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canSAR2018960
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NAMES
    SMILES
    Cc1cc(/C=C2\SC(Nc3ccccc3)=NC2=O)c(C)n1-c1ccc(S(N)(=O)=O)cc1
    InChI
    InChI=1S/C22H20N4O3S2/c1-14-12-16(15(2)26(14)18-8-10-19(11-9-18)31(23,28)29)13-20-21(27)25-22(30-20)24-17-6-4-3-5-7-17/h3-13H,1-2H3,(H2,23,28,29)(H,24,25,27)/b20-13-
    MOLECULAR FORMULA
    C22H20N4O3S2
    CROSS REFERENCES
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    canSAR2018960

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.10
    AlogP 3.82
    HBond donors 3
    HBond acceptors 7
    Atoms 51
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2018960.