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canSAR922274
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NAMES
    SMILES
    CC1(C)OC2=C(C(=O)C3=C(C2=O)[C@H]2c4cc(Br)ccc4CO[C@H]2C(C)(C)O3)[C@@H]2c3cc(Br)ccc3OC[C@@H]21
    InChI
    InChI=1S/C30H26Br2O6/c1-29(2)18-12-35-19-8-7-15(32)10-17(19)20(18)22-24(33)27-23(25(34)26(22)37-29)21-16-9-14(31)6-5-13(16)11-36-28(21)30(3,4)38-27/h5-10,18,20-21,28H,11-12H2,1-4H3/t18-,20+,21+,28+/m0/s1
    MOLECULAR FORMULA
    C30H26Br2O6
    CROSS REFERENCES
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    canSAR922274

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 640.01
    AlogP 6.26
    HBond donors 0
    HBond acceptors 6
    Atoms 64
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR922274.