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canSAR1621314
FEATURES
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NAMES
    SMILES
    C[C@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2O[C@H]1CN(C)Cc1ccc(-c2ccccc2)cc1
    InChI
    InChI=1S/C36H39FN4O4/c1-24-20-41(25(2)23-42)35(43)32-19-31(39-36(44)38-30-15-13-29(37)14-16-30)17-18-33(32)45-34(24)22-40(3)21-26-9-11-28(12-10-26)27-7-5-4-6-8-27/h4-19,24-25,34,42H,20-23H2,1-3H3,(H2,38,39,44)/t24-,25-,34-/m0/s1
    MOLECULAR FORMULA
    C36H39FN4O4
    CROSS REFERENCES
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    canSAR1621314

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 610.30
    AlogP 6.49
    HBond donors 3
    HBond acceptors 8
    Atoms 84
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1621314.