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

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-(5,6-dimethylbenzimidazol-1-yl)thiophene-2-sulfonamide 5-(5,6-dimethylbenzimidazol-1-yl…

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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) 2.76 4.58 -14.45 2 5 0 78 307.4 2 ↓
Hi High (pH 8-9.5) 2.76 5.06 -42.45 1 5 -1 75 306.392 2 ↓
Lo Low (pH 4.5-6) 2.76 5.06 -42.87 3 5 1 79 308.408 2 ↓

Analogs

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Popular Name: 1-(5-ethylsulfonyl-2-thienyl)benzimidazole 1-(5-ethylsulfonyl-2-thienyl)ben…

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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) 2.95 6.81 -14.81 0 4 0 52 292.385 3 ↓
Lo Low (pH 4.5-6) 2.95 7.29 -42.67 1 4 1 53 293.393 3 ↓

Parameters Provided:

ring.id = 398164
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 = 398164 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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