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canSAR72885
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NAMES
    SMILES
    O=C(/C=C(\O)c1cccc(Cc2ccccc2F)c1)C(=O)N1CCN(C(=O)C(=O)/C=C(\O)c2cccc(Cc3ccccc3F)c2)CC1
    InChI
    InChI=1S/C38H32F2N2O6/c39-31-13-3-1-9-27(31)19-25-7-5-11-29(21-25)33(43)23-35(45)37(47)41-15-17-42(18-16-41)38(48)36(46)24-34(44)30-12-6-8-26(22-30)20-28-10-2-4-14-32(28)40/h1-14,21-24,43-44H,15-20H2/b33-23-,34-24-
    MOLECULAR FORMULA
    C38H32F2N2O6
    CROSS REFERENCES
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    canSAR72885

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 650.22
    AlogP 5.45
    HBond donors 2
    HBond acceptors 8
    Atoms 80
    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 canSAR72885.