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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: (2R)-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2R)-1-(quinoxaline-6-carbonyl)p…

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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) -1.14 4.86 -62.84 0 6 -1 86 270.268 2 ↓

Analogs

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Popular Name: (2S)-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2S)-1-(quinoxaline-6-carbonyl)p…

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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) -1.14 5.18 -64.82 0 6 -1 86 270.268 2 ↓

Analogs

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Popular Name: (2R,4R)-4-hydroxy-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2R,4R)-4-hydroxy-1-(quinoxaline…

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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) -2.06 1.44 -62.4 1 7 -1 106 286.267 2 ↓

Analogs

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Popular Name: (2R,4S)-4-hydroxy-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2R,4S)-4-hydroxy-1-(quinoxaline…

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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) -2.06 1.44 -63.88 1 7 -1 106 286.267 2 ↓

Analogs

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Popular Name: (2S,4R)-4-hydroxy-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2S,4R)-4-hydroxy-1-(quinoxaline…

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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) -2.06 2.1 -66.62 1 7 -1 106 286.267 2 ↓

Analogs

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Popular Name: (2S,4S)-4-hydroxy-1-(quinoxaline-6-carbonyl)pyrrolidine-2-carboxylic (2S,4S)-4-hydroxy-1-(quinoxaline…

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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) -2.06 2.09 -64.65 1 7 -1 106 286.267 2 ↓

Analogs

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Popular Name: 2-[(2R)-1-(quinoxaline-6-carbonyl)pyrrolidin-2-yl]acetic 2-[(2R)-1-(quinoxaline-6-carbony…

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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 6.53 -73.66 0 6 -1 86 284.295 3 ↓

Analogs

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Popular Name: 2-[(2S)-1-(quinoxaline-6-carbonyl)pyrrolidin-2-yl]acetic 2-[(2S)-1-(quinoxaline-6-carbony…

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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 6.63 -74.5 0 6 -1 86 284.295 3 ↓

Analogs

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Popular Name: [(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(2R)-2-(hydroxymethyl)pyrrolidi…

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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) 0.44 1.52 -11.77 1 5 0 66 257.293 2 ↓

Analogs

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Popular Name: [(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(2S)-2-(hydroxymethyl)pyrrolidi…

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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) 0.44 1.53 -13.44 1 5 0 66 257.293 2 ↓

Analogs

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Popular Name: [(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(3S)-3-(hydroxymethyl)pyrrolidi…

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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) 0.55 1.17 -14.62 1 5 0 66 257.293 2 ↓

Analogs

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Popular Name: [(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(3R)-3-(hydroxymethyl)pyrrolidi…

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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) 0.55 1.18 -14.54 1 5 0 66 257.293 2 ↓

Analogs

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Popular Name: [(2R)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(2R)-2-(3-hydroxypropyl)pyrroli…

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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) 0.98 2.63 -17.05 1 5 0 66 285.347 4 ↓

Analogs

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Popular Name: [(2S)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(2S)-2-(3-hydroxypropyl)pyrroli…

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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) 0.98 2.58 -16.63 1 5 0 66 285.347 4 ↓

Analogs

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Popular Name: [(3R)-3-(aminomethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(3R)-3-(aminomethyl)pyrrolidin-…

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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) -0.02 1.85 -55.33 3 5 1 74 257.317 2 ↓

Analogs

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Popular Name: [(3S)-3-(aminomethyl)pyrrolidin-1-yl]-quinoxalin-6-yl-methanone [(3S)-3-(aminomethyl)pyrrolidin-…

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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) -0.02 1.86 -55.39 3 5 1 74 257.317 2 ↓

Analogs

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Popular Name: (3S)-3-methyl-1-(quinoxaline-6-carbonyl)pyrrolidine-3-carboxylic (3S)-3-methyl-1-(quinoxaline-6-c…

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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) 0.67 4.95 -53.6 0 6 -1 86 284.295 2 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-(quinoxaline-6-carbonyl)pyrrolidine-3-carboxylic (3R)-3-methyl-1-(quinoxaline-6-c…

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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) 0.67 5.07 -53.2 0 6 -1 86 284.295 2 ↓

Analogs

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Popular Name: (2S,4R)-4-amino-1-(2,3-dimethylquinoxaline-6-carbonyl)-N-ethyl-pyrrolidine-2-carboxamide (2S,4R)-4-amino-1-(2,3-dimethylq…

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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) -0.42 1.55 -77.64 4 7 1 103 342.423 3 ↓
Hi High (pH 8-9.5) -0.42 1.25 -21.25 3 7 0 101 341.415 3 ↓

Analogs

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Popular Name: (2S,4S)-4-amino-1-(2,3-dimethylquinoxaline-6-carbonyl)-N-ethyl-pyrrolidine-2-carboxamide (2S,4S)-4-amino-1-(2,3-dimethylq…

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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) -0.42 1.54 -68.92 4 7 1 103 342.423 3 ↓
Hi High (pH 8-9.5) -0.42 1.27 -18.14 3 7 0 101 341.415 3 ↓

Parameters Provided:

ring.id = 214504
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 = 214504 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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