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canSAR1858952
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NAMES
    SMILES
    N#Cc1cnc(NC(=O)Nc2ccc(CCNCc3ccc(F)cc3F)cc2)cn1
    InChI
    InChI=1S/C21H18F2N6O/c22-16-4-3-15(19(23)9-16)11-25-8-7-14-1-5-17(6-2-14)28-21(30)29-20-13-26-18(10-24)12-27-20/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
    MOLECULAR FORMULA
    C21H18F2N6O
    CROSS REFERENCES
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    canSAR1858952

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.15
    AlogP 3.60
    HBond donors 3
    HBond acceptors 7
    Atoms 48
    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 canSAR1858952.