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canSAR1635097
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NAMES
    SMILES
    Cc1nn(Cc2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2)c(C)c1CC(=O)O
    InChI
    InChI=1S/C23H19F3N2O2/c1-15-21(13-22(29)30)16(2)28(27-15)14-19-7-5-17(6-8-19)3-4-18-9-11-20(12-10-18)23(24,25)26/h5-12H,13-14H2,1-2H3,(H,29,30)
    MOLECULAR FORMULA
    C23H19F3N2O2
    CROSS REFERENCES
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    canSAR1635097

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.14
    AlogP 4.59
    HBond donors 1
    HBond acceptors 4
    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 canSAR1635097.