canSAR2154874
FEATURES
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NAMES
    SMILES
    Cc1nc(C(=O)Nc2cnn(Cc3nc(C(C)(C)O)co3)n2)c(-c2cccc(OC(F)(F)F)c2)o1
    InChI
    InChI=1S/C21H19F3N6O5/c1-11-26-17(18(34-11)12-5-4-6-13(7-12)35-21(22,23)24)19(31)28-15-8-25-30(29-15)9-16-27-14(10-33-16)20(2,3)32/h4-8,10,32H,9H2,1-3H3,(H,28,29,31)
    MOLECULAR FORMULA
    C21H19F3N6O5
    CROSS REFERENCES
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    canSAR2154874
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight492.14
    AlogP3.66
    HBond donors2
    HBond acceptors11
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2154874.