(16(17,18)19)7-12(14)23(27)28/h3-8,24H,1-2H3
    MOLECULAR FORMULA
    C16H13F3N4O6
    CROSS REFERENCES
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    canSAR1644463
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight414.08
    AlogP3.71
    HBond donors1
    HBond acceptors10
    Atoms42
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1644463.