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canSAR1721681
FEATURES
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NAMES
    SMILES
    Cc1ccc(C)c(N2CC(C(=O)Nc3nccs3)CC2=O)c1
    InChI
    InChI=1S/C16H17N3O2S/c1-10-3-4-11(2)13(7-10)19-9-12(8-14(19)20)15(21)18-16-17-5-6-22-16/h3-7,12H,8-9H2,1-2H3,(H,17,18,21)
    MOLECULAR FORMULA
    C16H17N3O2S
    CROSS REFERENCES
    1721681 logo

    canSAR1721681

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 315.10
    AlogP 2.75
    HBond donors 1
    HBond acceptors 5
    Atoms 39
    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 canSAR1721681.