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canSAR1068553
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NAMES
    SMILES
    COC(=O)C1=C(C)NC=C([N+](=O)[O-])C1c1ccccc1C(F)(F)F
    InChI
    InChI=1S/C15H13F3N2O4/c1-8-12(14(21)24-2)13(11(7-19-8)20(22)23)9-5-3-4-6-10(9)15(16,17)18/h3-7,13,19H,1-2H3
    MOLECULAR FORMULA
    C15H13F3N2O4
    CROSS REFERENCES
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    canSAR1068553

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.08
    AlogP 2.96
    HBond donors 1
    HBond acceptors 6
    Atoms 37
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1068553.