canSAR1646763
FEATURES
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NAMES
    SMILES
    Cc1cc(C)c(S(=O)(=O)NN=Cc2ccc([N+](=O)[O-])o2)c(C)c1
    InChI
    InChI=1S/C14H15N3O5S/c1-9-6-10(2)14(11(3)7-9)23(20,21)16-15-8-12-4-5-13(22-12)17(18)19/h4-8,16H,1-3H3
    MOLECULAR FORMULA
    C14H15N3O5S
    CROSS REFERENCES
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    canSAR1646763
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight337.07
    AlogP2.43
    HBond donors1
    HBond acceptors8
    Atoms38
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1646763.