canSAR1746581
FEATURES
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NAMES
    SMILES
    O=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1Oc1ccccc1)C1=COCCO1
    InChI
    InChI=1S/C22H24N2O6S/c25-22(21-16-28-13-14-29-21)23-19-15-18(31(26,27)24-11-5-2-6-12-24)9-10-20(19)30-17-7-3-1-4-8-17/h1,3-4,7-10,15-16H,2,5-6,11-14H2,(H,23,25)
    MOLECULAR FORMULA
    C22H24N2O6S
    CROSS REFERENCES
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    canSAR1746581
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight444.14
    AlogP3.48
    HBond donors1
    HBond acceptors8
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746581.