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

Analogs

42095335
42095335

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Popular Name: 1-benzyl-3-[[(3R)-3-ethyl-1-piperidyl]methyl]imidazolidine-2,4,5-trione 1-benzyl-3-[[(3R)-3-ethyl-1-pipe…

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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) 1.84 7.62 -5.94 0 6 0 64 329.4 5 ↓
Mid Mid (pH 6-8) 1.84 9.97 -38.87 1 6 1 66 330.408 5 ↓

Analogs

42095333
42095333

Draw Identity 99% 90% 80% 70%

Popular Name: 1-benzyl-3-[[(3S)-3-ethyl-1-piperidyl]methyl]imidazolidine-2,4,5-trione 1-benzyl-3-[[(3S)-3-ethyl-1-pipe…

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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) 1.84 7.51 -5.93 0 6 0 64 329.4 5 ↓
Mid Mid (pH 6-8) 1.84 9.73 -38.98 1 6 1 66 330.408 5 ↓

Analogs

42095454
42095454

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Popular Name: 1-[[(3R)-3-ethyl-1-piperidyl]methyl]-3-[(1S)-1-phenylethyl]imidazolidine-2,4,5-trione 1-[[(3R)-3-ethyl-1-piperidyl]met…

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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) 2.20 8.08 -6.7 0 6 0 64 343.427 5 ↓
Mid Mid (pH 6-8) 2.20 10.44 -39.02 1 6 1 66 344.435 5 ↓

Analogs

42095453
42095453

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[[(3S)-3-ethyl-1-piperidyl]methyl]-3-[(1S)-1-phenylethyl]imidazolidine-2,4,5-trione 1-[[(3S)-3-ethyl-1-piperidyl]met…

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) 2.20 7.97 -6.67 0 6 0 64 343.427 5 ↓
Mid Mid (pH 6-8) 2.20 10.19 -39.06 1 6 1 66 344.435 5 ↓

Parameters Provided:

ring.id = 123236
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 = 123236 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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