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canSAR1971049
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NAMES
    SMILES
    Cc1ccc(Cn2c(=N)n(CC(O)c3cccc(Br)c3)c3ccccc32)cc1
    InChI
    InChI=1S/C23H22BrN3O/c1-16-9-11-17(12-10-16)14-26-20-7-2-3-8-21(20)27(23(26)25)15-22(28)18-5-4-6-19(24)13-18/h2-13,22,25,28H,14-15H2,1H3
    MOLECULAR FORMULA
    C23H22BrN3O
    CROSS REFERENCES
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    canSAR1971049

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.09
    AlogP 4.78
    HBond donors 2
    HBond acceptors 4
    Atoms 50
    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 canSAR1971049.