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canSAR1128682
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NAMES
    SMILES
    CC(C(=O)NCc1ccc(C(F)(F)F)nc1OCC1CCC1)c1ccc(NS(C)(=O)=O)c(F)c1
    InChI
    InChI=1S/C22H25F4N3O4S/c1-13(15-6-8-18(17(23)10-15)29-34(2,31)32)20(30)27-11-16-7-9-19(22(24,25)26)28-21(16)33-12-14-4-3-5-14/h6-10,13-14,29H,3-5,11-12H2,1-2H3,(H,27,30)
    MOLECULAR FORMULA
    C22H25F4N3O4S
    CROSS REFERENCES
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    canSAR1128682

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.15
    AlogP 4.21
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    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 canSAR1128682.