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canSAR1991434
FEATURES
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NAMES
    SMILES
    CC(=NNC(=O)c1c(Br)cnn1C)c1ccc(NC(=O)c2ccc(F)cc2)cc1
    InChI
    InChI=1S/C20H17BrFN5O2/c1-12(25-26-20(29)18-17(21)11-23-27(18)2)13-5-9-16(10-6-13)24-19(28)14-3-7-15(22)8-4-14/h3-11H,1-2H3,(H,24,28)(H,26,29)
    MOLECULAR FORMULA
    C20H17BrFN5O2
    CROSS REFERENCES
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    canSAR1991434

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.05
    AlogP 3.73
    HBond donors 2
    HBond acceptors 7
    Atoms 46
    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 canSAR1991434.