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canSAR1120911
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NAMES
    SMILES
    Nc1cc(CN2CCC(C(=O)N3CCC(n4c(=O)n(CC(F)(F)F)c5cc(F)ccc54)CC3)CC2)ccn1
    InChI
    InChI=1S/C26H30F4N6O2/c27-19-1-2-21-22(14-19)35(16-26(28,29)30)25(38)36(21)20-6-11-34(12-7-20)24(37)18-4-9-33(10-5-18)15-17-3-8-32-23(31)13-17/h1-3,8,13-14,18,20H,4-7,9-12,15-16H2,(H2,31,32)
    MOLECULAR FORMULA
    C26H30F4N6O2
    CROSS REFERENCES
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    canSAR1120911

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.24
    AlogP 3.56
    HBond donors 2
    HBond acceptors 8
    Atoms 68
    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 canSAR1120911.