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canSAR1826799
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NAMES
    SMILES
    N#Cc1ncc(Nc2nn([C@H]3CCCC[C@@H]3C#N)cc2C(N)=O)cc1F
    InChI
    InChI=1S/C17H16FN7O/c18-13-5-11(8-22-14(13)7-20)23-17-12(16(21)26)9-25(24-17)15-4-2-1-3-10(15)6-19/h5,8-10,15H,1-4H2,(H2,21,26)(H,23,24)/t10-,15+/m1/s1
    MOLECULAR FORMULA
    C17H16FN7O
    CROSS REFERENCES
    1826799 logo

    canSAR1826799

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.14
    AlogP 2.39
    HBond donors 3
    HBond acceptors 8
    Atoms 42
    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 canSAR1826799.