canSAR701541
FEATURES
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NAMES
    SMILES
    Cc1cc(C)c(Oc2nc(Nc3ccc(C#N)cc3)ncc2Br)c(C)c1
    InChI
    InChI=1S/C20H17BrN4O/c1-12-8-13(2)18(14(3)9-12)26-19-17(21)11-23-20(25-19)24-16-6-4-15(10-22)5-7-16/h4-9,11H,1-3H3,(H,23,24,25)
    MOLECULAR FORMULA
    C20H17BrN4O
    CROSS REFERENCES
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    canSAR701541
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight408.06
    AlogP5.57
    HBond donors1
    HBond acceptors5
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR701541.