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canSAR1266534
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NAMES
    SMILES
    Cc1cccc(C(=O)N2CCc3c(sc(NCc4ccccc4)c3C#N)C2)c1
    InChI
    InChI=1S/C23H21N3OS/c1-16-6-5-9-18(12-16)23(27)26-11-10-19-20(13-24)22(28-21(19)15-26)25-14-17-7-3-2-4-8-17/h2-9,12,25H,10-11,14-15H2,1H3
    MOLECULAR FORMULA
    C23H21N3OS
    CROSS REFERENCES
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    canSAR1266534

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 387.14
    AlogP 4.74
    HBond donors 1
    HBond acceptors 4
    Atoms 49
    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 canSAR1266534.