1125272 logo
canSAR1125272
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(Nc3ccnc(C(F)(F)F)c3)cc2)c(O)c1
    InChI
    InChI=1S/C24H24F3N5O2/c1-3-32(4-2)20-10-7-17(21(33)14-20)15-29-31-23(34)16-5-8-18(9-6-16)30-19-11-12-28-22(13-19)24(25,26)27/h5-15,33H,3-4H2,1-2H3,(H,28,30)(H,31,34)/b29-15+
    MOLECULAR FORMULA
    C24H24F3N5O2
    CROSS REFERENCES
    1125272 logo

    canSAR1125272

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.19
    AlogP 5.16
    HBond donors 3
    HBond acceptors 7
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1125272.