UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: octahydropyrrolo[3,4-c]pyrrole-1,3-dione octahydropyrrolo[3,4-c]pyrrole-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) -0.83 -3.3 -51.31 2 4 0 69 140.142 0 ↓
Hi High (pH 8-9.5) -0.83 -4.74 -37.08 1 4 -1 65 139.134 0 ↓
Hi High (pH 8-9.5) -0.83 -4.77 -38.67 1 4 -1 65 139.134 0 ↓

Analogs

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Popular Name: (3aS,6aR)-2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,6- (3aS,6aR)-2-[(6-ethoxy-2-oxo-1H-…

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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) 0.38 -0.71 -51.26 1 7 -1 98 340.359 4 ↓
Mid Mid (pH 6-8) 0.19 1.05 -14.49 2 7 0 92 341.367 4 ↓
Mid Mid (pH 6-8) 0.38 1.82 -54.24 2 7 0 99 341.367 4 ↓

Parameters Provided:

ring.id = 373584
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 = 373584 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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