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canSAR1122961
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NAMES
    SMILES
    Cn1cc(-c2cnc3[nH]cc(-c4cnn(Cc5ccccc5F)c4)c3c2)cn1
    InChI
    InChI=1S/C21H17FN6/c1-27-11-16(8-25-27)15-6-18-19(10-24-21(18)23-7-15)17-9-26-28(13-17)12-14-4-2-3-5-20(14)22/h2-11,13H,12H2,1H3,(H,23,24)
    MOLECULAR FORMULA
    C21H17FN6
    CROSS REFERENCES
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    canSAR1122961

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.15
    AlogP 4.01
    HBond donors 1
    HBond acceptors 6
    Atoms 45
    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 canSAR1122961.