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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: (5S)-5-benzyl-2-(benzyl-(2-dimethylaminoethyl)amino)-3-(o-tolyl)-5H-imidazol-4-one (5S)-5-benzyl-2-(benzyl-(2-dimet…

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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) 4.78 18.14 -100.84 2 5 2 42 442.607 9 ↓
Hi High (pH 8-9.5) 4.78 15.81 -30.96 1 5 1 41 441.599 9 ↓
Hi High (pH 8-9.5) 4.78 14.58 -7.92 0 5 0 39 440.591 9 ↓

Analogs

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Popular Name: (5R)-5-benzyl-2-(benzyl-(2-dimethylaminoethyl)amino)-3-(o-tolyl)-5H-imidazol-4-one (5R)-5-benzyl-2-(benzyl-(2-dimet…

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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) 4.78 18.15 -107.22 2 5 2 42 442.607 9 ↓
Hi High (pH 8-9.5) 4.78 15.8 -31.22 1 5 1 41 441.599 9 ↓
Hi High (pH 8-9.5) 4.78 14.73 -8 0 5 0 39 440.591 9 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 5.38 18.35 -9.98 0 6 0 62 483.612 11 ↓
Mid Mid (pH 6-8) 2.91 20.08 -20.05 1 6 0 72 483.612 11 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 5.38 18.28 -9.92 0 6 0 62 483.612 11 ↓

Parameters Provided:

ring.id = 90841
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 = 90841 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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