canSAR290516
FEATURES
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NAMES
    SMILES
    CC(C)(C)C(=O)OCC(C/N=C(\S)NCc1ccc(NS(C)(=O)=O)cc1)Cc1ccc(C(C)(C)C)cc1
    InChI
    InChI=1S/C28H41N3O4S2/c1-27(2,3)23-12-8-20(9-13-23)16-22(19-35-25(32)28(4,5)6)18-30-26(36)29-17-21-10-14-24(15-11-21)31-37(7,33)34/h8-15,22,31H,16-19H2,1-7H3,(H2,29,30,36)
    MOLECULAR FORMULA
    C28H41N3O4S2
    CROSS REFERENCES
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    canSAR290516
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight547.25
    AlogP5.18
    HBond donors2
    HBond acceptors7
    Atoms78
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR290516.