canSAR1846356
FEATURES
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NAMES
    SMILES
    Nc1nnc(CC(=O)NN=Cc2cc([N+](=O)[O-])ccc2O)s1
    InChI
    InChI=1S/C11H10N6O4S/c12-11-16-15-10(22-11)4-9(19)14-13-5-6-3-7(17(20)21)1-2-8(6)18/h1-3,5,18H,4H2,(H2,12,16)(H,14,19)
    MOLECULAR FORMULA
    C11H10N6O4S
    CROSS REFERENCES
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    canSAR1846356
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight322.05
    AlogP0.43
    HBond donors4
    HBond acceptors10
    Atoms32
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846356.