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canSAR1727601
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NAMES
    SMILES
    O=C(NCc1ccc(Cl)cc1)C(=O)NCC1OCCCN1S(=O)(=O)c1cccs1
    InChI
    InChI=1S/C18H20ClN3O5S2/c19-14-6-4-13(5-7-14)11-20-17(23)18(24)21-12-15-22(8-2-9-27-15)29(25,26)16-3-1-10-28-16/h1,3-7,10,15H,2,8-9,11-12H2,(H,20,23)(H,21,24)
    MOLECULAR FORMULA
    C18H20ClN3O5S2
    CROSS REFERENCES
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    canSAR1727601

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.05
    AlogP 1.57
    HBond donors 2
    HBond acceptors 8
    Atoms 49
    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 canSAR1727601.