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canSAR1830954
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NAMES
    SMILES
    COc1ccc(CN2C(=NC(=O)c3ccccc3)SC3CS(=O)(=O)CC32)cc1OC
    InChI
    InChI=1S/C21H22N2O5S2/c1-27-17-9-8-14(10-18(17)28-2)11-23-16-12-30(25,26)13-19(16)29-21(23)22-20(24)15-6-4-3-5-7-15/h3-10,16,19H,11-13H2,1-2H3
    MOLECULAR FORMULA
    C21H22N2O5S2
    CROSS REFERENCES
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    canSAR1830954

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.10
    AlogP 2.61
    HBond donors 0
    HBond acceptors 7
    Atoms 52
    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 canSAR1830954.