UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

38738703
38738703
44960576
44960576
44960577
44960577

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Popular Name: (4aR,7aS)-6-(5-phenylpentanoyl)-7a-propyl-1,4a,5,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,4-dione (4aR,7aS)-6-(5-phenylpentanoyl)-…

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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) 3.11 6.84 -11.78 2 6 0 79 357.454 7 ↓

Analogs

44960576
44960576
44960577
44960577
38738702
38738702

Draw Identity 99% 90% 80% 70%

Popular Name: (4aR,7aR)-6-(5-phenylpentanoyl)-7a-propyl-1,4a,5,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,4-dione (4aR,7aR)-6-(5-phenylpentanoyl)-…

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) 3.11 7.07 -13.39 2 6 0 79 357.454 7 ↓

Parameters Provided:

ring.id = 600730
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 = 600730 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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