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canSAR1588335
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NAMES
    SMILES
    CC(NC(=O)c1ccncc1)C(c1cccs1)N1CCOCC1
    InChI
    InChI=1S/C17H21N3O2S/c1-13(19-17(21)14-4-6-18-7-5-14)16(15-3-2-12-23-15)20-8-10-22-11-9-20/h2-7,12-13,16H,8-11H2,1H3,(H,19,21)
    MOLECULAR FORMULA
    C17H21N3O2S
    CROSS REFERENCES
    1588335 logo

    canSAR1588335

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.14
    AlogP 2.33
    HBond donors 1
    HBond acceptors 5
    Atoms 44
    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 canSAR1588335.