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canSAR502968
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NAMES
    SMILES
    C=NC(=O)CCc1cccc2c(Nc3ccc(NS(C)(=O)=O)cc3OC)c3ccccc3nc12
    InChI
    InChI=1S/C25H24N4O4S/c1-26-23(30)14-11-16-7-6-9-19-24(16)27-20-10-5-4-8-18(20)25(19)28-21-13-12-17(15-22(21)33-2)29-34(3,31)32/h4-10,12-13,15,29H,1,11,14H2,2-3H3,(H,27,28)
    MOLECULAR FORMULA
    C25H24N4O4S
    CROSS REFERENCES
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    canSAR502968

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 476.15
    AlogP 4.67
    HBond donors 2
    HBond acceptors 8
    Atoms 58
    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 canSAR502968.