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canSAR67233
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NAMES
    SMILES
    COc1cc2nc(N3CCN(S(=O)(=O)c4ccc(OC(F)(F)F)cc4)CC3)nc(N)c2cc1OC
    InChI
    InChI=1S/C21H22F3N5O5S/c1-32-17-11-15-16(12-18(17)33-2)26-20(27-19(15)25)28-7-9-29(10-8-28)35(30,31)14-5-3-13(4-6-14)34-21(22,23)24/h3-6,11-12H,7-10H2,1-2H3,(H2,25,26,27)
    MOLECULAR FORMULA
    C21H22F3N5O5S
    CROSS REFERENCES
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    canSAR67233

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.13
    AlogP 2.64
    HBond donors 2
    HBond acceptors 10
    Atoms 57
    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 canSAR67233.