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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: (6R)-6-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-7,7-dioxo-5,6-dihydrothieno[2,3-b]thiopyran-4-on (6R)-6-[3-[4-(4-fluorophenyl)pip…

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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) 3.09 8.72 -55.79 1 5 1 59 423.555 5 ↓
Mid Mid (pH 6-8) 3.09 6.5 -14.25 0 5 0 58 422.547 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6S)-6-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-7,7-dioxo-5,6-dihydrothieno[2,3-b]thiopyran-4-on (6S)-6-[3-[4-(4-fluorophenyl)pip…

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) 3.09 8.49 -57.78 1 5 1 59 423.555 5 ↓
Mid Mid (pH 6-8) 3.09 6.28 -14.33 0 5 0 58 422.547 5 ↓

Parameters Provided:

ring.id = 14483
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 = 14483 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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