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canSAR1766623
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NAMES
    SMILES
    CC(=O)Nc1ccc(SCC(=O)OCC(=O)NC(=O)NC2CCCC2)cc1
    InChI
    InChI=1S/C18H23N3O5S/c1-12(22)19-14-6-8-15(9-7-14)27-11-17(24)26-10-16(23)21-18(25)20-13-4-2-3-5-13/h6-9,13H,2-5,10-11H2,1H3,(H,19,22)(H2,20,21,23,25)
    MOLECULAR FORMULA
    C18H23N3O5S
    CROSS REFERENCES
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    canSAR1766623

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.14
    AlogP 2.05
    HBond donors 3
    HBond acceptors 8
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1766623.