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canSAR2087660
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NAMES
    SMILES
    C[C@H]1CN(c2ccc([C@H]3CN(c4nc(-c5ccncc5F)cc(=O)n4C)CCN3)cc2)C[C@@H](C)N1
    InChI
    InChI=1S/C26H32FN7O/c1-17-14-34(15-18(2)30-17)20-6-4-19(5-7-20)24-16-33(11-10-29-24)26-31-23(12-25(35)32(26)3)21-8-9-28-13-22(21)27/h4-9,12-13,17-18,24,29-30H,10-11,14-16H2,1-3H3/t17-,18+,24-/m1/s1
    MOLECULAR FORMULA
    C26H32FN7O
    CROSS REFERENCES
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    canSAR2087660

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.27
    AlogP 2.32
    HBond donors 2
    HBond acceptors 8
    Atoms 67
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2087660.