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canSAR399251
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NAMES
    SMILES
    O=C1NCC2=C1[C@H](c1ccc(F)c(Br)c1)C1=C(O)CCCC1=N2
    InChI
    InChI=1S/C17H14BrFN2O2/c18-9-6-8(4-5-10(9)19)14-15-11(2-1-3-13(15)22)21-12-7-20-17(23)16(12)14/h4-6,14,22H,1-3,7H2,(H,20,23)/t14-/m1/s1
    MOLECULAR FORMULA
    C17H14BrFN2O2
    CROSS REFERENCES
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    canSAR399251

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.02
    AlogP 3.51
    HBond donors 2
    HBond acceptors 4
    Atoms 37
    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 canSAR399251.