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canSAR2000947
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NAMES
    SMILES
    CC(C)Nc1nc(-c2cccc(S(=O)(=O)NC3CC3)c2)cc2ncn(C)c(=O)c12
    InChI
    InChI=1S/C20H23N5O3S/c1-12(2)22-19-18-17(21-11-25(3)20(18)26)10-16(23-19)13-5-4-6-15(9-13)29(27,28)24-14-7-8-14/h4-6,9-12,14,24H,7-8H2,1-3H3,(H,22,23)
    MOLECULAR FORMULA
    C20H23N5O3S
    CROSS REFERENCES
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    canSAR2000947

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.15
    AlogP 2.26
    HBond donors 2
    HBond acceptors 8
    Atoms 52
    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 canSAR2000947.