UCSF
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39294073
39294073

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Popular Name: (5R)-5-[2-[4-[4-(4-fluorophenyl)-4-oxo-butyl]piperazin-1-yl]ethyl]-5,6-dihydrocyclopenta[b]thiophen- (5R)-5-[2-[4-[4-(4-fluorophenyl)…

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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) 3.74 11.68 -45.59 1 4 1 42 415.554 8 ↓
Hi High (pH 8-9.5) 3.74 9.35 -14.1 0 4 0 41 414.546 8 ↓
Mid Mid (pH 6-8) 3.74 11.73 -50.21 1 4 1 42 415.554 8 ↓

Parameters Provided:

ring.id = 126501
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 = 126501 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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