105948 logo
canSAR105948
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccccc1-c1cccc(OC(F)(F)F)c1)C2
    InChI
    InChI=1S/C20H16F3N3O5/c21-20(22,23)31-15-6-3-5-13(8-15)17-7-2-1-4-14(17)11-29-16-9-25-10-18(26(27)28)24-19(25)30-12-16/h1-8,10,16H,9,11-12H2/t16-/m0/s1
    MOLECULAR FORMULA
    C20H16F3N3O5
    CROSS REFERENCES
    105948 logo

    canSAR105948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.10
    AlogP 4.33
    HBond donors 0
    HBond acceptors 8
    Atoms 47
    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 canSAR105948.