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canSAR1991890
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NAMES
    SMILES
    O=C(NCC1CCCO1)c1ccc(COc2ccc(Br)cc2)cc1
    InChI
    InChI=1S/C19H20BrNO3/c20-16-7-9-17(10-8-16)24-13-14-3-5-15(6-4-14)19(22)21-12-18-2-1-11-23-18/h3-10,18H,1-2,11-13H2,(H,21,22)
    MOLECULAR FORMULA
    C19H20BrNO3
    CROSS REFERENCES
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    canSAR1991890

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.06
    AlogP 3.94
    HBond donors 1
    HBond acceptors 4
    Atoms 44
    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 canSAR1991890.