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canSAR1829142
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NAMES
    SMILES
    COc1ccc(C(=O)N2N=C(c3cccc(NS(C)(=O)=O)c3)CC2c2cccs2)cc1
    InChI
    InChI=1S/C22H21N3O4S2/c1-29-18-10-8-15(9-11-18)22(26)25-20(21-7-4-12-30-21)14-19(23-25)16-5-3-6-17(13-16)24-31(2,27)28/h3-13,20,24H,14H2,1-2H3
    MOLECULAR FORMULA
    C22H21N3O4S2
    CROSS REFERENCES
    1829142 logo

    canSAR1829142

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.10
    AlogP 4.12
    HBond donors 1
    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 canSAR1829142.