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canSAR1974786
FEATURES
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NAMES
    SMILES
    Cc1ccc(/C(O)=C(/C([S-])=Nc2ccc(SC(F)F)cc2)[n+]2ccccc2)cc1[N+](=O)[O-]
    InChI
    InChI=1S/C22H17F2N3O3S2/c1-14-5-6-15(13-18(14)27(29)30)20(28)19(26-11-3-2-4-12-26)21(31)25-16-7-9-17(10-8-16)32-22(23)24/h2-13,22H,1H3,(H-,25,28,31)
    MOLECULAR FORMULA
    C22H17F2N3O3S2
    CROSS REFERENCES
    1974786 logo

    canSAR1974786

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.07
    AlogP 5.67
    HBond donors 1
    HBond acceptors 6
    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 canSAR1974786.