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canSAR1265489
FEATURES
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NAMES
    SMILES
    O=C1NC(=O)C2(c3ccccc3-c3ccccc32)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C21H13N3O6S/c25-19-21(17-7-3-1-5-15(17)16-6-2-4-8-18(16)21)23(20(26)22-19)31(29,30)14-11-9-13(10-12-14)24(27)28/h1-12H,(H,22,25,26)
    MOLECULAR FORMULA
    C21H13N3O6S
    CROSS REFERENCES
    1265489 logo

    canSAR1265489

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.05
    AlogP 2.76
    HBond donors 1
    HBond acceptors 9
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1265489.