1127405 logo
canSAR1127405
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)c1c(C(F)(F)F)[n+]([O-])c2ccc(C(F)(F)F)cc2[n+]1[O-]
    InChI
    InChI=1S/C12H6F6N2O4/c1-24-10(21)8-9(12(16,17)18)20(23)6-3-2-5(11(13,14)15)4-7(6)19(8)22/h2-4H,1H3
    MOLECULAR FORMULA
    C12H6F6N2O4
    CROSS REFERENCES
    1127405 logo

    canSAR1127405

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 356.02
    AlogP 1.93
    HBond donors 0
    HBond acceptors 6
    Atoms 30
    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 canSAR1127405.