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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-[(2R,5R)-2,5-dimethylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(2R,5R)-2,5-dimethylmorpholin…

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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) -0.21 0.94 -10.41 2 6 0 78 225.248 1 ↓

Analogs

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Popular Name: 4-[(2S,5R)-2,5-dimethylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(2S,5R)-2,5-dimethylmorpholin…

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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) -0.21 -0.05 -14.44 2 6 0 78 225.248 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2R,5S)-2,5-dimethylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(2R,5S)-2,5-dimethylmorpholin…

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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) -0.21 -0.03 -14.18 2 6 0 78 225.248 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2S,5S)-2,5-dimethylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(2S,5S)-2,5-dimethylmorpholin…

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) -0.21 0.33 -12.14 2 6 0 78 225.248 1 ↓

Analogs

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Popular Name: 4-[(3R)-3-methylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(3R)-3-methylmorpholine-4-car…

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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) -0.58 -0.76 -14.53 2 6 0 78 211.221 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(3S)-3-methylmorpholine-4-carbonyl]-1,3-dihydroimidazol-2-one 4-[(3S)-3-methylmorpholine-4-car…

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) -0.58 -0.77 -14.68 2 6 0 78 211.221 1 ↓

Parameters Provided:

ring.id = 333684
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 = 333684 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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