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canSAR2277817
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NAMES
    SMILES
    Cc1nc(O)cc(C2CCN(Cc3ccc(C4CCCC4)s3)CC2)n1
    InChI
    InChI=1S/C20H27N3OS/c1-14-21-18(12-20(24)22-14)15-8-10-23(11-9-15)13-17-6-7-19(25-17)16-4-2-3-5-16/h6-7,12,15-16H,2-5,8-11,13H2,1H3,(H,21,22,24)
    MOLECULAR FORMULA
    C20H27N3OS
    CROSS REFERENCES
    2277817 logo

    canSAR2277817

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.19
    AlogP 4.59
    HBond donors 1
    HBond acceptors 4
    Atoms 52
    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 canSAR2277817.