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

Analogs

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Popular Name: 1-[2-(2,5,6-trimethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-4-carboxamide 1-[2-(2,5,6-trimethylthieno[3,2-…

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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) 1.56 5.09 -17.58 2 6 0 89 378.523 4 ↓

Analogs

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Popular Name: (3R)-1-[2-(6-ethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-3-carboxylic (3R)-1-[2-(6-ethylthieno[3,2-e]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) 2.18 8.71 -56.07 0 6 -1 86 364.472 5 ↓

Analogs

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Popular Name: (3S)-1-[2-(6-ethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-3-carboxylic (3S)-1-[2-(6-ethylthieno[3,2-e]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) 2.18 8.73 -56.04 0 6 -1 86 364.472 5 ↓

Analogs

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Popular Name: (2R)-1-[2-(6-ethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-2-carboxylic (2R)-1-[2-(6-ethylthieno[3,2-e]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) 0.85 9.75 -66.53 0 6 -1 86 364.472 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[2-(6-ethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-2-carboxylic (2S)-1-[2-(6-ethylthieno[3,2-e]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) 0.85 9.68 -66.23 0 6 -1 86 364.472 5 ↓

Analogs

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Popular Name: (3R)-1-[2-(5,6-dimethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-3-carboxylic (3R)-1-[2-(5,6-dimethylthieno[3,…

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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) 1.99 8.23 -56.32 0 6 -1 86 364.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[2-(5,6-dimethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-3-carboxylic (3S)-1-[2-(5,6-dimethylthieno[3,…

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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) 1.99 8.18 -56.3 0 6 -1 86 364.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[2-(5,6-dimethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-2-carboxylic (2R)-1-[2-(5,6-dimethylthieno[3,…

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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) 0.65 9.08 -65.5 0 6 -1 86 364.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[2-(5,6-dimethylthieno[3,2-e]pyrimidin-4-yl)sulfanylacetyl]piperidine-2-carboxylic (2S)-1-[2-(5,6-dimethylthieno[3,…

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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) 0.65 9.03 -65.16 0 6 -1 86 364.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-(2-thieno[3,2-e]pyrimidin-4-ylsulfanylacetyl)piperidine-3-carboxylic (3R)-1-(2-thieno[3,2-e]pyrimidin…

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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) 1.39 7.12 -56.57 0 6 -1 86 336.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-(2-thieno[3,2-e]pyrimidin-4-ylsulfanylacetyl)piperidine-3-carboxylic (3S)-1-(2-thieno[3,2-e]pyrimidin…

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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) 1.39 7.13 -56.61 0 6 -1 86 336.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-thieno[3,2-e]pyrimidin-4-ylsulfanylacetyl)piperidine-4-carboxylic 1-(2-thieno[3,2-e]pyrimidin-4-yl…

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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) 1.39 7.12 -52.64 0 6 -1 86 336.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-(2-thieno[3,2-e]pyrimidin-4-ylsulfanylacetyl)piperidine-2-carboxylic (2S)-1-(2-thieno[3,2-e]pyrimidin…

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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) 0.05 8.08 -66.55 0 6 -1 86 336.418 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-(2-thieno[3,2-e]pyrimidin-4-ylsulfanylacetyl)piperidine-2-carboxylic (2R)-1-(2-thieno[3,2-e]pyrimidin…

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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) 0.05 8.15 -66.82 0 6 -1 86 336.418 4 ↓

Parameters Provided:

ring.id = 99461
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 = 99461 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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