UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (3R)-1-[(1-ethylimidazol-2-yl)methyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1-ethylimidazol-2-yl)me…

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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 7.44 -46.84 1 6 0 80 251.286 4 ↓
Mid Mid (pH 6-8) -0.38 6.48 -45.95 0 6 -1 78 250.278 4 ↓

Analogs

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Popular Name: (3S)-1-[(1-ethylimidazol-2-yl)methyl]-6-oxo-piperidine-3-carboxylic (3S)-1-[(1-ethylimidazol-2-yl)me…

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) -0.38 6.83 -43.9 1 6 0 80 251.286 4 ↓
Mid Mid (pH 6-8) -0.38 6.44 -44.68 0 6 -1 78 250.278 4 ↓

Parameters Provided:

ring.id = 151564
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 = 151564 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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