658224 logo
canSAR658224
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=S(=O)(NC1CCN(CCCO)CC1)c1cc(S(=O)(=O)c2ccccc2)ccc1C(F)(F)F
    InChI
    InChI=1S/C21H25F3N2O5S2/c22-21(23,24)19-8-7-18(32(28,29)17-5-2-1-3-6-17)15-20(19)33(30,31)25-16-9-12-26(13-10-16)11-4-14-27/h1-3,5-8,15-16,25,27H,4,9-14H2
    MOLECULAR FORMULA
    C21H25F3N2O5S2
    CROSS REFERENCES
    658224 logo

    canSAR658224

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 506.12
    AlogP 2.66
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR658224.