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canSAR1718414
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NAMES
    SMILES
    N#CC1(C#N)CC(C=O)=C(N)C1(C#N)CC(=O)c1ccc(F)cc1
    InChI
    InChI=1S/C17H11FN4O2/c18-13-3-1-11(2-4-13)14(24)6-17(10-21)15(22)12(7-23)5-16(17,8-19)9-20/h1-4,7H,5-6,22H2
    MOLECULAR FORMULA
    C17H11FN4O2
    CROSS REFERENCES
    1718414 logo

    canSAR1718414

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 322.09
    AlogP 1.76
    HBond donors 2
    HBond acceptors 6
    Atoms 35
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1718414.