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    • Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
    UCSF
    ZINC Item Suppliers, Protomers, & Similar Substances

    Analogs

    37022151
    37022151

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[2-(3,5-difluorophenyl)sulfonylaminoethyl]-3,5-difluoro-benzenesulfonamide N-[2-(3,5-difluorophenyl)sulfony…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.21 -7.09 -15.55 2 6 0 92 412.386 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-chloro-N-[2-[(3-chlorophenyl)sulfonylamino]ethyl]benzenesulfonamide 3-chloro-N-[2-[(3-chlorophenyl)s…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 3.01 1.91 -17.17 2 6 0 92 409.316 7 ↓

    Analogs

    35207849
    35207849
    37022052
    37022052

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-fluoro-N-[2-[(2-fluorophenyl)sulfonylamino]ethyl]benzenesulfonamide 2-fluoro-N-[2-[(2-fluorophenyl)s…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 1.93 0.38 -18.34 2 6 0 92 376.406 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[2-[(3,4-difluorophenyl)sulfonylamino]ethyl]-3,4-difluoro-benzenesulfonamide N-[2-[(3,4-difluorophenyl)sulfon…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.21 1.1 -19.47 2 6 0 92 412.386 7 ↓

    Analogs

    5853294
    5853294

    Draw Identity 99% 90% 80% 70%


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    Popular Name:

    Find On: PubMed — Wikipedia — Google

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 4.27 -10.61 -14.62 2 6 0 92 478.206 7 ↓

    Analogs

    42420354
    42420354

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-[2-[(4-carboxylatophenyl)sulfonylamino]ethylsulfamoyl]benzoate 4-[2-[(4-carboxylatophenyl)sulfo…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 1.52 -10.87 -107.37 2 10 -2 172 426.428 9 ↓

    Parameters Provided:

    ring.id = 10060
filter.purchasability = annotated
page.format = targets
page.num = 1

    Structural Results Found: (before additional filtering)

    SQL Query Was

    SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 10060 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

    Permalink

    //zinc12.docking.org/results/combination?ring.id=10060&filter.purchasability=annotated

    Embed Link to Results

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