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

Analogs

60219225
60219225

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Popular Name: 5-methyl-3-[4-[(E)-2-[(2S)-quinuclidin-2-yl]vinyl]phenyl]-1,2,4-oxadiazole 5-methyl-3-[4-[(E)-2-[(2S)-quinu…

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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) 3.86 8.83 -42.59 1 4 1 43 296.394 3 ↓

Analogs

60219222
60219222

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Popular Name: 5-methyl-3-[4-[(E)-2-[(2R)-quinuclidin-2-yl]vinyl]phenyl]-1,2,4-oxadiazole 5-methyl-3-[4-[(E)-2-[(2R)-quinu…

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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) 3.86 8.84 -42.57 1 4 1 43 296.394 3 ↓

Analogs

60219265
60219265
60219269
60219269
60219273
60219273

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Popular Name: (2R,3R)-2-[(E)-2-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2R,3R)-2-[(E)-2-[4-(5-ethyl-1,2…

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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) 3.33 6.53 -44.96 2 5 1 64 326.42 4 ↓

Analogs

60219269
60219269
60219273
60219273
60219260
60219260

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R)-2-[(E)-2-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2S,3R)-2-[(E)-2-[4-(5-ethyl-1,2…

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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) 3.33 6.31 -44.64 2 5 1 64 326.42 4 ↓

Analogs

60219273
60219273
60219260
60219260
60219265
60219265

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3S)-2-[(E)-2-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2R,3S)-2-[(E)-2-[4-(5-ethyl-1,2…

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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) 3.33 6.28 -44.66 2 5 1 64 326.42 4 ↓

Analogs

60219260
60219260
60219265
60219265
60219269
60219269

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S)-2-[(E)-2-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2S,3S)-2-[(E)-2-[4-(5-ethyl-1,2…

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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) 3.33 6.56 -44.94 2 5 1 64 326.42 4 ↓

Analogs

60219425
60219425
60219428
60219428
60219431
60219431

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R)-2-[(E)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2R,3R)-2-[(E)-2-[4-(5-methyl-1,…

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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) 2.76 5.79 -45.53 2 5 1 64 312.393 3 ↓

Analogs

60219428
60219428
60219431
60219431
60219422
60219422

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R)-2-[(E)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2S,3R)-2-[(E)-2-[4-(5-methyl-1,…

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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) 2.76 5.57 -45.2 2 5 1 64 312.393 3 ↓

Analogs

60219431
60219431
60219422
60219422
60219425
60219425

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3S)-2-[(E)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2R,3S)-2-[(E)-2-[4-(5-methyl-1,…

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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) 2.76 5.54 -45.25 2 5 1 64 312.393 3 ↓

Analogs

60219422
60219422
60219425
60219425

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S)-2-[(E)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]vinyl]quinuclidin-3-ol (2S,3S)-2-[(E)-2-[4-(5-methyl-1,…

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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) 2.76 5.82 -45.54 2 5 1 64 312.393 3 ↓

Parameters Provided:

ring.id = 198228
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 = 198228 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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