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canSAR561228
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NAMES
    SMILES
    Cc1cc(C)[n+](NC(=O)c2[nH]c3ccc(S(N)(=O)=O)cc3c2-c2ccccc2F)c(C)c1
    InChI
    InChI=1S/C23H21FN4O3S/c1-13-10-14(2)28(15(3)11-13)27-23(29)22-21(17-6-4-5-7-19(17)24)18-12-16(32(25,30)31)8-9-20(18)26-22/h4-12H,1-3H3,(H3-,25,26,27,29,30,31)/p+1
    MOLECULAR FORMULA
    C23H22FN4O3S+
    CROSS REFERENCES
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    canSAR561228

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.14
    AlogP 3.22
    HBond donors 4
    HBond acceptors 7
    Atoms 54
    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 canSAR561228.