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Popular Name: (4S)-3-[(3S)-3-methylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3S)-3-methylpyrrolidine…

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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) -1.65 3.6 -79.73 2 5 0 77 244.316 2 ↓

Analogs

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Popular Name: (4S)-3-[(3R)-3-methylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3R)-3-methylpyrrolidine…

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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) -1.65 3.64 -73.27 2 5 0 77 244.316 2 ↓

Analogs

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Popular Name: (4R)-3-[(3S)-3-methylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3S)-3-methylpyrrolidine…

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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) -1.65 4.32 -72.63 2 5 0 77 244.316 2 ↓

Analogs

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Popular Name: (4R)-3-[(3R)-3-methylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3R)-3-methylpyrrolidine…

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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) -1.65 4.29 -79.46 2 5 0 77 244.316 2 ↓

Analogs

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Popular Name: (4S)-3-[(3S)-3-ethylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3S)-3-ethylpyrrolidine-…

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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) -1.32 4.2 -83.26 2 5 0 77 258.343 3 ↓

Analogs

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Popular Name: (4S)-3-[(3R)-3-ethylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3R)-3-ethylpyrrolidine-…

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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) -1.32 4.18 -71.12 2 5 0 77 258.343 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-[(3S)-3-ethylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3S)-3-ethylpyrrolidine-…

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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) -1.32 4.61 -71.97 2 5 0 77 258.343 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-[(3R)-3-ethylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3R)-3-ethylpyrrolidine-…

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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) -1.32 4.39 -76.66 2 5 0 77 258.343 3 ↓

Analogs

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Popular Name: (4S)-3-[(3S)-3-propylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3S)-3-propylpyrrolidine…

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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) -0.76 4.96 -83.98 2 5 0 77 272.37 4 ↓

Analogs

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Popular Name: (4S)-3-[(3R)-3-propylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4S)-3-[(3R)-3-propylpyrrolidine…

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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) -0.76 4.96 -71.26 2 5 0 77 272.37 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-[(3S)-3-propylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3S)-3-propylpyrrolidine…

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) -0.76 5.38 -72.15 2 5 0 77 272.37 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-3-[(3R)-3-propylpyrrolidine-3-carbonyl]thiazolidine-4-carboxylic (4R)-3-[(3R)-3-propylpyrrolidine…

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) -0.76 5.17 -77.12 2 5 0 77 272.37 4 ↓

Parameters Provided:

ring.id = 303152
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 = 303152 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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