1127305 logo
canSAR1127305
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCc1ccc(S(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1)c1cc2cnccc2[nH]1
    InChI
    InChI=1S/C22H16F3N3O3S/c23-22(24,25)16-3-7-18(8-4-16)32(30,31)17-5-1-14(2-6-17)12-27-21(29)20-11-15-13-26-10-9-19(15)28-20/h1-11,13,28H,12H2,(H,27,29)
    MOLECULAR FORMULA
    C22H16F3N3O3S
    CROSS REFERENCES
    1127305 logo

    canSAR1127305

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.09
    AlogP 4.34
    HBond donors 2
    HBond acceptors 6
    Atoms 48
    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 canSAR1127305.