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canSAR2083687
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NAMES
    SMILES
    CC(C)OC(=O)c1c(/N=C2\SC(CC(=O)O)C(=O)N2c2ccccc2)sc2c1CCCC2
    InChI
    InChI=1S/C23H24N2O5S2/c1-13(2)30-22(29)19-15-10-6-7-11-16(15)31-20(19)24-23-25(14-8-4-3-5-9-14)21(28)17(32-23)12-18(26)27/h3-5,8-9,13,17H,6-7,10-12H2,1-2H3,(H,26,27)/b24-23-
    MOLECULAR FORMULA
    C23H24N2O5S2
    CROSS REFERENCES
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    canSAR2083687

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 472.11
    AlogP 4.80
    HBond donors 1
    HBond acceptors 7
    Atoms 56
    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 canSAR2083687.