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canSAR1269969
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NAMES
    SMILES
    Cc1cc(C(=O)N2CCc3c(sc(NCc4ccc(F)cc4)c3C#N)C2)[nH]n1
    InChI
    InChI=1S/C20H18FN5OS/c1-12-8-17(25-24-12)20(27)26-7-6-15-16(9-22)19(28-18(15)11-26)23-10-13-2-4-14(21)5-3-13/h2-5,8,23H,6-7,10-11H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C20H18FN5OS
    CROSS REFERENCES
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    canSAR1269969

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.12
    AlogP 3.60
    HBond donors 2
    HBond acceptors 6
    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 canSAR1269969.