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Analogs

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Popular Name: (3S)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-methyl-pyrrolidine-3-carboxylic (3S)-1-(5,6-dihydro-4H-cyclopent…

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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) 1.92 7.55 -51.13 0 4 -1 60 278.353 2 ↓

Analogs

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Popular Name: (3R)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-methyl-pyrrolidine-3-carboxylic (3R)-1-(5,6-dihydro-4H-cyclopent…

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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) 1.92 7.73 -48.99 0 4 -1 60 278.353 2 ↓

Analogs

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Popular Name: (3S)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.26 8.21 -43.78 0 4 -1 60 292.38 3 ↓

Analogs

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Popular Name: (3R)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-ethyl-pyrrolidine-3-carboxylic (3R)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.26 8.22 -48.46 0 4 -1 60 292.38 3 ↓

Analogs

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Popular Name: (3S)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-propyl-pyrrolidine-3-carboxylic (3S)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.82 8.97 -44.03 0 4 -1 60 306.407 4 ↓

Analogs

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Popular Name: (3R)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-3-propyl-pyrrolidine-3-carboxylic (3R)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.82 8.98 -48.73 0 4 -1 60 306.407 4 ↓

Analogs

41826899
41826899

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Popular Name: (2R)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carb (2R)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.35 6.27 -15.9 1 4 0 49 346.374 4 ↓

Analogs

41826897
41826897

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Popular Name: (2S)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carb (2S)-1-(5,6-dihydro-4H-cyclopent…

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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) 2.35 6.24 -16.15 1 4 0 49 346.374 4 ↓

Analogs

36753422
36753422

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Popular Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(pyrrolidin-1-yl)methanone 5,6-dihydro-4H-cyclopenta[b]thio…

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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) 2.34 6.75 -9.67 0 2 0 20 221.325 1 ↓

Analogs

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Popular Name: 2-[(2R)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)pyrrolidin-2-yl]acetic 2-[(2R)-1-(5,6-dihydro-4H-cyclop…

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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 7.88 -55.21 0 4 -1 60 278.353 3 ↓

Analogs

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Popular Name: 2-[(2S)-1-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)pyrrolidin-2-yl]acetic 2-[(2S)-1-(5,6-dihydro-4H-cyclop…

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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 7.95 -55.33 0 4 -1 60 278.353 3 ↓

Analogs

42433622
42433622

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Popular Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone 5,6-dihydro-4H-cyclopenta[b]thio…

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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) 1.69 5.67 -12.43 1 3 0 41 251.351 2 ↓

Analogs

42433621
42433621

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Popular Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone 5,6-dihydro-4H-cyclopenta[b]thio…

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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) 1.69 5.66 -12.46 1 3 0 41 251.351 2 ↓

Parameters Provided:

ring.id = 307068
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 = 307068 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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