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Analogs

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Popular Name: (3S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-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) 1.70 6.97 -59.68 1 6 -1 85 294.356 2 ↓

Analogs

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Popular Name: (3R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-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) 1.70 7.08 -64.22 1 6 -1 85 294.356 2 ↓

Analogs

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Popular Name: (3S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-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) 2.04 7.54 -53.91 1 6 -1 85 308.383 3 ↓

Analogs

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Popular Name: (3R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-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) 2.04 7.57 -63.71 1 6 -1 85 308.383 3 ↓

Analogs

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Popular Name: (2R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)pyrrolidine-2-carboxylic (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) -0.11 6.93 -71.01 1 6 -1 85 280.329 2 ↓

Analogs

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Popular Name: (2S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)pyrrolidine-2-carboxylic (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) -0.11 7.21 -70.54 1 6 -1 85 280.329 2 ↓

Analogs

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Popular Name: (2R,4R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-hydroxy-pyrrolidine-2-carboxylic (2R,4R)-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) -1.02 3.54 -71.49 2 7 -1 106 296.328 2 ↓

Analogs

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Popular Name: (2R,4S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-hydroxy-pyrrolidine-2-carboxylic (2R,4S)-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) -1.02 3.54 -73.16 2 7 -1 106 296.328 2 ↓

Analogs

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Popular Name: (2S,4R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-hydroxy-pyrrolidine-2-carboxylic (2S,4R)-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) -1.02 3.84 -72.68 2 7 -1 106 296.328 2 ↓

Analogs

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Popular Name: (2S,4S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-hydroxy-pyrrolidine-2-carboxylic (2S,4S)-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) -1.02 3.84 -71.1 2 7 -1 106 296.328 2 ↓

Analogs

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Popular Name: (2R,4R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-methoxy-pyrrolidine-2-carboxylic (2R,4R)-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) -0.41 5.8 -70.45 1 7 -1 95 310.355 3 ↓

Analogs

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Popular Name: (2R,4S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-methoxy-pyrrolidine-2-carboxylic (2R,4S)-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) -0.41 5.8 -72.23 1 7 -1 95 310.355 3 ↓

Analogs

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Popular Name: (2S,4R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-methoxy-pyrrolidine-2-carboxylic (2S,4R)-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) -0.41 6.08 -66.95 1 7 -1 95 310.355 3 ↓

Analogs

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Popular Name: (2S,4S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)-4-methoxy-pyrrolidine-2-carboxylic (2S,4S)-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) -0.41 5.92 -69.67 1 7 -1 95 310.355 3 ↓

Analogs

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Popular Name: 2-[(2R)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)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) 1.62 7.3 -64.17 1 6 -1 85 294.356 3 ↓

Analogs

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Popular Name: 2-[(2S)-1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoyl)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) 1.62 7.23 -63.97 1 6 -1 85 294.356 3 ↓

Parameters Provided:

ring.id = 310871
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 = 310871 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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