canSAR1831093
FEATURES
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NAMES
    SMILES
    CN(C)CCNS(=O)(=O)c1ccc2c(c1)/C(=N/Nc1ccccc1[N+](=O)[O-])C(=O)N2
    InChI
    InChI=1S/C18H20N6O5S/c1-23(2)10-9-19-30(28,29)12-7-8-14-13(11-12)17(18(25)20-14)22-21-15-5-3-4-6-16(15)24(26)27/h3-8,11,19,21H,9-10H2,1-2H3,(H,20,22,25)
    MOLECULAR FORMULA
    C18H20N6O5S
    CROSS REFERENCES
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    canSAR1831093
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight432.12
    AlogP1.20
    HBond donors3
    HBond acceptors11
    Atoms50
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1831093.