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canSAR1595868
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NAMES
    SMILES
    N#CC1=C2Nc3ccccc3N2C(=O)NC1(c1ccccc1)C(F)(F)F
    InChI
    InChI=1S/C18H11F3N4O/c19-18(20,21)17(11-6-2-1-3-7-11)12(10-22)15-23-13-8-4-5-9-14(13)25(15)16(26)24-17/h1-9,23H,(H,24,26)
    MOLECULAR FORMULA
    C18H11F3N4O
    CROSS REFERENCES
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    canSAR1595868

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 356.09
    AlogP 3.83
    HBond donors 2
    HBond acceptors 5
    Atoms 37
    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 canSAR1595868.