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canSAR1127958
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NAMES
    SMILES
    Nc1sc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)c1C(=O)N1CCCCC1=O
    InChI
    InChI=1S/C22H18Cl2N2O2S/c23-15-8-4-13(5-9-15)18-19(22(28)26-12-2-1-3-17(26)27)21(25)29-20(18)14-6-10-16(24)11-7-14/h4-11H,1-3,12,25H2
    MOLECULAR FORMULA
    C22H18Cl2N2O2S
    CROSS REFERENCES
    1127958 logo

    canSAR1127958

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.05
    AlogP 6.12
    HBond donors 2
    HBond acceptors 4
    Atoms 47
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1127958.