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canSAR220902
FEATURES
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NAMES
    SMILES
    Nc1nc2c(ncn2-c2ccc(S(=O)(=O)N3CCCCC3)cc2)c(=O)[nH]1
    InChI
    InChI=1S/C16H18N6O3S/c17-16-19-14-13(15(23)20-16)18-10-22(14)11-4-6-12(7-5-11)26(24,25)21-8-2-1-3-9-21/h4-7,10H,1-3,8-9H2,(H3,17,19,20,23)
    MOLECULAR FORMULA
    C16H18N6O3S
    CROSS REFERENCES
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    canSAR220902

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.12
    AlogP 0.87
    HBond donors 3
    HBond acceptors 9
    Atoms 44
    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 canSAR220902.