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canSAR649903
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NAMES
    SMILES
    CCCCSC(C(OCC)c1ccc(Cl)cc1)n1ccnc1
    InChI
    InChI=1S/C17H23ClN2OS/c1-3-5-12-22-17(20-11-10-19-13-20)16(21-4-2)14-6-8-15(18)9-7-14/h6-11,13,16-17H,3-5,12H2,1-2H3
    MOLECULAR FORMULA
    C17H23ClN2OS
    CROSS REFERENCES
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    canSAR649903

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.12
    AlogP 5.35
    HBond donors 0
    HBond acceptors 3
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR649903.