UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(benzylcarbamoyl)-2-[(2R)-2-(1,3-dioxolan-2-yl)-1-piperidyl]acetamide N-(benzylcarbamoyl)-2-[(2R)-2-(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) 1.70 4.62 -18.27 2 7 0 80 347.415 5 ↓
Mid Mid (pH 6-8) 1.70 6.58 -43.79 3 7 1 81 348.423 5 ↓

Analogs

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Popular Name: N-(benzylcarbamoyl)-2-[(2S)-2-(1,3-dioxolan-2-yl)-1-piperidyl]acetamide N-(benzylcarbamoyl)-2-[(2S)-2-(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) 1.70 4.6 -18.24 2 7 0 80 347.415 5 ↓
Mid Mid (pH 6-8) 1.70 6.51 -43.83 3 7 1 81 348.423 5 ↓

Parameters Provided:

ring.id = 341702
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 = 341702 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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