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canSAR1985453
FEATURES
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NAMES
    SMILES
    CC(Oc1ccc(Br)cc1)C(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1
    InChI
    InChI=1S/C22H26BrN3O4/c1-16(30-20-9-3-17(23)4-10-20)22(28)25(2)15-21(27)24-18-5-7-19(8-6-18)26-11-13-29-14-12-26/h3-10,16H,11-15H2,1-2H3,(H,24,27)
    MOLECULAR FORMULA
    C22H26BrN3O4
    CROSS REFERENCES
    1985453 logo

    canSAR1985453

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.11
    AlogP 3.15
    HBond donors 1
    HBond acceptors 7
    Atoms 56
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1985453.