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canSAR1532098
FEATURES
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NAMES
    SMILES
    Cc1c(C(=O)Oc2cc(N)n(S(C)(=O)=O)n2)cccc1[N+](=O)[O-]
    InChI
    InChI=1S/C12H12N4O6S/c1-7-8(4-3-5-9(7)16(18)19)12(17)22-11-6-10(13)15(14-11)23(2,20)21/h3-6H,13H2,1-2H3
    MOLECULAR FORMULA
    C12H12N4O6S
    CROSS REFERENCES
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    canSAR1532098

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.05
    AlogP 0.71
    HBond donors 2
    HBond acceptors 10
    Atoms 35
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1532098.