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canSAR1865351
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NAMES
    SMILES
    Cn1c(=O)c2c(nc(NCCCO)n2Cc2cccc(C(F)(F)F)c2)n(C)c1=O
    InChI
    InChI=1S/C18H20F3N5O3/c1-24-14-13(15(28)25(2)17(24)29)26(16(23-14)22-7-4-8-27)10-11-5-3-6-12(9-11)18(19,20)21/h3,5-6,9,27H,4,7-8,10H2,1-2H3,(H,22,23)
    MOLECULAR FORMULA
    C18H20F3N5O3
    CROSS REFERENCES
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    canSAR1865351

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.15
    AlogP 1.30
    HBond donors 2
    HBond acceptors 8
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1865351.