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canSAR1145533
FEATURES
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NAMES
    SMILES
    COc1c(C(=O)Nc2ccc(OS(C)(=O)=O)cc2)cc(N2CCC(=O)NC2=O)cc1C(C)(C)C
    InChI
    InChI=1S/C23H27N3O7S/c1-23(2,3)18-13-15(26-11-10-19(27)25-22(26)29)12-17(20(18)32-4)21(28)24-14-6-8-16(9-7-14)33-34(5,30)31/h6-9,12-13H,10-11H2,1-5H3,(H,24,28)(H,25,27,29)
    MOLECULAR FORMULA
    C23H27N3O7S
    CROSS REFERENCES
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    canSAR1145533

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 489.16
    AlogP 3.03
    HBond donors 2
    HBond acceptors 10
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1145533.