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canSAR1836291
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NAMES
    SMILES
    Brc1ccc2c(c1)[C@H]1OCC[C@H]1[C@@H](c1cccs1)N2
    InChI
    InChI=1S/C15H14BrNOS/c16-9-3-4-12-11(8-9)15-10(5-6-18-15)14(17-12)13-2-1-7-19-13/h1-4,7-8,10,14-15,17H,5-6H2/t10-,14-,15-/m0/s1
    MOLECULAR FORMULA
    C15H14BrNOS
    CROSS REFERENCES
    1836291 logo

    canSAR1836291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.00
    AlogP 4.75
    HBond donors 1
    HBond acceptors 2
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1836291.