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

Analogs

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Popular Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonyl-methyl-amino)-N-[3-(trifluoromethyl)phenyl]acetamide 2-(2,1,3-benzothiadiazol-4-ylsul…

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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) 3.34 4.05 -15.85 1 7 0 92 430.433 6 ↓

Analogs

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Popular Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonyl-methyl-amino)-N-ethyl-N-[3-(trifluoromethyl)phenyl]acetamide 2-(2,1,3-benzothiadiazol-4-ylsul…

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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) 3.59 6.32 -16.74 0 7 0 83 458.487 7 ↓

Analogs

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Popular Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(3-fluorophenyl)acetamide 2-(2,1,3-benzothiadiazol-4-ylsul…

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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) 2.36 1.25 -18.18 2 7 0 101 366.399 5 ↓
Hi High (pH 8-9.5) 2.36 0.75 -50.49 1 7 -1 103 365.391 5 ↓

Analogs

15935280
15935280

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Popular Name: (2R)-N-(4-acetamidophenyl)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-butanamide (2R)-N-(4-acetamidophenyl)-2-(2,…

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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) 2.19 1.91 -19.94 3 9 0 130 447.542 7 ↓
Hi High (pH 8-9.5) 2.19 2.05 -57.45 2 9 -1 132 446.534 7 ↓

Analogs

15935279
15935279

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Popular Name: (2S)-N-(4-acetamidophenyl)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-butanamide (2S)-N-(4-acetamidophenyl)-2-(2,…

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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) 2.19 2.13 -29.28 3 9 0 130 447.542 7 ↓
Hi High (pH 8-9.5) 2.19 1.83 -56.76 2 9 -1 132 446.534 7 ↓

Parameters Provided:

ring.id = 36704
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 = 36704 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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