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canSAR1106569
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NAMES
    SMILES
    COc1ccccc1-c1nc2ccc(-c3ccsc3)nn2c1-c1cccc(-c2ccccc2)c1
    InChI
    InChI=1S/C29H21N3OS/c1-33-26-13-6-5-12-24(26)28-29(22-11-7-10-21(18-22)20-8-3-2-4-9-20)32-27(30-28)15-14-25(31-32)23-16-17-34-19-23/h2-19H,1H3
    MOLECULAR FORMULA
    C29H21N3OS
    CROSS REFERENCES
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    canSAR1106569

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.14
    AlogP 7.47
    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 canSAR1106569.