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canSAR1836164
FEATURES
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NAMES
    SMILES
    COC(=O)c1ccc2c(c1C(=O)OC)CN(S(=O)(=O)C(C)(C)C)[C@@H]2CCO
    InChI
    InChI=1S/C18H25NO7S/c1-18(2,3)27(23,24)19-10-13-11(14(19)8-9-20)6-7-12(16(21)25-4)15(13)17(22)26-5/h6-7,14,20H,8-10H2,1-5H3/t14-/m1/s1
    MOLECULAR FORMULA
    C18H25NO7S
    CROSS REFERENCES
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    canSAR1836164

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.14
    AlogP 1.63
    HBond donors 1
    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 canSAR1836164.