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canSAR74892
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NAMES
    SMILES
    O=C(Nc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1)c1ccc(Nc2ccncn2)cc1
    InChI
    InChI=1S/C21H13F4N5O2/c22-16-6-3-13(9-15(16)21(23,24)25)20-30-18(10-32-20)29-19(31)12-1-4-14(5-2-12)28-17-7-8-26-11-27-17/h1-11H,(H,29,31)(H,26,27,28)
    MOLECULAR FORMULA
    C21H13F4N5O2
    CROSS REFERENCES
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    canSAR74892

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.10
    AlogP 5.29
    HBond donors 2
    HBond acceptors 7
    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 canSAR74892.