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canSAR1985876
FEATURES
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NAMES
    SMILES
    O=C(NC(=S)Nc1ccc2[nH]c(O)nc2c1)c1ccccc1[N+](=O)[O-]
    InChI
    InChI=1S/C15H11N5O4S/c21-13(9-3-1-2-4-12(9)20(23)24)19-15(25)16-8-5-6-10-11(7-8)18-14(22)17-10/h1-7H,(H2,17,18,22)(H2,16,19,21,25)
    MOLECULAR FORMULA
    C15H11N5O4S
    CROSS REFERENCES
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    canSAR1985876

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.05
    AlogP 2.30
    HBond donors 4
    HBond acceptors 9
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1985876.