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canSAR1490855
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NAMES
    SMILES
    COc1ccc2c(c1)c(C=C1SC(S)=NC1=O)c(C)n2C(=O)c1ccc(Cl)cc1
    InChI
    InChI=1S/C21H15ClN2O3S2/c1-11-15(10-18-19(25)23-21(28)29-18)16-9-14(27-2)7-8-17(16)24(11)20(26)12-3-5-13(22)6-4-12/h3-10H,1-2H3,(H,23,25,28)
    MOLECULAR FORMULA
    C21H15ClN2O3S2
    CROSS REFERENCES
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    canSAR1490855

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.02
    AlogP 5.20
    HBond donors 0
    HBond acceptors 5
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1490855.