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Analogs

4043793
4043793

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Popular Name: (3R,3aR,8aR,9aR)-3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-5,8a-dimethyl-3,3a,7,8,9,9a-hexahy (3R,3aR,8aR,9aR)-3-(1,4-dioxa-8-…

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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) 2.58 0.98 -35.44 1 5 1 49 374.501 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,3aR,8aS,9aR)-3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydro (3S,3aR,8aS,9aR)-3-(1,4-dioxa-8-…

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) 2.58 10.86 -43.98 1 5 1 49 374.501 2 ↓
Mid Mid (pH 6-8) 2.58 8.65 -10.92 0 5 0 48 373.493 2 ↓

Parameters Provided:

ring.id = 232010
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 = 232010 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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