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canSAR843581
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NAMES
    SMILES
    CCC(O)(c1cn(Cc2ccc3c(-c4ccccc4)c(CO)sc3c2)nn1)C(F)(F)F
    InChI
    InChI=1S/C22H20F3N3O2S/c1-2-21(30,22(23,24)25)19-12-28(27-26-19)11-14-8-9-16-17(10-14)31-18(13-29)20(16)15-6-4-3-5-7-15/h3-10,12,29-30H,2,11,13H2,1H3
    MOLECULAR FORMULA
    C22H20F3N3O2S
    CROSS REFERENCES
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    canSAR843581

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.12
    AlogP 4.86
    HBond donors 2
    HBond acceptors 5
    Atoms 51
    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 canSAR843581.