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canSAR1617458
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NAMES
    SMILES
    Cc1ccc(SC(c2ccccc2)C(Cn2cncn2)C(=O)c2ccccc2)cc1
    InChI
    InChI=1S/C25H23N3OS/c1-19-12-14-22(15-13-19)30-25(21-10-6-3-7-11-21)23(16-28-18-26-17-27-28)24(29)20-8-4-2-5-9-20/h2-15,17-18,23,25H,16H2,1H3
    MOLECULAR FORMULA
    C25H23N3OS
    CROSS REFERENCES
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    canSAR1617458

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.16
    AlogP 5.62
    HBond donors 0
    HBond acceptors 4
    Atoms 53
    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 canSAR1617458.