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canSAR398526
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NAMES
    SMILES
    Fc1ccc(CNc2ncnc3c2cnn3CC(Cl)c2ccc(F)cc2)cc1
    InChI
    InChI=1S/C20H16ClF2N5/c21-18(14-3-7-16(23)8-4-14)11-28-20-17(10-27-28)19(25-12-26-20)24-9-13-1-5-15(22)6-2-13/h1-8,10,12,18H,9,11H2,(H,24,25,26)
    MOLECULAR FORMULA
    C20H16ClF2N5
    CROSS REFERENCES
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    canSAR398526

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.11
    AlogP 4.70
    HBond donors 1
    HBond acceptors 5
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR398526.