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canSAR1153793
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NAMES
    SMILES
    O=C1N(Cc2cccc3ccccc23)C(Cc2ccccc2)C(O)C(C(Br)Cc2ccccc2)N1Cc1cccc2ccccc12
    InChI
    InChI=1S/C41H37BrN2O2/c42-37(25-29-13-3-1-4-14-29)39-40(45)38(26-30-15-5-2-6-16-30)43(27-33-21-11-19-31-17-7-9-23-35(31)33)41(46)44(39)28-34-22-12-20-32-18-8-10-24-36(32)34/h1-24,37-40,45H,25-28H2
    MOLECULAR FORMULA
    C41H37BrN2O2
    CROSS REFERENCES
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    canSAR1153793

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 668.20
    AlogP 8.78
    HBond donors 1
    HBond acceptors 4
    Atoms 83
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1153793.