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

Analogs

11842177
11842177
39308259
39308259
39308261
39308261

Draw Identity 99% 90% 80% 70%

Popular Name: 2,2-dimethyl-6-[(3R)-3-[3-(trifluoromethyl)benzoyl]piperidine-1-carbonyl]-3H-pyran-4-one 2,2-dimethyl-6-[(3R)-3-[3-(trifl…

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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) 3.37 9.74 -13.52 0 5 0 64 409.404 4 ↓

Analogs

39308259
39308259
39308261
39308261
11842175
11842175

Draw Identity 99% 90% 80% 70%

Popular Name: 2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)benzoyl]piperidine-1-carbonyl]-3H-pyran-4-one 2,2-dimethyl-6-[(3S)-3-[3-(trifl…

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) 3.37 9.72 -15.73 0 5 0 64 409.404 4 ↓

Parameters Provided:

ring.id = 59776
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 = 59776 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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