UCSF
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Analogs

19885162
19885162
11665072
11665072

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Popular Name: (3aS,6aR)-3-[2-(4-methoxyphenyl)ethyl]-5-(3-pyridylmethyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazol- (3aS,6aR)-3-[2-(4-methoxyphenyl)…

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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) 1.94 6.63 -17.33 0 6 0 55 353.422 6 ↓
Lo Low (pH 4.5-6) 1.94 7.09 -49.39 1 6 1 56 354.43 6 ↓

Parameters Provided:

ring.id = 88573
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 = 88573 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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