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canSAR1687412
FEATURES
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NAMES
    SMILES
    CN1C(=O)C(=NNc2ccc(S(=O)(=O)N3CCOCC3)cc2)C(=O)N(C)C1=O
    InChI
    InChI=1S/C16H19N5O6S/c1-19-14(22)13(15(23)20(2)16(19)24)18-17-11-3-5-12(6-4-11)28(25,26)21-7-9-27-10-8-21/h3-6,17H,7-10H2,1-2H3
    MOLECULAR FORMULA
    C16H19N5O6S
    CROSS REFERENCES
    1687412 logo

    canSAR1687412

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.11
    AlogP -0.47
    HBond donors 1
    HBond acceptors 11
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1687412.