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canSAR1114920
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NAMES
    SMILES
    COC(=O)N(OC)c1ccccc1COc1nc(Nc2ccc(F)c(F)c2F)nc(C(F)(F)F)c1C
    InChI
    InChI=1S/C22H18F6N4O4/c1-11-18(22(26,27)28)30-20(29-14-9-8-13(23)16(24)17(14)25)31-19(11)36-10-12-6-4-5-7-15(12)32(35-3)21(33)34-2/h4-9H,10H2,1-3H3,(H,29,30,31)
    MOLECULAR FORMULA
    C22H18F6N4O4
    CROSS REFERENCES
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    canSAR1114920

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.12
    AlogP 5.68
    HBond donors 1
    HBond acceptors 8
    Atoms 54
    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 canSAR1114920.