UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-[(3R)-3-(2-methylimidazol-1-yl)piperidine-1-carbonyl]chromen-4-one 2-[(3R)-3-(2-methylimidazol-1-yl…

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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) 1.65 9.54 -41.47 1 6 1 70 338.387 2 ↓
Mid Mid (pH 6-8) 1.65 9.06 -14.44 0 6 0 68 337.379 2 ↓

Analogs

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Popular Name: 2-[(3S)-3-(2-methylimidazol-1-yl)piperidine-1-carbonyl]chromen-4-one 2-[(3S)-3-(2-methylimidazol-1-yl…

Find On: PubMed — Wikipedia — Google

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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) 1.65 9.54 -39.39 1 6 1 70 338.387 2 ↓
Mid Mid (pH 6-8) 1.65 9.07 -16.18 0 6 0 68 337.379 2 ↓

Parameters Provided:

ring.id = 449246
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 = 449246 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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