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canSAR1634569
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NAMES
    SMILES
    COc1nc(NCCc2ccc(F)cc2)nc(-c2ccc(OC)c(C#N)c2)n1
    InChI
    InChI=1S/C20H18FN5O2/c1-27-17-8-5-14(11-15(17)12-22)18-24-19(26-20(25-18)28-2)23-10-9-13-3-6-16(21)7-4-13/h3-8,11H,9-10H2,1-2H3,(H,23,24,25,26)
    MOLECULAR FORMULA
    C20H18FN5O2
    CROSS REFERENCES
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    canSAR1634569

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.14
    AlogP 3.22
    HBond donors 1
    HBond acceptors 7
    Atoms 46
    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 canSAR1634569.