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Popular Name: 1-(1-benzyl-4-piperidyl)-3-phenethyl-1-[[3-[4-[(phenethylamino)methyl]phenyl]phenyl]methyl]urea 1-(1-benzyl-4-piperidyl)-3-phene…

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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) 8.53 22.61 -44.75 3 5 1 49 637.892 14 ↓
Hi High (pH 8-9.5) 8.53 20.36 -13.92 2 5 0 48 636.884 14 ↓
Mid Mid (pH 6-8) 8.53 23.96 -108.51 4 5 2 53 638.9 14 ↓

Parameters Provided:

ring.id = 9150
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 = 9150 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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