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canSAR1489869
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NAMES
    SMILES
    COc1cc(-c2csc3ccccc23)cc2c1OCCN(Cc1ccc(Cl)cc1)C2
    InChI
    InChI=1S/C25H22ClNO2S/c1-28-23-13-18(22-16-30-24-5-3-2-4-21(22)24)12-19-15-27(10-11-29-25(19)23)14-17-6-8-20(26)9-7-17/h2-9,12-13,16H,10-11,14-15H2,1H3
    MOLECULAR FORMULA
    C25H22ClNO2S
    CROSS REFERENCES
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    canSAR1489869

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.11
    AlogP 6.62
    HBond donors 0
    HBond acceptors 3
    Atoms 52
    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 canSAR1489869.