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canSAR2085895
FEATURES
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NAMES
    SMILES
    CN(C)[C@H]1CCN(c2ccc([C@H]3CN(c4nc(-c5ccncc5F)cc(=O)n4C)CCO3)cc2)C1
    InChI
    InChI=1S/C26H31FN6O2/c1-30(2)20-9-11-32(16-20)19-6-4-18(5-7-19)24-17-33(12-13-35-24)26-29-23(14-25(34)31(26)3)21-8-10-28-15-22(21)27/h4-8,10,14-15,20,24H,9,11-13,16-17H2,1-3H3/t20-,24+/m0/s1
    MOLECULAR FORMULA
    C26H31FN6O2
    CROSS REFERENCES
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    canSAR2085895

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.25
    AlogP 2.70
    HBond donors 0
    HBond acceptors 8
    Atoms 66
    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 canSAR2085895.