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canSAR1447079
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NAMES
    SMILES
    CC(C)CC(=O)c1ccc2c(c1)C(C=Nc1ccc(S(N)(=O)=O)cc1)C(=O)N2
    InChI
    InChI=1S/C20H21N3O4S/c1-12(2)9-19(24)13-3-8-18-16(10-13)17(20(25)23-18)11-22-14-4-6-15(7-5-14)28(21,26)27/h3-8,10-12,17H,9H2,1-2H3,(H,23,25)(H2,21,26,27)
    MOLECULAR FORMULA
    C20H21N3O4S
    CROSS REFERENCES
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    canSAR1447079

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.13
    AlogP 3.00
    HBond donors 3
    HBond acceptors 7
    Atoms 49
    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 canSAR1447079.