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canSAR1119413
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NAMES
    SMILES
    CCCCN(CCc1ccccc1)C(=O)Nc1cc(-c2ccc(Cl)c(Cl)c2)sc1C(=O)O
    InChI
    InChI=1S/C24H24Cl2N2O3S/c1-2-3-12-28(13-11-16-7-5-4-6-8-16)24(31)27-20-15-21(32-22(20)23(29)30)17-9-10-18(25)19(26)14-17/h4-10,14-15H,2-3,11-13H2,1H3,(H,27,31)(H,29,30)
    MOLECULAR FORMULA
    C24H24Cl2N2O3S
    CROSS REFERENCES
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    canSAR1119413

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 490.09
    AlogP 7.30
    HBond donors 2
    HBond acceptors 5
    Atoms 56
    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 canSAR1119413.