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canSAR1596796
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NAMES
    SMILES
    O=C(NCC(F)(F)F)Nc1cccc(-c2cnc3cc(-c4cnn(C5CCOC5)c4)ccn23)c1
    InChI
    InChI=1S/C23H21F3N6O2/c24-23(25,26)14-28-22(33)30-18-3-1-2-16(8-18)20-11-27-21-9-15(4-6-31(20)21)17-10-29-32(12-17)19-5-7-34-13-19/h1-4,6,8-12,19H,5,7,13-14H2,(H2,28,30,33)
    MOLECULAR FORMULA
    C23H21F3N6O2
    CROSS REFERENCES
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    canSAR1596796

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.17
    AlogP 4.51
    HBond donors 2
    HBond acceptors 8
    Atoms 55
    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 canSAR1596796.