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canSAR1403307
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NAMES
    SMILES
    CC(C)(C)c1ccc(C2(C)NC(=O)N(CC(=O)NCc3cccs3)C2=O)cc1
    InChI
    InChI=1S/C21H25N3O3S/c1-20(2,3)14-7-9-15(10-8-14)21(4)18(26)24(19(27)23-21)13-17(25)22-12-16-6-5-11-28-16/h5-11H,12-13H2,1-4H3,(H,22,25)(H,23,27)
    MOLECULAR FORMULA
    C21H25N3O3S
    CROSS REFERENCES
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    canSAR1403307

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.16
    AlogP 3.13
    HBond donors 2
    HBond acceptors 6
    Atoms 53
    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 canSAR1403307.