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canSAR1115838
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NAMES
    SMILES
    COc1cc(Nc2ncnc(Nc3cccc(NS(C)(=O)=O)c3)n2)cc(OC)c1OC
    InChI
    InChI=1S/C19H22N6O5S/c1-28-15-9-14(10-16(29-2)17(15)30-3)23-19-21-11-20-18(24-19)22-12-6-5-7-13(8-12)25-31(4,26)27/h5-11,25H,1-4H3,(H2,20,21,22,23,24)
    MOLECULAR FORMULA
    C19H22N6O5S
    CROSS REFERENCES
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    canSAR1115838

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.14
    AlogP 2.76
    HBond donors 3
    HBond acceptors 11
    Atoms 53
    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 canSAR1115838.