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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (3R)-3-[(3R)-3-(morpholinomethyl)-1-piperidyl]tetrahydrofuran-2-one (3R)-3-[(3R)-3-(morpholinomethyl…

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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) -0.18 4.99 -42.1 1 5 1 43 269.365 3 ↓
Mid Mid (pH 6-8) -0.18 7.03 -100.83 2 5 2 44 270.373 3 ↓
Mid Mid (pH 6-8) -0.18 2.8 -9.13 0 5 0 42 268.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[(3S)-3-(morpholinomethyl)-1-piperidyl]tetrahydrofuran-2-one (3R)-3-[(3S)-3-(morpholinomethyl…

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) -0.18 4.98 -42.26 1 5 1 43 269.365 3 ↓
Mid Mid (pH 6-8) -0.18 2.66 -8.99 0 5 0 42 268.357 3 ↓
Mid Mid (pH 6-8) -0.18 7.02 -110.68 2 5 2 44 270.373 3 ↓

Parameters Provided:

ring.id = 463598
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 = 463598 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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