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canSAR1270501
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NAMES
    SMILES
    COc1cc(-c2nc(Nc3cccc(C(F)(F)F)c3)n(C)n2)ccc1-n1cnc(C)n1
    InChI
    InChI=1S/C20H18F3N7O/c1-12-24-11-30(27-12)16-8-7-13(9-17(16)31-3)18-26-19(29(2)28-18)25-15-6-4-5-14(10-15)20(21,22)23/h4-11H,1-3H3,(H,25,26,28)
    MOLECULAR FORMULA
    C20H18F3N7O
    CROSS REFERENCES
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    canSAR1270501

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.15
    AlogP 4.14
    HBond donors 1
    HBond acceptors 8
    Atoms 49
    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 canSAR1270501.