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canSAR65635
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NAMES
    SMILES
    COc1ccccc1N1CCN(CCCCSc2nc3ccccc3s2)CC1
    InChI
    InChI=1S/C22H27N3OS2/c1-26-20-10-4-3-9-19(20)25-15-13-24(14-16-25)12-6-7-17-27-22-23-18-8-2-5-11-21(18)28-22/h2-5,8-11H,6-7,12-17H2,1H3
    MOLECULAR FORMULA
    C22H27N3OS2
    CROSS REFERENCES
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    canSAR65635

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.16
    AlogP 5.00
    HBond donors 0
    HBond acceptors 4
    Atoms 55
    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 canSAR65635.