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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (5R)-5-(4-chlorophenyl)-3-hydroxy-1-[3-(3H-imidazol-4-yl)propyl]-4-(4-methylbenzoyl)-5H-pyrrol-2-one (5R)-5-(4-chlorophenyl)-3-hydrox…

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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) 3.81 11.86 -73.84 2 6 0 90 435.911 7 ↓
Mid Mid (pH 6-8) 4.25 10.34 -35.75 2 6 0 86 435.911 6 ↓
Mid Mid (pH 6-8) 3.22 11.32 -29.71 1 6 0 83 435.911 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-5-(4-chlorophenyl)-3-hydroxy-1-[3-(3H-imidazol-4-yl)propyl]-4-(4-methylbenzoyl)-5H-pyrrol-2-one (5S)-5-(4-chlorophenyl)-3-hydrox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.81 12.25 -78.42 2 6 0 90 435.911 7 ↓
Mid Mid (pH 6-8) 4.25 10.83 -29.41 2 6 0 86 435.911 6 ↓
Mid Mid (pH 6-8) 3.22 11.81 -22.89 1 6 0 83 435.911 7 ↓

Parameters Provided:

ring.id = 223780
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 = 223780 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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