UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

10510241
10510241

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Popular Name: 2-piperazineacetic acid, 3-oxo-1-[[[2-(2-phenylethoxy)benzoyl]amino]thioxomethyl]-, cyclohexyl ester 2-piperazineacetic acid, 3-oxo-1…

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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) 4.61 -1.22 -23.39 2 8 0 96 523.655 11 ↓

Analogs

10510234
10510234

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-[[[2-(2-phenylethoxy)benzoyl]amino]thioxomethyl]-, cyclohexyl ester 2-piperazineacetic acid, 3-oxo-1…

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) 4.61 -1.14 -23.32 2 8 0 96 523.655 11 ↓

Parameters Provided:

ring.id = 9840
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 = 9840 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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