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canSAR65992
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NAMES
    SMILES
    C#CCSc1cnc2ccccc2c1SCC#CC[Se]c1c(SCC#CC)cnc2ccccc12
    InChI
    InChI=1S/C29H22N2S3Se/c1-3-5-17-33-27-21-31-25-15-9-7-13-23(25)29(27)35-19-11-10-18-34-28-22-12-6-8-14-24(22)30-20-26(28)32-16-4-2/h2,6-9,12-15,20-21H,16-19H2,1H3
    MOLECULAR FORMULA
    C29H22N2S3Se
    CROSS REFERENCES
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    canSAR65992

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.01
    AlogP 6.17
    HBond donors 0
    HBond acceptors 2
    Atoms 57
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR65992.