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canSAR660312
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NAMES
    SMILES
    Cc1ccc([P+](Cc2ccc(C(=O)c3ccc(C[P+](c4ccccc4)(c4ccccc4)c4ccc(C)cc4)cc3)cc2)(c2ccccc2)c2ccccc2)cc1.[Br-].[Br-]
    InChI
    InChI=1S/C53H46OP2.2BrH/c1-41-23-35-51(36-24-41)55(47-15-7-3-8-16-47,48-17-9-4-10-18-48)39-43-27-31-45(32-28-43)53(54)46-33-29-44(30-34-46)40-56(49-19-11-5-12-20-49,50-21-13-6-14-22-50)52-37-25-42(2)26-38-52;;/h3-38H,39-40H2,1-2H3;2*1H/q+2;;/p-2
    MOLECULAR FORMULA
    C53H46Br2OP2
    CROSS REFERENCES
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    canSAR660312

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 918.14
    AlogP 4.53
    HBond donors 0
    HBond acceptors 1
    Atoms 104
    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 canSAR660312.