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canSAR1125837
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NAMES
    SMILES
    CC(C)(C)Nc1nc(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2s1
    InChI
    InChI=1S/C12H12N4O5S/c1-12(2,3)14-11-13-10(17)7-4-6(15(18)19)5-8(16(20)21)9(7)22-11/h4-5H,1-3H3,(H,13,14,17)
    MOLECULAR FORMULA
    C12H12N4O5S
    CROSS REFERENCES
    1125837 logo

    canSAR1125837

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.05
    AlogP 2.68
    HBond donors 1
    HBond acceptors 9
    Atoms 34
    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 canSAR1125837.