2050511 logo
canSAR2050511
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN(c1cc(Cl)cc(C(=O)NCc2c(C(F)(F)F)cc(C)[nH]c2=O)c1C)C1CCOCC1
    InChI
    InChI=1S/C23H27ClF3N3O3/c1-4-30(16-5-7-33-8-6-16)20-11-15(24)10-17(14(20)3)21(31)28-12-18-19(23(25,26)27)9-13(2)29-22(18)32/h9-11,16H,4-8,12H2,1-3H3,(H,28,31)(H,29,32)
    MOLECULAR FORMULA
    C23H27ClF3N3O3
    CROSS REFERENCES
    2050511 logo

    canSAR2050511

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.17
    AlogP 4.60
    HBond donors 2
    HBond acceptors 6
    Atoms 60
    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 canSAR2050511.