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canSAR1125320
FEATURES
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NAMES
    SMILES
    CC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(-c2ccnc(=O)[nH]2)c1
    InChI
    InChI=1S/C20H20N2O5S/c1-13(2)26-16-10-14(19-8-9-21-20(23)22-19)11-17(12-16)27-15-4-6-18(7-5-15)28(3,24)25/h4-13H,1-3H3,(H,21,22,23)
    MOLECULAR FORMULA
    C20H20N2O5S
    CROSS REFERENCES
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    canSAR1125320

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.11
    AlogP 3.42
    HBond donors 1
    HBond acceptors 7
    Atoms 48
    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 canSAR1125320.