canSAR1746174
FEATURES
Loading...
NAMES
    SMILES
    Cc1cc(N=S2(=O)CCCC2)cc2ncnc(Nc3ccc(F)cc3O[C@H](C)C(F)(F)F)c12
    InChI
    InChI=1S/C22H22F4N4O2S/c1-13-9-16(30-33(31)7-3-4-8-33)11-18-20(13)21(28-12-27-18)29-17-6-5-15(23)10-19(17)32-14(2)22(24,25)26/h5-6,9-12,14H,3-4,7-8H2,1-2H3,(H,27,28,29)/t14-/m1/s1
    MOLECULAR FORMULA
    C22H22F4N4O2S
    CROSS REFERENCES
    Loading...
    canSAR1746174
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight482.14
    AlogP6.04
    HBond donors1
    HBond acceptors6
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746174.