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canSAR552209
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NAMES
    SMILES
    COc1cc(-c2ccccc2)c2c(c1)N(c1nc3ccc(F)cc3c(C(=O)[O-])c1C)CC2.[Na+]
    InChI
    InChI=1S/C26H21FN2O3.Na/c1-15-24(26(30)31)21-12-17(27)8-9-22(21)28-25(15)29-11-10-19-20(16-6-4-3-5-7-16)13-18(32-2)14-23(19)29;/h3-9,12-14H,10-11H2,1-2H3,(H,30,31);/q;+1/p-1
    MOLECULAR FORMULA
    C26H20FN2NaO3
    CROSS REFERENCES
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    canSAR552209

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.14
    AlogP 1.42
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR552209.