canSAR1649447
FEATURES
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NAMES
    SMILES
    CC(C)(C)c1ccc(/C(O)=C(/C([S-])=NCc2ccco2)[n+]2ccccc2)cc1
    InChI
    InChI=1S/C23H24N2O2S/c1-23(2,3)18-11-9-17(10-12-18)21(26)20(25-13-5-4-6-14-25)22(28)24-16-19-8-7-15-27-19/h4-15H,16H2,1-3H3,(H-,24,26,28)
    MOLECULAR FORMULA
    C23H24N2O2S
    CROSS REFERENCES
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    canSAR1649447
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight392.16
    AlogP4.89
    HBond donors1
    HBond acceptors4
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1649447.