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canSAR2051275
FEATURES
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NAMES
    SMILES
    Cc1nc(NC(=O)C(C)(C)C)sc1-c1ccc(Cl)c(S(=O)(=O)NCCO)c1
    InChI
    InChI=1S/C17H22ClN3O4S2/c1-10-14(26-16(20-10)21-15(23)17(2,3)4)11-5-6-12(18)13(9-11)27(24,25)19-7-8-22/h5-6,9,19,22H,7-8H2,1-4H3,(H,20,21,23)
    MOLECULAR FORMULA
    C17H22ClN3O4S2
    CROSS REFERENCES
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    canSAR2051275

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.07
    AlogP 3.03
    HBond donors 3
    HBond acceptors 7
    Atoms 49
    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 canSAR2051275.