1062529 logo
canSAR1062529
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(Oc1cc(=O)oc2ccccc12)C(=O)Nc1ccc(C(F)(F)F)cc1C#N
    InChI
    InChI=1S/C20H13F3N2O4/c1-11(28-17-9-18(26)29-16-5-3-2-4-14(16)17)19(27)25-15-7-6-13(20(21,22)23)8-12(15)10-24/h2-9,11H,1H3,(H,25,27)
    MOLECULAR FORMULA
    C20H13F3N2O4
    CROSS REFERENCES
    1062529 logo

    canSAR1062529

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.08
    AlogP 4.09
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    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 canSAR1062529.