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canSAR1861227
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NAMES
    SMILES
    Brc1ccc2c(c1)[C@H]1c3cc(Br)ccc3[C@H](C2)N2CCC[C@@H]12
    InChI
    InChI=1S/C19H17Br2N/c20-12-4-3-11-8-18-14-6-5-13(21)10-16(14)19(15(11)9-12)17-2-1-7-22(17)18/h3-6,9-10,17-19H,1-2,7-8H2/t17-,18-,19-/m0/s1
    MOLECULAR FORMULA
    C19H17Br2N
    CROSS REFERENCES
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    canSAR1861227

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.97
    AlogP 5.42
    HBond donors 0
    HBond acceptors 1
    Atoms 39
    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 canSAR1861227.