1616868 logo
canSAR1616868
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(OCC2CCC(C(F)(F)F)CC2)cc1F
    InChI
    InChI=1S/C21H25F4NO4S/c22-18-10-19(30-11-12-1-5-14(6-2-12)21(23,24)25)16(13-3-4-13)9-17(18)20(27)26-31(28,29)15-7-8-15/h9-10,12-15H,1-8,11H2,(H,26,27)/t12?,14-
    MOLECULAR FORMULA
    C21H25F4NO4S
    CROSS REFERENCES
    1616868 logo

    canSAR1616868

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.14
    AlogP 4.67
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    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 canSAR1616868.