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canSAR1441736
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)c1cccc(NC(=O)CCCNS(=O)(=O)c2cccc(C(=N)N)c2)c1
    InChI
    InChI=1S/C22H28N4O5S/c1-22(2,3)31-21(28)16-8-4-9-17(13-16)26-19(27)11-6-12-25-32(29,30)18-10-5-7-15(14-18)20(23)24/h4-5,7-10,13-14,25H,6,11-12H2,1-3H3,(H3,23,24)(H,26,27)
    MOLECULAR FORMULA
    C22H28N4O5S
    CROSS REFERENCES
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    canSAR1441736

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 460.18
    AlogP 2.62
    HBond donors 5
    HBond acceptors 9
    Atoms 60
    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 canSAR1441736.