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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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4346334
4346334
4346516
4346516
4346524
4346524
4346525
4346525
4346526
4346526

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Popular Name: (2R)-4-[(4-fluorophenyl)methyl]-1-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-methyl-piperazin (2R)-4-[(4-fluorophenyl)methyl]-…

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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) 4.46 13.81 -47.59 1 3 1 13 396.505 6 ↓
Mid Mid (pH 6-8) 4.46 11.55 -7.08 0 3 0 11 395.497 6 ↓
Mid Mid (pH 6-8) 4.46 12.99 -40.87 1 3 1 13 396.505 6 ↓

Parameters Provided:

ring.id = 173271
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 = 173271 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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