UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

2791947
2791947
20427608
20427608
2791215
2791215
2791233
2791233
2770930
2770930

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Popular Name: 2-[[5-(4-bromo-2-thienyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-[(1-methylpyrazol-4-yl)methyl]acetamid 2-[[5-(4-bromo-2-thienyl)-4-meth…

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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) 1.90 7.16 -15.34 1 7 0 78 427.353 6 ↓

Analogs

2791215
2791215
2791233
2791233
2791588
2791588

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Popular Name: 2-[[5-(4-bromo-2-thienyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-[(1-methylpyrazol-4-yl)methyl]acetamide 2-[[5-(4-bromo-2-thienyl)-4-ethy…

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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) 2.27 8.06 -15.43 1 7 0 78 441.38 7 ↓

Analogs

2791409
2791409

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Popular Name: 2-[[5-(4-bromo-5-ethyl-2-thienyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-[(1-methylpyrazol-4-yl)methyl]a 2-[[5-(4-bromo-5-ethyl-2-thienyl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.07 9.55 -15.68 1 7 0 78 469.434 8 ↓

Parameters Provided:

ring.id = 56921
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 = 56921 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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